*HEADER    IMMUNE SYSTEM                           17-MAR-09   2WCY
*TITLE     NMR SOLUTION STRUCTURE OF FACTOR I-LIKE MODULES OF
*TITLE    2 COMPLEMENT C7.
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: COMPLEMENT COMPONENT C7;
*COMPND   3 CHAIN: A;
*COMPND   4 FRAGMENT: FACTOR I-LIKE MODULES (FIMS), RESIDUES 693-843;
*COMPND   5 ENGINEERED: YES;
*COMPND   6 OTHER_DETAILS: N TERMINAL CLONING ARTEFACT GSHM
*SOURCE    MOL_ID: 1;
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;
*SOURCE   3 ORGANISM_COMMON: HUMAN;
*SOURCE   4 ORGANISM_TAXID: 9606;
*SOURCE   5 TISSUE: BLOOD;
*SOURCE   6 CELLULAR_LOCATION: EXTRACELLULAR;
*SOURCE   7 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   8 EXPRESSION_SYSTEM_TAXID: 562;
*SOURCE   9 EXPRESSION_SYSTEM_STRAIN: ORIGAMI B;
*SOURCE  10 EXPRESSION_SYSTEM_VECTOR: PET15B;
*SOURCE  11 OTHER_DETAILS: COMPONENT OF HUMAN COMPLEMENT SYSTEM
*KEYWDS    IMMUNE SYSTEM, DISULFIDE BOND, IMMUNE RESPONSE, FACTOR I
*KEYWDS   2 MODULE, C7, FIM, EGF, MAC, FOLN, SUSHI, FIMAC, KAZAL,
*KEYWDS   3 COMPLEMENT ALTERNATE PATHWAY, FOLLISTATIN, POLYMORPHISM,
*KEYWDS   4 GLYCOPROTEIN, SECRETED, DISULFIDE, CYTOLYSIS, COMPLEMENT,
*KEYWDS   5 COMPLEMENT PATHWAY, MEMBRANE ATTACK COMPLEX, INNATE
*KEYWDS   6 IMMUNITY, EGF-LIKE DOMAIN, DISEASE MUTATION
*EXPDTA    SOLUTION NMR
*AUTHOR    M.M.PHELAN,C.T.THAI,D.C.SOARES,R.T.OGATA,P.N.BARLOW,
*AUTHOR   2 J.BRAMHAM
*REVDAT   1   09-APR-09 2WCY    0




!C7-FIMs numbered 1-155, renumbered 689-843 in final structures

! NOE constraints generated from CYANA

 assi 
   (( resid 77   and name  HN  ))
   (( resid 77   and name  HB2 ))

      2.465     0.665     0.665
 assi 
   (( resid 77   and name  HN  ))
   (( resid 77   and name  HB1 ))

      2.735     0.935     0.935
 assi 
   (  resid 76   and name  HG2#)
   (( resid 77   and name  HN  ))

      2.660     0.860     0.860
 assi 
   (( resid 77   and name  HN  ))
   (  resid 77   and name  HD2#)

      3.140     1.340     1.340
 assi 
   (( resid 77   and name  HN  ))
   (  resid 77   and name  HD1#)

      2.810     1.010     1.010
 assi 
   (( resid 76   and name  HA  ))
   (( resid 77   and name  HN  ))

      2.370     0.570     0.570
 assi 
   (( resid 76   and name  HB  ))
   (( resid 77   and name  HN  ))

      3.240     1.440     1.440
 assi 
   (( resid 77   and name  HN  ))
   (( resid 78   and name  HD2 ))

      3.385     1.585     1.585
 assi 
   (( resid 77   and name  HN  ))
   (( resid 78   and name  HD1 ))

      3.445     1.645     1.645
 assi 
   (( resid 51   and name  HB1 ))
   (( resid 77   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 37   and name  HN  ))
   (( resid 54   and name  HB  ))

      3.250     1.450     1.450
 assi 
   (( resid 37   and name  HN  ))
   (( resid 37   and name  HB1 ))

      2.925     1.125     1.125
 assi 
   (( resid 37   and name  HN  ))
   (( resid 37   and name  HG  ))

      3.095     1.295     1.295
 assi 
   (( resid 37   and name  HN  ))
   (( resid 37   and name  HB2 ))

      2.805     1.005     1.005
 assi 
   (( resid 37   and name  HN  ))
   (  resid 54   and name  HG1#)

      3.150     1.350     1.350
 assi 
   (( resid 37   and name  HN  ))
   (  resid 37   and name  HD1#)

      3.470     1.670     1.670
 assi 
   (( resid 37   and name  HN  ))
   (  resid 37   and name  HD2#)

      3.470     1.670     1.670
 assi 
   (( resid 36   and name  HB1 ))
   (( resid 37   and name  HN  ))

      3.290     1.490     1.490
 assi 
   (( resid 37   and name  HN  ))
   (( resid 54   and name  HN  ))

      2.900     1.100     1.100
 assi 
   (( resid 36   and name  HN  ))
   (( resid 37   and name  HN  ))

      3.240     1.440     1.440
 assi 
   (( resid 37   and name  HN  ))
   (( resid 38   and name  HN  ))

      3.435     1.635     1.635
 assi 
   (( resid 43   and name  HN  ))
   (  resid 50   and name  HD1#)

      3.320     1.520     1.520
 assi 
   (( resid 43   and name  HN  ))
   (( resid 43   and name  HB1 ))

      2.775     0.975     0.975
 assi 
   (( resid 43   and name  HN  ))
   (( resid 43   and name  HB2 ))

      2.775     0.975     0.975
 assi 
   (( resid 43   and name  HN  ))
   (( resid 47   and name  HA  ))

      3.190     1.390     1.390
 assi 
   (( resid 42   and name  HA  ))
   (( resid 43   and name  HN  ))

      2.645     0.845     0.845
 assi 
   (( resid 43   and name  HN  ))
   (( resid 49   and name  HA  ))

      3.005     1.205     1.205
 assi 
   (( resid 43   and name  HN  ))
   (( resid 44   and name  HN  ))

      3.430     1.630     1.630
 assi 
   (( resid 43   and name  HN  ))
   (( resid 47   and name  HN  ))

      3.590     1.790     1.790
 assi 
   (  resid 154  and name  HG2#)
   (( resid 155  and name  HN  ))

      3.095     1.295     1.295
 assi 
   (( resid 155  and name  HN  ))
   (( resid 155  and name  HG2 ))

      3.470     1.670     1.670
 assi 
   (( resid 155  and name  HN  ))
   (( resid 155  and name  HG1 ))

      3.470     1.670     1.670
 assi 
   (( resid 154  and name  HA  ))
   (( resid 155  and name  HN  ))

      2.490     0.690     0.690
 assi 
   (( resid 21   and name  HN  ))
   (( resid 21   and name  HG2 ))

      3.025     1.225     1.225
 assi 
   (( resid 21   and name  HN  ))
   (( resid 21   and name  HB1 ))

      2.750     0.950     0.950
 assi 
   (( resid 21   and name  HN  ))
   (( resid 21   and name  HB2 ))

      2.925     1.125     1.125
 assi 
   (( resid 21   and name  HN  ))
   (( resid 24   and name  HG1 ))

      2.780     0.980     0.980
 assi 
   (( resid 20   and name  HG  ))
   (( resid 21   and name  HN  ))

      2.925     1.125     1.125
 assi 
   (( resid 21   and name  HN  ))
   (  resid 26   and name  HG1#)

      2.950     1.150     1.150
 assi 
   (( resid 21   and name  HN  ))
   (  resid 26   and name  HG2#)

      2.850     1.050     1.050
 assi 
   (( resid 21   and name  HN  ))
   (( resid 25   and name  HA  ))

      2.995     1.195     1.195
 assi 
   (( resid 20   and name  HA  ))
   (( resid 21   and name  HN  ))

      2.475     0.675     0.675
 assi 
   (( resid 21   and name  HN  ))
   (( resid 23   and name  HN  ))

      3.480     1.680     1.680
 assi 
   (( resid 21   and name  HN  ))
   (( resid 25   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 142  and name  HG12))
   (( resid 144  and name  HN  ))

      3.165     1.365     1.365
 assi 
   (( resid 144  and name  HN  ))
   (( resid 144  and name  HB  ))

      2.620     0.820     0.820
 assi 
   (( resid 131  and name  HA  ))
   (( resid 134  and name  HN  ))

      2.970     1.170     1.170
 assi 
   (( resid 81   and name  HN  ))
   (  resid 81   and name  HB# )

      2.425     0.625     0.625
 assi 
   (( resid 39   and name  HN  ))
   (( resid 52   and name  HN  ))

      2.950     1.150     1.150
 assi 
   (( resid 51   and name  HA  ))
   (( resid 52   and name  HN  ))

      2.505     0.705     0.705
 assi 
   (( resid 52   and name  HN  ))
   (( resid 53   and name  HN  ))

      3.225     1.425     1.425
 assi 
   (( resid 52   and name  HN  ))
   (( resid 52   and name  HB2 ))

      2.765     0.965     0.965
 assi 
   (( resid 52   and name  HN  ))
   (  resid 77   and name  HD1#)

      2.895     1.095     1.095
 assi 
   (  resid 39   and name  HG2#)
   (( resid 52   and name  HN  ))

      2.860     1.060     1.060
 assi 
   (( resid 51   and name  HB2 ))
   (( resid 52   and name  HN  ))

      2.765     0.965     0.965
 assi 
   (( resid 121  and name  HN  ))
   (( resid 122  and name  HN  ))

      2.740     0.940     0.940
 assi 
   (( resid 121  and name  HN  ))
   (( resid 121  and name  HD21))

      3.275     1.475     1.475
 assi 
   (  resid 120  and name  HG2#)
   (( resid 121  and name  HN  ))

      2.990     1.190     1.190
 assi 
   (( resid 121  and name  HN  ))
   (( resid 121  and name  HB2 ))

      2.950     1.150     1.150
 assi 
   (( resid 121  and name  HN  ))
   (( resid 122  and name  HA2 ))

      3.530     1.730     1.730
 assi 
   (( resid 120  and name  HA  ))
   (( resid 121  and name  HN  ))

      2.345     0.545     0.545
 assi 
   (( resid 21   and name  HB2 ))
   (( resid 22   and name  HN  ))

      3.115     1.315     1.315
 assi 
   (( resid 120  and name  HB  ))
   (( resid 121  and name  HN  ))

      3.020     1.220     1.220
 assi 
   (( resid 118  and name  HN  ))
   (( resid 125  and name  HN  ))

      2.670     0.870     0.870
 assi 
   (( resid 118  and name  HN  ))
   (( resid 150  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 117  and name  HA  ))
   (( resid 118  and name  HN  ))

      2.440     0.640     0.640
 assi 
   (( resid 118  and name  HN  ))
   (( resid 144  and name  HA  ))

      3.380     1.580     1.580
 assi 
   (( resid 116  and name  HG12))
   (( resid 118  and name  HN  ))

      3.385     1.585     1.585
 assi 
   (( resid 118  and name  HN  ))
   (  resid 126  and name  HG2#)

      3.635     1.835     1.835
 assi 
   (( resid 117  and name  HB2 ))
   (( resid 118  and name  HN  ))

      3.195     1.395     1.395
 assi 
   (( resid 117  and name  HB1 ))
   (( resid 118  and name  HN  ))

      3.365     1.565     1.565
 assi 
   (( resid 118  and name  HN  ))
   (( resid 125  and name  HG2 ))

      3.440     1.640     1.640
 assi 
   (( resid 118  and name  HN  ))
   (( resid 118  and name  HB  ))

      2.645     0.845     0.845
 assi 
   (( resid 120  and name  HN  ))
   (( resid 123  and name  HN  ))

      2.750     0.950     0.950
 assi 
   (( resid 120  and name  HN  ))
   (( resid 122  and name  HN  ))

      3.155     1.355     1.355
 assi 
   (( resid 120  and name  HN  ))
   (( resid 121  and name  HN  ))

      3.215     1.415     1.415
 assi 
   (( resid 120  and name  HN  ))
   (( resid 125  and name  HN  ))

      2.930     1.130     1.130
 assi 
   (( resid 120  and name  HN  ))
   (( resid 124  and name  HA  ))

      2.740     0.940     0.940
 assi 
   (( resid 120  and name  HN  ))
   (  resid 120  and name  HG1#)

      2.930     1.130     1.130
 assi 
   (( resid 120  and name  HN  ))
   (( resid 120  and name  HB  ))

      2.585     0.785     0.785
 assi 
   (( resid 119  and name  HG2 ))
   (( resid 120  and name  HN  ))

      2.635     0.835     0.835
 assi 
   (( resid 126  and name  HA  ))
   (( resid 127  and name  HN  ))

      2.460     0.660     0.660
 assi 
   (( resid 115  and name  HA  ))
   (( resid 127  and name  HN  ))

      3.505     1.705     1.705
 assi 
   (( resid 127  and name  HN  ))
   (( resid 149  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 127  and name  HN  ))
   (( resid 127  and name  HG1 ))

      3.105     1.305     1.305
 assi 
   (( resid 127  and name  HN  ))
   (  resid 127  and name  HE# )

      3.305     1.505     1.505
 assi 
   (  resid 126  and name  HG2#)
   (( resid 127  and name  HN  ))

      2.560     0.760     0.760
 assi 
   (  resid 116  and name  HD1#)
   (( resid 127  and name  HN  ))

      3.160     1.360     1.360
 assi 
   (( resid 124  and name  HN  ))
   (( resid 125  and name  HN  ))

      3.140     1.340     1.340
 assi 
   (( resid 123  and name  HN  ))
   (( resid 124  and name  HN  ))

      3.165     1.365     1.365
 assi 
   (( resid 123  and name  HA  ))
   (( resid 124  and name  HN  ))

      2.500     0.700     0.700
 assi 
   (( resid 124  and name  HN  ))
   (( resid 124  and name  HG1 ))

      3.025     1.225     1.225
 assi 
   (( resid 124  and name  HN  ))
   (( resid 124  and name  HB2 ))

      2.430     0.630     0.630
 assi 
   (( resid 109  and name  HA  ))
   (( resid 110  and name  HN  ))

      2.645     0.845     0.845
 assi 
   (( resid 78   and name  HB2 ))
   (( resid 79   and name  HN  ))

      2.710     0.910     0.910
 assi 
   (( resid 110  and name  HN  ))
   (( resid 110  and name  HB2 ))

      2.890     1.090     1.090
 assi 
   (( resid 110  and name  HN  ))
   (( resid 110  and name  HG2 ))

      3.505     1.705     1.705
 assi 
   (( resid 110  and name  HN  ))
   (( resid 110  and name  HG1 ))

      3.505     1.705     1.705
 assi 
   (( resid 79   and name  HN  ))
   (  resid 79   and name  HB# )

      2.295     0.495     0.495
 assi 
   (( resid 118  and name  HN  ))
   (( resid 119  and name  HN  ))

      3.300     1.500     1.500
 assi 
   (( resid 119  and name  HN  ))
   (( resid 144  and name  HN  ))

      3.470     1.670     1.670
 assi 
   (( resid 119  and name  HN  ))
   (( resid 120  and name  HN  ))

      3.260     1.460     1.460
 assi 
   (( resid 119  and name  HN  ))
   (( resid 119  and name  HB2 ))

      2.720     0.920     0.920
 assi 
   (( resid 119  and name  HN  ))
   (( resid 119  and name  HB1 ))

      2.590     0.790     0.790
 assi 
   (( resid 118  and name  HA  ))
   (( resid 119  and name  HN  ))

      2.565     0.765     0.765
 assi 
   (( resid 119  and name  HN  ))
   (( resid 144  and name  HA  ))

      2.935     1.135     1.135
 assi 
   (( resid 119  and name  HN  ))
   (( resid 143  and name  HB1 ))

      3.010     1.210     1.210
 assi 
   (( resid 105  and name  HN  ))
   (( resid 106  and name  HN  ))

      3.320     1.520     1.520
 assi 
   (( resid 106  and name  HN  ))
   (( resid 107  and name  HA  ))

      3.440     1.640     1.640
 assi 
   (( resid 105  and name  HA  ))
   (( resid 106  and name  HN  ))

      2.480     0.680     0.680
 assi 
   (( resid 105  and name  HB1 ))
   (( resid 106  and name  HN  ))

      2.730     0.930     0.930
 assi 
   (( resid 105  and name  HB2 ))
   (( resid 106  and name  HN  ))

      2.730     0.930     0.930
 assi 
   (( resid 106  and name  HN  ))
   (  resid 106  and name  HB# )

      2.405     0.605     0.605
 assi 
   (( resid 87   and name  HN  ))
   (( resid 88   and name  HN  ))

      2.905     1.105     1.105
 assi 
   (( resid 87   and name  HN  ))
   (  resid 87   and name  HB# )

      2.635     0.835     0.835
 assi 
   (( resid 49   and name  HN  ))
   (( resid 50   and name  HN  ))

      3.270     1.470     1.470
 assi 
   (( resid 8    and name  HA  ))
   (( resid 9    and name  HN  ))

      2.700     0.900     0.900
 assi 
   (( resid 84   and name  HN  ))
   (( resid 85   and name  HN  ))

      3.220     1.420     1.420
 assi 
   (( resid 83   and name  HA  ))
   (( resid 84   and name  HN  ))

      2.425     0.625     0.625
 assi 
   (( resid 83   and name  HB1 ))
   (( resid 84   and name  HN  ))

      2.570     0.770     0.770
 assi 
   (( resid 84   and name  HN  ))
   (  resid 84   and name  HB# )

      2.365     0.565     0.565
 assi 
   (( resid 146  and name  HA  ))
   (( resid 148  and name  HN  ))

      2.890     1.090     1.090
 assi 
   (( resid 146  and name  HB2 ))
   (( resid 148  and name  HN  ))

      3.045     1.245     1.245
 assi 
   (( resid 117  and name  HB1 ))
   (( resid 148  and name  HN  ))

      3.285     1.485     1.485
 assi 
   (( resid 148  and name  HN  ))
   (( resid 148  and name  HB1 ))

      2.850     1.050     1.050
 assi 
   (( resid 148  and name  HN  ))
   (( resid 148  and name  HB2 ))

      2.850     1.050     1.050
 assi 
   (( resid 148  and name  HN  ))
   (( resid 148  and name  HG2 ))

      3.130     1.330     1.330
 assi 
   (  resid 147  and name  HG2#)
   (( resid 148  and name  HN  ))

      3.155     1.355     1.355
 assi 
   (( resid 67   and name  HN  ))
   (( resid 68   and name  HN  ))

      3.265     1.465     1.465
 assi 
   (( resid 61   and name  HD2 ))
   (( resid 67   and name  HN  ))

      3.185     1.385     1.385
 assi 
   (( resid 67   and name  HN  ))
   (  resid 67   and name  HD# )

      2.780     0.980     0.980
 assi 
   (( resid 67   and name  HN  ))
   (  resid 67   and name  HE# )

      3.650     1.850     1.850
 assi 
   (( resid 66   and name  HA  ))
   (( resid 67   and name  HN  ))

      2.610     0.810     0.810
 assi 
   (( resid 67   and name  HN  ))
   (( resid 67   and name  HB2 ))

      2.670     0.870     0.870
 assi 
   (( resid 67   and name  HN  ))
   (( resid 67   and name  HB1 ))

      2.885     1.085     1.085
 assi 
   (( resid 148  and name  HN  ))
   (( resid 148  and name  HG1 ))

      3.130     1.330     1.330
 assi 
   (( resid 125  and name  HN  ))
   (( resid 126  and name  HN  ))

      3.245     1.445     1.445
 assi 
   (( resid 126  and name  HN  ))
   (( resid 127  and name  HN  ))

      3.155     1.355     1.355
 assi 
   (( resid 126  and name  HN  ))
   (( resid 150  and name  HN  ))

      3.335     1.535     1.535
 assi 
   (( resid 125  and name  HA  ))
   (( resid 126  and name  HN  ))

      2.490     0.690     0.690
 assi 
   (( resid 126  and name  HN  ))
   (( resid 126  and name  HB  ))

      2.500     0.700     0.700
 assi 
   (( resid 126  and name  HN  ))
   (( resid 127  and name  HG2 ))

      3.500     1.700     1.700
 assi 
   (( resid 125  and name  HG2 ))
   (( resid 126  and name  HN  ))

      2.960     1.160     1.160
 assi 
   (( resid 125  and name  HB2 ))
   (( resid 126  and name  HN  ))

      2.890     1.090     1.090
 assi 
   (( resid 41   and name  HN  ))
   (( resid 52   and name  HN  ))

      3.020     1.220     1.220
 assi 
   (( resid 40   and name  HA  ))
   (( resid 41   and name  HN  ))

      2.470     0.670     0.670
 assi 
   (( resid 40   and name  HB2 ))
   (( resid 41   and name  HN  ))

      3.285     1.485     1.485
 assi 
   (( resid 40   and name  HB1 ))
   (( resid 41   and name  HN  ))

      2.970     1.170     1.170
 assi 
   (( resid 41   and name  HN  ))
   (( resid 50   and name  HG  ))

      3.250     1.450     1.450
 assi 
   (( resid 41   and name  HN  ))
   (  resid 41   and name  HB# )

      2.680     0.880     0.880
 assi 
   (( resid 41   and name  HN  ))
   (  resid 49   and name  HG2#)

      2.745     0.945     0.945
 assi 
   (  resid 39   and name  HG2#)
   (( resid 41   and name  HN  ))

      3.475     1.675     1.675
 assi 
   (( resid 41   and name  HN  ))
   (  resid 52   and name  HD1#)

      3.565     1.765     1.765
 assi 
   (( resid 83   and name  HN  ))
   (( resid 83   and name  HB2 ))

      2.665     0.865     0.865
 assi 
   (( resid 152  and name  HN  ))
   (( resid 153  and name  HN  ))

      2.850     1.050     1.050
 assi 
   (( resid 151  and name  HA  ))
   (( resid 152  and name  HN  ))

      2.600     0.800     0.800
 assi 
   (( resid 150  and name  HB1 ))
   (( resid 152  and name  HN  ))

      3.075     1.275     1.275
 assi 
   (( resid 150  and name  HB2 ))
   (( resid 152  and name  HN  ))

      3.075     1.275     1.275
 assi 
   (( resid 152  and name  HN  ))
   (  resid 152  and name  HB# )

      2.230     0.430     0.430
 assi 
   (( resid 20   and name  HN  ))
   (( resid 21   and name  HN  ))

      3.095     1.295     1.295
 assi 
   (( resid 19   and name  HA  ))
   (( resid 20   and name  HN  ))

      2.490     0.690     0.690
 assi 
   (( resid 20   and name  HN  ))
   (( resid 20   and name  HB1 ))

      2.530     0.730     0.730
 assi 
   (( resid 20   and name  HN  ))
   (( resid 20   and name  HB2 ))

      2.530     0.730     0.730
 assi 
   (  resid 39   and name  HG1#)
   (( resid 54   and name  HN  ))

      3.045     1.245     1.245
 assi 
   (( resid 117  and name  HA  ))
   (( resid 125  and name  HN  ))

      3.580     1.780     1.780
 assi 
   (( resid 124  and name  HA  ))
   (( resid 125  and name  HN  ))

      2.460     0.660     0.660
 assi 
   (( resid 125  and name  HN  ))
   (( resid 125  and name  HB2 ))

      2.625     0.825     0.825
 assi 
   (( resid 59   and name  HA  ))
   (( resid 62   and name  HN  ))

      2.830     1.030     1.030
 assi 
   (( resid 62   and name  HN  ))
   (( resid 63   and name  HG1 ))

      3.650     1.850     1.850
 assi 
   (( resid 58   and name  HB1 ))
   (( resid 62   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 62   and name  HN  ))
   (( resid 63   and name  HG2 ))

      3.650     1.850     1.850
 assi 
   (  resid 59   and name  HG1#)
   (( resid 62   and name  HN  ))

      3.505     1.705     1.705
 assi 
   (( resid 62   and name  HN  ))
   (( resid 63   and name  HN  ))

      2.730     0.930     0.930
 assi 
   (( resid 17   and name  HD1 ))
   (( resid 62   and name  HN  ))

      3.330     1.530     1.530
 assi 
   (( resid 103  and name  HN  ))
   (( resid 104  and name  HN  ))

      3.155     1.355     1.355
 assi 
   (( resid 103  and name  HB1 ))
   (( resid 104  and name  HN  ))

      3.180     1.380     1.380
 assi 
   (( resid 103  and name  HB2 ))
   (( resid 104  and name  HN  ))

      3.180     1.380     1.380
 assi 
   (( resid 72   and name  HN  ))
   (( resid 73   and name  HN  ))

      2.670     0.870     0.870
 assi 
   (( resid 71   and name  HA1 ))
   (( resid 72   and name  HN  ))

      2.590     0.790     0.790
 assi 
   (( resid 71   and name  HA2 ))
   (( resid 72   and name  HN  ))

      2.590     0.790     0.790
 assi 
   (( resid 72   and name  HN  ))
   (( resid 72   and name  HB1 ))

      2.605     0.805     0.805
 assi 
   (( resid 72   and name  HN  ))
   (( resid 72   and name  HB2 ))

      2.830     1.030     1.030
 assi 
   (( resid 142  and name  HN  ))
   (( resid 142  and name  HB  ))

      2.950     1.150     1.150
 assi 
   (( resid 142  and name  HN  ))
   (( resid 142  and name  HG12))

      2.795     0.995     0.995
 assi 
   (( resid 142  and name  HN  ))
   (  resid 142  and name  HG2#)

      2.695     0.895     0.895
 assi 
   (( resid 38   and name  HN  ))
   (( resid 91   and name  HH2 ))

      3.075     1.275     1.275
 assi 
   (( resid 37   and name  HA  ))
   (( resid 38   and name  HN  ))

      2.570     0.770     0.770
 assi 
   (( resid 38   and name  HN  ))
   (( resid 38   and name  HB1 ))

      2.930     1.130     1.130
 assi 
   (( resid 37   and name  HB1 ))
   (( resid 38   and name  HN  ))

      2.890     1.090     1.090
 assi 
   (( resid 75   and name  HN  ))
   (( resid 76   and name  HN  ))

      3.180     1.380     1.380
 assi 
   (( resid 74   and name  HB1 ))
   (( resid 75   and name  HN  ))

      3.075     1.275     1.275
 assi 
   (( resid 40   and name  HB1 ))
   (( resid 75   and name  HN  ))

      3.125     1.325     1.325
 assi 
   (( resid 73   and name  HA  ))
   (( resid 75   and name  HN  ))

      3.480     1.680     1.680
 assi 
   (( resid 74   and name  HB2 ))
   (( resid 75   and name  HN  ))

      3.075     1.275     1.275
 assi 
   (( resid 75   and name  HN  ))
   (( resid 75   and name  HB1 ))

      2.855     1.055     1.055
 assi 
   (( resid 75   and name  HN  ))
   (( resid 75   and name  HB2 ))

      2.915     1.115     1.115
 assi 
   (  resid 49   and name  HD1#)
   (( resid 75   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 66   and name  HN  ))
   (( resid 67   and name  HN  ))

      3.110     1.310     1.310
 assi 
   (( resid 66   and name  HN  ))
   (( resid 66   and name  HD21))

      3.095     1.295     1.295
 assi 
   (( resid 66   and name  HN  ))
   (( resid 66   and name  HD22))

      3.140     1.340     1.340
 assi 
   (( resid 66   and name  HN  ))
   (  resid 67   and name  HE# )

      3.165     1.365     1.365
 assi 
   (( resid 65   and name  HA  ))
   (( resid 66   and name  HN  ))

      2.430     0.630     0.630
 assi 
   (( resid 66   and name  HN  ))
   (( resid 66   and name  HB2 ))

      2.520     0.720     0.720
 assi 
   (( resid 65   and name  HB1 ))
   (( resid 66   and name  HN  ))

      2.765     0.965     0.965
 assi 
   (( resid 44   and name  HB2 ))
   (( resid 66   and name  HN  ))

      3.080     1.280     1.280
 assi 
   (( resid 65   and name  HB2 ))
   (( resid 66   and name  HN  ))

      3.150     1.350     1.350
 assi 
   (( resid 131  and name  HN  ))
   (( resid 132  and name  HN  ))

      2.710     0.910     0.910
 assi 
   (( resid 130  and name  HN  ))
   (( resid 131  and name  HN  ))

      2.765     0.965     0.965
 assi 
   (( resid 131  and name  HN  ))
   (( resid 131  and name  HB2 ))

      2.700     0.900     0.900
 assi 
   (( resid 131  and name  HN  ))
   (( resid 131  and name  HB1 ))

      2.780     0.980     0.980
 assi 
   (  resid 106  and name  HB# )
   (( resid 131  and name  HN  ))

      3.135     1.335     1.335
 assi 
   (( resid 131  and name  HN  ))
   (  resid 134  and name  HB# )

      3.300     1.500     1.500
 assi 
   (( resid 131  and name  HN  ))
   (  resid 132  and name  HB# )

      3.265     1.465     1.465
 assi 
   (( resid 14   and name  HN  ))
   (( resid 15   and name  HN  ))

      3.175     1.375     1.375
 assi 
   (( resid 14   and name  HN  ))
   (( resid 14   and name  HB1 ))

      2.860     1.060     1.060
 assi 
   (( resid 14   and name  HN  ))
   (( resid 14   and name  HB2 ))

      2.860     1.060     1.060
 assi 
   (( resid 13   and name  HA  ))
   (( resid 14   and name  HN  ))

      2.330     0.530     0.530
 assi 
   (( resid 59   and name  HN  ))
   (( resid 60   and name  HN  ))

      2.830     1.030     1.030
 assi 
   (( resid 60   and name  HN  ))
   (( resid 61   and name  HN  ))

      2.825     1.025     1.025
 assi 
   (( resid 56   and name  HA  ))
   (( resid 60   and name  HN  ))

      2.975     1.175     1.175
 assi 
   (( resid 59   and name  HB  ))
   (( resid 60   and name  HN  ))

      2.945     1.145     1.145
 assi 
   (( resid 60   and name  HN  ))
   (( resid 60   and name  HB1 ))

      2.795     0.995     0.995
 assi 
   (( resid 60   and name  HN  ))
   (( resid 60   and name  HB2 ))

      2.795     0.995     0.995
 assi 
   (  resid 59   and name  HG2#)
   (( resid 60   and name  HN  ))

      3.000     1.200     1.200
 assi 
   (  resid 59   and name  HG1#)
   (( resid 60   and name  HN  ))

      2.815     1.015     1.015
 assi 
   (( resid 60   and name  HN  ))
   (  resid 60   and name  HD1#)

      3.065     1.265     1.265
 assi 
   (( resid 59   and name  HN  ))
   (( resid 61   and name  HN  ))

      3.150     1.350     1.350
 assi 
   (( resid 59   and name  HN  ))
   (  resid 59   and name  HG2#)

      2.590     0.790     0.790
 assi 
   (( resid 59   and name  HN  ))
   (  resid 59   and name  HG1#)

      2.865     1.065     1.065
 assi 
   (( resid 59   and name  HN  ))
   (( resid 59   and name  HB  ))

      2.690     0.890     0.890
 assi 
   (( resid 17   and name  HB2 ))
   (( resid 59   and name  HN  ))

      2.840     1.040     1.040
 assi 
   (( resid 58   and name  HB2 ))
   (( resid 59   and name  HN  ))

      2.820     1.020     1.020
 assi 
   (( resid 11   and name  HN  ))
   (( resid 11   and name  HB  ))

      2.590     0.790     0.790
 assi 
   (  resid 10   and name  HB# )
   (( resid 11   and name  HN  ))

      2.800     1.000     1.000
 assi 
   (( resid 43   and name  HN  ))
   (( resid 48   and name  HN  ))

      2.855     1.055     1.055
 assi 
   (( resid 47   and name  HN  ))
   (( resid 48   and name  HN  ))

      2.630     0.830     0.830
 assi 
   (( resid 43   and name  HB1 ))
   (( resid 48   and name  HN  ))

      2.955     1.155     1.155
 assi 
   (( resid 43   and name  HB2 ))
   (( resid 48   and name  HN  ))

      2.955     1.155     1.155
 assi 
   (( resid 48   and name  HN  ))
   (  resid 49   and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 110  and name  HN  ))
   (( resid 111  and name  HN  ))

      2.555     0.755     0.755
 assi 
   (( resid 111  and name  HN  ))
   (( resid 111  and name  HB2 ))

      2.710     0.910     0.910
 assi 
   (( resid 111  and name  HN  ))
   (( resid 111  and name  HB1 ))

      2.710     0.910     0.910
 assi 
   (( resid 117  and name  HA  ))
   (( resid 150  and name  HN  ))

      3.115     1.315     1.315
 assi 
   (( resid 126  and name  HA  ))
   (( resid 150  and name  HN  ))

      3.285     1.485     1.485
 assi 
   (( resid 126  and name  HB  ))
   (( resid 150  and name  HN  ))

      2.960     1.160     1.160
 assi 
   (( resid 149  and name  HA  ))
   (( resid 150  and name  HN  ))

      2.490     0.690     0.690
 assi 
   (( resid 150  and name  HN  ))
   (( resid 150  and name  HB1 ))

      2.780     0.980     0.980
 assi 
   (( resid 117  and name  HB2 ))
   (( resid 150  and name  HN  ))

      2.920     1.120     1.120
 assi 
   (( resid 150  and name  HN  ))
   (( resid 150  and name  HB2 ))

      2.780     0.980     0.980
 assi 
   (( resid 149  and name  HB1 ))
   (( resid 150  and name  HN  ))

      2.930     1.130     1.130
 assi 
   (( resid 149  and name  HB2 ))
   (( resid 150  and name  HN  ))

      2.760     0.960     0.960
 assi 
   (  resid 126  and name  HG2#)
   (( resid 150  and name  HN  ))

      2.760     0.960     0.960
 assi 
   (( resid 121  and name  HN  ))
   (( resid 123  and name  HN  ))

      3.200     1.400     1.400
 assi 
   (( resid 122  and name  HN  ))
   (( resid 123  and name  HN  ))

      2.620     0.820     0.820
 assi 
   (( resid 123  and name  HN  ))
   (( resid 124  and name  HA  ))

      3.590     1.790     1.790
 assi 
   (( resid 119  and name  HA  ))
   (( resid 123  and name  HN  ))

      3.550     1.750     1.750
 assi 
   (  resid 120  and name  HG1#)
   (( resid 123  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (  resid 120  and name  HG2#)
   (( resid 123  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 109  and name  HN  ))
   (( resid 109  and name  HB1 ))

      2.795     0.995     0.995
 assi 
   (( resid 121  and name  HB1 ))
   (( resid 123  and name  HN  ))

      2.835     1.035     1.035
 assi 
   (( resid 109  and name  HN  ))
   (( resid 109  and name  HB2 ))

      2.795     0.995     0.995
 assi 
   (( resid 121  and name  HB2 ))
   (( resid 123  and name  HN  ))

      3.035     1.235     1.235
 assi 
   (( resid 108  and name  HB2 ))
   (( resid 109  and name  HN  ))

      3.530     1.730     1.730
 assi 
   (( resid 108  and name  HB1 ))
   (( resid 109  and name  HN  ))

      3.530     1.730     1.730
 assi 
   (( resid 132  and name  HN  ))
   (( resid 133  and name  HA2 ))

      3.650     1.850     1.850
 assi 
   (( resid 132  and name  HN  ))
   (  resid 132  and name  HB# )

      2.505     0.705     0.705
 assi 
   (( resid 131  and name  HB1 ))
   (( resid 132  and name  HN  ))

      2.825     1.025     1.025
 assi 
   (( resid 2    and name  HA  ))
   (( resid 3    and name  HN  ))

      2.435     0.635     0.635
 assi 
   (( resid 27   and name  HN  ))
   (( resid 28   and name  HN  ))

      3.205     1.405     1.405
 assi 
   (( resid 19   and name  HN  ))
   (( resid 28   and name  HN  ))

      3.175     1.375     1.375
 assi 
   (( resid 18   and name  HA  ))
   (( resid 28   and name  HN  ))

      2.975     1.175     1.175
 assi 
   (( resid 27   and name  HB1 ))
   (( resid 28   and name  HN  ))

      3.190     1.390     1.390
 assi 
   (( resid 27   and name  HB2 ))
   (( resid 28   and name  HN  ))

      3.190     1.390     1.390
 assi 
   (( resid 28   and name  HN  ))
   (( resid 28   and name  HB1 ))

      2.930     1.130     1.130
 assi 
   (( resid 28   and name  HN  ))
   (( resid 28   and name  HB2 ))

      2.930     1.130     1.130
 assi 
   (( resid 28   and name  HN  ))
   (  resid 59   and name  HG2#)

      2.920     1.120     1.120
 assi 
   (( resid 28   and name  HN  ))
   (  resid 59   and name  HG1#)

      2.990     1.190     1.190
 assi 
   (( resid 65   and name  HN  ))
   (( resid 66   and name  HN  ))

      3.285     1.485     1.485
 assi 
   (( resid 64   and name  HN  ))
   (( resid 65   and name  HN  ))

      2.515     0.715     0.715
 assi 
   (( resid 12   and name  HA  ))
   (( resid 13   and name  HN  ))

      2.600     0.800     0.800
 assi 
   (( resid 12   and name  HB1 ))
   (( resid 13   and name  HN  ))

      2.780     0.980     0.980
 assi 
   (( resid 117  and name  HN  ))
   (( resid 148  and name  HN  ))

      2.945     1.145     1.145
 assi 
   (( resid 117  and name  HN  ))
   (( resid 127  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 117  and name  HN  ))
   (( resid 145  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 116  and name  HN  ))
   (( resid 117  and name  HN  ))

      3.235     1.435     1.435
 assi 
   (( resid 117  and name  HN  ))
   (( resid 118  and name  HN  ))

      3.255     1.455     1.455
 assi 
   (( resid 117  and name  HN  ))
   (( resid 149  and name  HA  ))

      2.845     1.045     1.045
 assi 
   (( resid 116  and name  HA  ))
   (( resid 117  and name  HN  ))

      2.610     0.810     0.810
 assi 
   (( resid 117  and name  HN  ))
   (( resid 117  and name  HB2 ))

      2.965     1.165     1.165
 assi 
   (( resid 116  and name  HB  ))
   (( resid 117  and name  HN  ))

      2.640     0.840     0.840
 assi 
   (( resid 116  and name  HG12))
   (( resid 117  and name  HN  ))

      2.975     1.175     1.175
 assi 
   (  resid 116  and name  HD1#)
   (( resid 117  and name  HN  ))

      3.235     1.435     1.435
 assi 
   (( resid 15   and name  HN  ))
   (( resid 18   and name  HN  ))

      3.095     1.295     1.295
 assi 
   (( resid 18   and name  HN  ))
   (( resid 28   and name  HN  ))

      3.365     1.565     1.565
 assi 
   (( resid 17   and name  HN  ))
   (( resid 18   and name  HN  ))

      2.610     0.810     0.810
 assi 
   (( resid 18   and name  HN  ))
   (( resid 27   and name  HA  ))

      3.320     1.520     1.520
 assi 
   (( resid 16   and name  HA  ))
   (( resid 18   and name  HN  ))

      2.810     1.010     1.010
 assi 
   (( resid 14   and name  HB1 ))
   (( resid 18   and name  HN  ))

      3.330     1.530     1.530
 assi 
   (( resid 17   and name  HB1 ))
   (( resid 18   and name  HN  ))

      3.235     1.435     1.435
 assi 
   (( resid 14   and name  HB2 ))
   (( resid 18   and name  HN  ))

      3.330     1.530     1.530
 assi 
   (( resid 18   and name  HN  ))
   (( resid 18   and name  HB1 ))

      2.865     1.065     1.065
 assi 
   (( resid 18   and name  HN  ))
   (( resid 18   and name  HB2 ))

      2.800     1.000     1.000
 assi 
   (( resid 24   and name  HN  ))
   (( resid 25   and name  HN  ))

      3.200     1.400     1.400
 assi 
   (( resid 24   and name  HA  ))
   (( resid 25   and name  HN  ))

      2.440     0.640     0.640
 assi 
   (( resid 24   and name  HB2 ))
   (( resid 25   and name  HN  ))

      2.505     0.705     0.705
 assi 
   (( resid 136  and name  HN  ))
   (( resid 137  and name  HN  ))

      2.785     0.985     0.985
 assi 
   (( resid 136  and name  HN  ))
   (( resid 138  and name  HN  ))

      3.285     1.485     1.485
 assi 
   (( resid 138  and name  HN  ))
   (( resid 140  and name  HN  ))

      3.430     1.630     1.630
 assi 
   (( resid 136  and name  HN  ))
   (( resid 136  and name  HE  ))

      3.375     1.575     1.575
 assi 
   (( resid 140  and name  HN  ))
   (( resid 140  and name  HB1 ))

      2.775     0.975     0.975
 assi 
   (( resid 136  and name  HN  ))
   (( resid 136  and name  HB2 ))

      2.880     1.080     1.080
 assi 
   (( resid 136  and name  HN  ))
   (( resid 136  and name  HB1 ))

      2.880     1.080     1.080
 assi 
   (( resid 140  and name  HN  ))
   (( resid 140  and name  HB2 ))

      2.775     0.975     0.975
 assi 
   (( resid 116  and name  HN  ))
   (( resid 129  and name  HN  ))

      3.480     1.680     1.680
 assi 
   (( resid 128  and name  HN  ))
   (( resid 129  and name  HN  ))

      3.635     1.835     1.835
 assi 
   (( resid 114  and name  HA  ))
   (( resid 129  and name  HN  ))

      3.325     1.525     1.525
 assi 
   (( resid 129  and name  HN  ))
   (( resid 129  and name  HB1 ))

      2.860     1.060     1.060
 assi 
   (( resid 129  and name  HN  ))
   (( resid 129  and name  HB2 ))

      2.740     0.940     0.940
 assi 
   (  resid 116  and name  HG2#)
   (( resid 129  and name  HN  ))

      3.265     1.465     1.465
 assi 
   (  resid 116  and name  HD1#)
   (( resid 129  and name  HN  ))

      3.090     1.290     1.290
 assi 
   (( resid 135  and name  HB1 ))
   (( resid 141  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 93   and name  HN  ))
   (( resid 94   and name  HN  ))

      3.110     1.310     1.310
 assi 
   (( resid 94   and name  HN  ))
   (( resid 94   and name  HB1 ))

      2.735     0.935     0.935
 assi 
   (( resid 94   and name  HN  ))
   (( resid 94   and name  HB2 ))

      2.735     0.935     0.935
 assi 
   (( resid 104  and name  HA  ))
   (( resid 105  and name  HN  ))

      2.610     0.810     0.810
 assi 
   (( resid 105  and name  HN  ))
   (( resid 105  and name  HG2 ))

      2.870     1.070     1.070
 assi 
   (( resid 104  and name  HB1 ))
   (( resid 105  and name  HN  ))

      2.675     0.875     0.875
 assi 
   (( resid 152  and name  HA  ))
   (( resid 153  and name  HN  ))

      2.595     0.795     0.795
 assi 
   (( resid 39   and name  HB  ))
   (( resid 40   and name  HN  ))

      2.455     0.655     0.655
 assi 
   (  resid 152  and name  HB# )
   (( resid 153  and name  HN  ))

      2.750     0.950     0.950
 assi 
   (  resid 39   and name  HG1#)
   (( resid 40   and name  HN  ))

      2.885     1.085     1.085
 assi 
   (( resid 40   and name  HN  ))
   (  resid 77   and name  HD1#)

      3.025     1.225     1.225
 assi 
   (  resid 39   and name  HG2#)
   (( resid 40   and name  HN  ))

      2.845     1.045     1.045
 assi 
   (( resid 29   and name  HN  ))
   (( resid 32   and name  HN  ))

      3.220     1.420     1.420
 assi 
   (  resid 31   and name  HD# )
   (( resid 32   and name  HN  ))

      3.105     1.305     1.305
 assi 
   (  resid 31   and name  HE# )
   (( resid 32   and name  HN  ))

      3.570     1.770     1.770
 assi 
   (( resid 31   and name  HN  ))
   (( resid 32   and name  HN  ))

      2.815     1.015     1.015
 assi 
   (( resid 31   and name  HB2 ))
   (( resid 32   and name  HN  ))

      3.260     1.460     1.460
 assi 
   (( resid 32   and name  HN  ))
   (( resid 32   and name  HB2 ))

      2.930     1.130     1.130
 assi 
   (( resid 32   and name  HN  ))
   (( resid 32   and name  HB1 ))

      2.930     1.130     1.130
 assi 
   (( resid 29   and name  HB1 ))
   (( resid 32   and name  HN  ))

      3.040     1.240     1.240
 assi 
   (( resid 29   and name  HB2 ))
   (( resid 32   and name  HN  ))

      3.040     1.240     1.240
 assi 
   (( resid 119  and name  HN  ))
   (( resid 145  and name  HN  ))

      2.900     1.100     1.100
 assi 
   (( resid 118  and name  HN  ))
   (( resid 145  and name  HN  ))

      3.445     1.645     1.645
 assi 
   (( resid 118  and name  HA  ))
   (( resid 145  and name  HN  ))

      2.865     1.065     1.065
 assi 
   (( resid 145  and name  HN  ))
   (( resid 146  and name  HA  ))

      3.550     1.750     1.750
 assi 
   (( resid 144  and name  HA  ))
   (( resid 145  and name  HN  ))

      2.600     0.800     0.800
 assi 
   (( resid 118  and name  HB  ))
   (( resid 145  and name  HN  ))

      3.500     1.700     1.700
 assi 
   (( resid 119  and name  HB1 ))
   (( resid 145  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 144  and name  HB  ))
   (( resid 145  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 117  and name  HB1 ))
   (( resid 145  and name  HN  ))

      3.260     1.460     1.460
 assi 
   (( resid 25   and name  HN  ))
   (( resid 26   and name  HN  ))

      3.215     1.415     1.415
 assi 
   (( resid 25   and name  HA  ))
   (( resid 26   and name  HN  ))

      2.525     0.725     0.725
 assi 
   (( resid 20   and name  HA  ))
   (( resid 26   and name  HN  ))

      2.935     1.135     1.135
 assi 
   (( resid 18   and name  HB1 ))
   (( resid 26   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 26   and name  HN  ))
   (  resid 26   and name  HG2#)

      2.565     0.765     0.765
 assi 
   (( resid 24   and name  HG1 ))
   (( resid 26   and name  HN  ))

      3.195     1.395     1.395
 assi 
   (( resid 135  and name  HN  ))
   (( resid 135  and name  HB2 ))

      2.590     0.790     0.790
 assi 
   (  resid 134  and name  HB# )
   (( resid 135  and name  HN  ))

      2.690     0.890     0.890
 assi 
   (( resid 135  and name  HN  ))
   (( resid 135  and name  HB1 ))

      2.840     1.040     1.040
 assi 
   (( resid 135  and name  HN  ))
   (  resid 135  and name  HD1#)

      2.865     1.065     1.065
 assi 
   (( resid 58   and name  HN  ))
   (( resid 59   and name  HN  ))

      2.800     1.000     1.000
 assi 
   (( resid 58   and name  HN  ))
   (( resid 58   and name  HD2 ))

      3.040     1.240     1.240
 assi 
   (( resid 58   and name  HN  ))
   (( resid 59   and name  HB  ))

      3.455     1.655     1.655
 assi 
   (( resid 55   and name  HA  ))
   (( resid 58   and name  HN  ))

      3.055     1.255     1.255
 assi 
   (( resid 54   and name  HA  ))
   (( resid 58   and name  HN  ))

      3.135     1.335     1.335
 assi 
   (( resid 58   and name  HN  ))
   (( resid 58   and name  HB2 ))

      2.710     0.910     0.910
 assi 
   (( resid 58   and name  HN  ))
   (( resid 58   and name  HB1 ))

      2.835     1.035     1.035
 assi 
   (( resid 57   and name  HB2 ))
   (( resid 58   and name  HN  ))

      3.065     1.265     1.265
 assi 
   (( resid 57   and name  HB1 ))
   (( resid 58   and name  HN  ))

      3.095     1.295     1.295
 assi 
   (( resid 57   and name  HG1 ))
   (( resid 58   and name  HN  ))

      3.180     1.380     1.380
 assi 
   (( resid 57   and name  HG2 ))
   (( resid 58   and name  HN  ))

      3.045     1.245     1.245
 assi 
   (( resid 56   and name  HB2 ))
   (( resid 58   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 56   and name  HB1 ))
   (( resid 58   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 58   and name  HN  ))
   (  resid 59   and name  HG2#)

      3.375     1.575     1.575
 assi 
   (( resid 106  and name  HN  ))
   (( resid 108  and name  HN  ))

      3.255     1.455     1.455
 assi 
   (( resid 105  and name  HN  ))
   (( resid 108  and name  HN  ))

      3.295     1.495     1.495
 assi 
   (( resid 108  and name  HN  ))
   (( resid 109  and name  HN  ))

      2.550     0.750     0.750
 assi 
   (  resid 106  and name  HB# )
   (( resid 108  and name  HN  ))

      3.195     1.395     1.395
 assi 
   (( resid 106  and name  HA  ))
   (( resid 108  and name  HN  ))

      2.940     1.140     1.140
 assi 
   (( resid 104  and name  HB1 ))
   (( resid 108  and name  HN  ))

      3.395     1.595     1.595
 assi 
   (( resid 42   and name  HN  ))
   (( resid 68   and name  HN  ))

      2.695     0.895     0.895
 assi 
   (( resid 41   and name  HA  ))
   (( resid 42   and name  HN  ))

      2.560     0.760     0.760
 assi 
   (( resid 42   and name  HN  ))
   (( resid 69   and name  HA  ))

      3.025     1.225     1.225
 assi 
   (( resid 42   and name  HN  ))
   (( resid 68   and name  HB  ))

      3.100     1.300     1.300
 assi 
   (( resid 42   and name  HN  ))
   (( resid 67   and name  HB1 ))

      3.190     1.390     1.390
 assi 
   (( resid 42   and name  HN  ))
   (( resid 42   and name  HB1 ))

      2.795     0.995     0.995
 assi 
   (( resid 42   and name  HN  ))
   (  resid 57   and name  HE# )

      3.125     1.325     1.325
 assi 
   (( resid 42   and name  HN  ))
   (( resid 42   and name  HB2 ))

      2.795     0.995     0.995
 assi 
   (  resid 41   and name  HB# )
   (( resid 42   and name  HN  ))

      2.600     0.800     0.800
 assi 
   (( resid 42   and name  HN  ))
   (  resid 70   and name  HG2#)

      2.810     1.010     1.010
 assi 
   (( resid 42   and name  HN  ))
   (  resid 49   and name  HG2#)

      3.520     1.720     1.720
 assi 
   (( resid 42   and name  HN  ))
   (  resid 69   and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 42   and name  HN  ))
   (  resid 69   and name  HD2#)

      3.650     1.850     1.850
 assi 
   (( resid 116  and name  HN  ))
   (( resid 117  and name  HA  ))

      3.645     1.845     1.845
 assi 
   (( resid 116  and name  HN  ))
   (( resid 126  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 116  and name  HN  ))
   (( resid 128  and name  HA  ))

      2.840     1.040     1.040
 assi 
   (( resid 116  and name  HN  ))
   (( resid 129  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 115  and name  HB2 ))
   (( resid 116  and name  HN  ))

      3.245     1.445     1.445
 assi 
   (( resid 116  and name  HN  ))
   (( resid 116  and name  HG12))

      2.715     0.915     0.915
 assi 
   (( resid 116  and name  HN  ))
   (  resid 126  and name  HG2#)

      2.830     1.030     1.030
 assi 
   (( resid 116  and name  HN  ))
   (  resid 116  and name  HG2#)

      2.725     0.925     0.925
 assi 
   (( resid 116  and name  HN  ))
   (  resid 116  and name  HD1#)

      2.855     1.055     1.055
 assi 
   (( resid 15   and name  HN  ))
   (( resid 16   and name  HN  ))

      3.270     1.470     1.470
 assi 
   (( resid 16   and name  HN  ))
   (( resid 17   and name  HZ3 ))

      3.105     1.305     1.305
 assi 
   (( resid 16   and name  HN  ))
   (( resid 17   and name  HN  ))

      2.865     1.065     1.065
 assi 
   (( resid 16   and name  HN  ))
   (( resid 17   and name  HZ2 ))

      3.650     1.850     1.850
 assi 
   (( resid 16   and name  HN  ))
   (( resid 18   and name  HN  ))

      3.110     1.310     1.310
 assi 
   (( resid 15   and name  HA  ))
   (( resid 16   and name  HN  ))

      2.520     0.720     0.720
 assi 
   (( resid 16   and name  HN  ))
   (( resid 16   and name  HG2 ))

      3.055     1.255     1.255
 assi 
   (( resid 15   and name  HB1 ))
   (( resid 16   and name  HN  ))

      2.935     1.135     1.135
 assi 
   (( resid 15   and name  HB2 ))
   (( resid 16   and name  HN  ))

      2.935     1.135     1.135
 assi 
   (( resid 21   and name  HN  ))
   (( resid 24   and name  HN  ))

      2.660     0.860     0.860
 assi 
   (( resid 23   and name  HN  ))
   (( resid 24   and name  HN  ))

      2.540     0.740     0.740
 assi 
   (( resid 23   and name  HB2 ))
   (( resid 24   and name  HN  ))

      3.565     1.765     1.765
 assi 
   (( resid 23   and name  HB1 ))
   (( resid 24   and name  HN  ))

      3.565     1.765     1.765
 assi 
   (( resid 24   and name  HN  ))
   (  resid 26   and name  HG1#)

      3.475     1.675     1.675
 assi 
   (( resid 21   and name  HA  ))
   (( resid 24   and name  HN  ))

      3.315     1.515     1.515
 assi 
   (( resid 22   and name  HA  ))
   (( resid 24   and name  HN  ))

      3.325     1.525     1.525
 assi 
   (( resid 23   and name  HA  ))
   (( resid 24   and name  HN  ))

      2.680     0.880     0.880
 assi 
   (( resid 24   and name  HN  ))
   (( resid 24   and name  HD2 ))

      3.650     1.850     1.850
 assi 
   (( resid 24   and name  HN  ))
   (( resid 24   and name  HD1 ))

      3.650     1.850     1.850
 assi 
   (( resid 22   and name  HB1 ))
   (( resid 24   and name  HN  ))

      3.160     1.360     1.360
 assi 
   (( resid 22   and name  HB2 ))
   (( resid 24   and name  HN  ))

      3.395     1.595     1.595
 assi 
   (( resid 24   and name  HN  ))
   (( resid 24   and name  HB1 ))

      2.625     0.825     0.825
 assi 
   (( resid 24   and name  HN  ))
   (( resid 24   and name  HG1 ))

      2.790     0.990     0.990
 assi 
   (( resid 24   and name  HN  ))
   (( resid 24   and name  HG2 ))

      2.870     1.070     1.070
 assi 
   (( resid 20   and name  HG  ))
   (( resid 24   and name  HN  ))

      3.145     1.345     1.345
 assi 
   (( resid 54   and name  HN  ))
   (( resid 55   and name  HN  ))

      2.825     1.025     1.025
 assi 
   (( resid 36   and name  HB1 ))
   (( resid 55   and name  HN  ))

      3.270     1.470     1.470
 assi 
   (( resid 53   and name  HA  ))
   (( resid 55   and name  HN  ))

      3.500     1.700     1.700
 assi 
   (( resid 36   and name  HA  ))
   (( resid 55   and name  HN  ))

      3.255     1.455     1.455
 assi 
   (( resid 55   and name  HN  ))
   (( resid 55   and name  HB1 ))

      2.970     1.170     1.170
 assi 
   (( resid 36   and name  HB2 ))
   (( resid 55   and name  HN  ))

      3.270     1.470     1.470
 assi 
   (( resid 55   and name  HN  ))
   (( resid 55   and name  HB2 ))

      2.970     1.170     1.170
 assi 
   (( resid 54   and name  HB  ))
   (( resid 55   and name  HN  ))

      3.020     1.220     1.220
 assi 
   (  resid 53   and name  HG2#)
   (( resid 55   and name  HN  ))

      3.285     1.485     1.485
 assi 
   (  resid 54   and name  HG2#)
   (( resid 55   and name  HN  ))

      3.035     1.235     1.235
 assi 
   (  resid 54   and name  HG1#)
   (( resid 55   and name  HN  ))

      3.035     1.235     1.235
 assi 
   (( resid 55   and name  HN  ))
   (( resid 56   and name  HN  ))

      3.080     1.280     1.280
 assi 
   (( resid 54   and name  HN  ))
   (( resid 56   and name  HN  ))

      3.425     1.625     1.625
 assi 
   (( resid 56   and name  HN  ))
   (( resid 59   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 55   and name  HB1 ))
   (( resid 56   and name  HN  ))

      3.030     1.230     1.230
 assi 
   (( resid 56   and name  HN  ))
   (( resid 57   and name  HB1 ))

      3.500     1.700     1.700
 assi 
   (  resid 52   and name  HD2#)
   (( resid 56   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 53   and name  HB  ))
   (( resid 56   and name  HN  ))

      3.115     1.315     1.315
 assi 
   (( resid 33   and name  HB1 ))
   (( resid 56   and name  HN  ))

      3.405     1.605     1.605
 assi 
   (( resid 33   and name  HB2 ))
   (( resid 56   and name  HN  ))

      3.405     1.605     1.605
 assi 
   (( resid 54   and name  HA  ))
   (( resid 56   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 55   and name  HB2 ))
   (( resid 56   and name  HN  ))

      3.030     1.230     1.230
 assi 
   (( resid 56   and name  HN  ))
   (( resid 56   and name  HB2 ))

      2.835     1.035     1.035
 assi 
   (( resid 56   and name  HN  ))
   (( resid 56   and name  HB1 ))

      2.835     1.035     1.035
 assi 
   (  resid 53   and name  HG2#)
   (( resid 56   and name  HN  ))

      3.020     1.220     1.220
 assi 
   (( resid 93   and name  HN  ))
   (( resid 102  and name  HN  ))

      2.885     1.085     1.085
 assi 
   (( resid 101  and name  HA  ))
   (( resid 102  and name  HN  ))

      2.650     0.850     0.850
 assi 
   (( resid 94   and name  HA  ))
   (( resid 102  and name  HN  ))

      3.190     1.390     1.390
 assi 
   (( resid 102  and name  HN  ))
   (( resid 102  and name  HB  ))

      2.980     1.180     1.180
 assi 
   (( resid 102  and name  HN  ))
   (  resid 102  and name  HG2#)

      2.895     1.095     1.095
 assi 
   (( resid 33   and name  HN  ))
   (( resid 34   and name  HN  ))

      3.225     1.425     1.425
 assi 
   (( resid 32   and name  HN  ))
   (( resid 33   and name  HN  ))

      2.645     0.845     0.845
 assi 
   (( resid 31   and name  HA  ))
   (( resid 33   and name  HN  ))

      3.230     1.430     1.430
 assi 
   (( resid 30   and name  HA  ))
   (( resid 33   and name  HN  ))

      3.555     1.755     1.755
 assi 
   (( resid 33   and name  HN  ))
   (( resid 33   and name  HB1 ))

      2.750     0.950     0.950
 assi 
   (( resid 33   and name  HN  ))
   (( resid 33   and name  HB2 ))

      2.750     0.950     0.950
 assi 
   (( resid 32   and name  HB2 ))
   (( resid 33   and name  HN  ))

      3.440     1.640     1.640
 assi 
   (( resid 32   and name  HB1 ))
   (( resid 33   and name  HN  ))

      3.440     1.640     1.640
 assi 
   (( resid 33   and name  HN  ))
   (  resid 59   and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 36   and name  HN  ))
   (( resid 91   and name  HH2 ))

      3.590     1.790     1.790
 assi 
   (( resid 35   and name  HA  ))
   (( resid 36   and name  HN  ))

      2.430     0.630     0.630
 assi 
   (( resid 36   and name  HN  ))
   (  resid 53   and name  HG2#)

      3.010     1.210     1.210
 assi 
   (( resid 19   and name  HN  ))
   (( resid 27   and name  HN  ))

      3.510     1.710     1.710
 assi 
   (( resid 26   and name  HN  ))
   (( resid 27   and name  HN  ))

      3.635     1.835     1.835
 assi 
   (( resid 18   and name  HA  ))
   (( resid 27   and name  HN  ))

      3.365     1.565     1.565
 assi 
   (( resid 26   and name  HA  ))
   (( resid 27   and name  HN  ))

      2.650     0.850     0.850
 assi 
   (( resid 27   and name  HN  ))
   (( resid 27   and name  HB1 ))

      2.825     1.025     1.025
 assi 
   (( resid 27   and name  HN  ))
   (( resid 27   and name  HB2 ))

      2.825     1.025     1.025
 assi 
   (( resid 26   and name  HB  ))
   (( resid 27   and name  HN  ))

      2.505     0.705     0.705
 assi 
   (  resid 26   and name  HG1#)
   (( resid 27   and name  HN  ))

      2.755     0.955     0.955
 assi 
   (  resid 26   and name  HG2#)
   (( resid 27   and name  HN  ))

      2.725     0.925     0.925
 assi 
   (( resid 84   and name  HA  ))
   (( resid 101  and name  HN  ))

      3.200     1.400     1.400
 assi 
   (( resid 137  and name  HN  ))
   (( resid 138  and name  HN  ))

      2.865     1.065     1.065
 assi 
   (( resid 138  and name  HN  ))
   (( resid 139  and name  HN  ))

      2.650     0.850     0.850
 assi 
   (( resid 134  and name  HA  ))
   (( resid 138  and name  HN  ))

      3.110     1.310     1.310
 assi 
   (( resid 135  and name  HA  ))
   (( resid 138  and name  HN  ))

      2.985     1.185     1.185
 assi 
   (( resid 137  and name  HB2 ))
   (( resid 138  and name  HN  ))

      2.895     1.095     1.095
 assi 
   (( resid 137  and name  HB1 ))
   (( resid 138  and name  HN  ))

      2.925     1.125     1.125
 assi 
   (( resid 138  and name  HN  ))
   (( resid 138  and name  HB1 ))

      2.720     0.920     0.920
 assi 
   (( resid 138  and name  HN  ))
   (( resid 138  and name  HB2 ))

      2.720     0.920     0.920
 assi 
   (( resid 102  and name  HN  ))
   (( resid 103  and name  HN  ))

      3.295     1.495     1.495
 assi 
   (( resid 103  and name  HN  ))
   (( resid 103  and name  HB1 ))

      2.840     1.040     1.040
 assi 
   (( resid 103  and name  HN  ))
   (( resid 103  and name  HB2 ))

      2.840     1.040     1.040
 assi 
   (( resid 102  and name  HB  ))
   (( resid 103  and name  HN  ))

      2.900     1.100     1.100
 assi 
   (  resid 102  and name  HG2#)
   (( resid 103  and name  HN  ))

      2.795     0.995     0.995
 assi 
   (  resid 102  and name  HG1#)
   (( resid 103  and name  HN  ))

      2.795     0.995     0.995
 assi 
   (( resid 119  and name  HN  ))
   (( resid 143  and name  HN  ))

      2.780     0.980     0.980
 assi 
   (( resid 143  and name  HN  ))
   (( resid 144  and name  HN  ))

      3.145     1.345     1.345
 assi 
   (( resid 142  and name  HA  ))
   (( resid 143  and name  HN  ))

      2.505     0.705     0.705
 assi 
   (( resid 143  and name  HN  ))
   (( resid 143  and name  HB1 ))

      2.700     0.900     0.900
 assi 
   (( resid 143  and name  HN  ))
   (( resid 143  and name  HB2 ))

      2.730     0.930     0.930
 assi 
   (( resid 119  and name  HB1 ))
   (( resid 143  and name  HN  ))

      2.830     1.030     1.030
 assi 
   (( resid 142  and name  HB  ))
   (( resid 143  and name  HN  ))

      2.600     0.800     0.800
 assi 
   (( resid 142  and name  HG12))
   (( resid 143  and name  HN  ))

      3.020     1.220     1.220
 assi 
   (( resid 142  and name  HG11))
   (( resid 143  and name  HN  ))

      3.560     1.760     1.760
 assi 
   (( resid 143  and name  HN  ))
   (  resid 145  and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 147  and name  HN  ))
   (  resid 147  and name  HG2#)

      2.735     0.935     0.935
 assi 
   (( resid 45   and name  HN  ))
   (( resid 46   and name  HN  ))

      2.580     0.780     0.780
 assi 
   (( resid 43   and name  HA  ))
   (( resid 45   and name  HN  ))

      3.030     1.230     1.230
 assi 
   (( resid 45   and name  HN  ))
   (( resid 45   and name  HB2 ))

      2.610     0.810     0.810
 assi 
   (( resid 45   and name  HN  ))
   (( resid 45   and name  HB1 ))

      2.610     0.810     0.810
 assi 
   (( resid 147  and name  HN  ))
   (  resid 147  and name  HD1#)

      2.895     1.095     1.095
 assi 
   (( resid 146  and name  HA  ))
   (( resid 147  and name  HN  ))

      2.645     0.845     0.845
 assi 
   (( resid 93   and name  HN  ))
   (( resid 104  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 93   and name  HN  ))
   (( resid 101  and name  HA  ))

      3.700     1.900     1.900
 assi 
   (( resid 130  and name  HN  ))
   (( resid 130  and name  HB1 ))

      2.745     0.945     0.945
 assi 
   (( resid 130  and name  HN  ))
   (( resid 130  and name  HB2 ))

      2.745     0.945     0.945
 assi 
   (( resid 129  and name  HB1 ))
   (( resid 130  and name  HN  ))

      2.905     1.105     1.105
 assi 
   (( resid 129  and name  HB2 ))
   (( resid 130  and name  HN  ))

      2.885     1.085     1.085
 assi 
   (( resid 80   and name  HN  ))
   (( resid 81   and name  HN  ))

      2.685     0.885     0.885
 assi 
   (( resid 79   and name  HA  ))
   (( resid 80   and name  HN  ))

      2.545     0.745     0.745
 assi 
   (( resid 80   and name  HN  ))
   (( resid 80   and name  HB2 ))

      2.930     1.130     1.130
 assi 
   (( resid 80   and name  HN  ))
   (( resid 80   and name  HB1 ))

      2.930     1.130     1.130
 assi 
   (( resid 56   and name  HN  ))
   (( resid 57   and name  HN  ))

      2.795     0.995     0.995
 assi 
   (( resid 57   and name  HN  ))
   (( resid 58   and name  HN  ))

      2.780     0.980     0.980
 assi 
   (( resid 53   and name  HN  ))
   (( resid 57   and name  HN  ))

      3.060     1.260     1.260
 assi 
   (( resid 54   and name  HA  ))
   (( resid 57   and name  HN  ))

      3.105     1.305     1.305
 assi 
   (( resid 57   and name  HN  ))
   (( resid 57   and name  HB2 ))

      2.760     0.960     0.960
 assi 
   (( resid 57   and name  HN  ))
   (( resid 57   and name  HB1 ))

      2.575     0.775     0.775
 assi 
   (( resid 57   and name  HN  ))
   (( resid 58   and name  HB2 ))

      3.365     1.565     1.565
 assi 
   (( resid 85   and name  HN  ))
   (( resid 101  and name  HN  ))

      3.030     1.230     1.230
 assi 
   (( resid 84   and name  HA  ))
   (( resid 85   and name  HN  ))

      2.535     0.735     0.735
 assi 
   (( resid 85   and name  HN  ))
   (( resid 85   and name  HB1 ))

      2.815     1.015     1.015
 assi 
   (( resid 85   and name  HN  ))
   (( resid 85   and name  HB2 ))

      2.815     1.015     1.015
 assi 
   (  resid 84   and name  HB# )
   (( resid 85   and name  HN  ))

      2.510     0.710     0.710
 assi 
   (( resid 115  and name  HN  ))
   (( resid 128  and name  HA  ))

      3.435     1.635     1.635
 assi 
   (( resid 114  and name  HA  ))
   (( resid 115  and name  HN  ))

      2.395     0.595     0.595
 assi 
   (( resid 115  and name  HN  ))
   (( resid 115  and name  HB1 ))

      2.725     0.925     0.925
 assi 
   (( resid 115  and name  HN  ))
   (( resid 115  and name  HB2 ))

      2.725     0.925     0.925
 assi 
   (( resid 114  and name  HB1 ))
   (( resid 115  and name  HN  ))

      3.080     1.280     1.280
 assi 
   (( resid 114  and name  HB2 ))
   (( resid 115  and name  HN  ))

      3.080     1.280     1.280
 assi 
   (( resid 16   and name  HD1 ))
   (( resid 115  and name  HN  ))

      3.340     1.540     1.540
 assi 
   (( resid 16   and name  HD2 ))
   (( resid 115  and name  HN  ))

      3.340     1.540     1.540
 assi 
   (( resid 115  and name  HN  ))
   (  resid 126  and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 115  and name  HN  ))
   (  resid 116  and name  HG2#)

      2.990     1.190     1.190
 assi 
   (( resid 63   and name  HN  ))
   (( resid 63   and name  HE21))

      3.415     1.615     1.615
 assi 
   (( resid 63   and name  HN  ))
   (( resid 65   and name  HN  ))

      3.245     1.445     1.445
 assi 
   (( resid 60   and name  HA  ))
   (( resid 63   and name  HN  ))

      2.895     1.095     1.095
 assi 
   (( resid 62   and name  HB1 ))
   (( resid 63   and name  HN  ))

      3.120     1.320     1.320
 assi 
   (( resid 59   and name  HA  ))
   (( resid 63   and name  HN  ))

      3.070     1.270     1.270
 assi 
   (( resid 62   and name  HB2 ))
   (( resid 63   and name  HN  ))

      3.120     1.320     1.320
 assi 
   (( resid 63   and name  HN  ))
   (( resid 63   and name  HG1 ))

      2.750     0.950     0.950
 assi 
   (( resid 63   and name  HN  ))
   (( resid 63   and name  HG2 ))

      2.750     0.950     0.950
 assi 
   (  resid 59   and name  HG2#)
   (( resid 63   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (  resid 59   and name  HG1#)
   (( resid 63   and name  HN  ))

      3.175     1.375     1.375
 assi 
   (( resid 87   and name  HA  ))
   (( resid 88   and name  HN  ))

      2.600     0.800     0.800
 assi 
   (  resid 87   and name  HB# )
   (( resid 88   and name  HN  ))

      2.715     0.915     0.915
 assi 
   (( resid 42   and name  HN  ))
   (( resid 70   and name  HN  ))

      3.100     1.300     1.300
 assi 
   (( resid 69   and name  HN  ))
   (( resid 70   and name  HN  ))

      3.175     1.375     1.375
 assi 
   (( resid 41   and name  HA  ))
   (( resid 70   and name  HN  ))

      2.735     0.935     0.935
 assi 
   (( resid 69   and name  HA  ))
   (( resid 70   and name  HN  ))

      2.510     0.710     0.710
 assi 
   (( resid 69   and name  HB1 ))
   (( resid 70   and name  HN  ))

      2.805     1.005     1.005
 assi 
   (  resid 41   and name  HB# )
   (( resid 70   and name  HN  ))

      2.975     1.175     1.175
 assi 
   (( resid 19   and name  HN  ))
   (( resid 20   and name  HN  ))

      3.390     1.590     1.590
 assi 
   (( resid 18   and name  HN  ))
   (( resid 19   and name  HN  ))

      3.160     1.360     1.360
 assi 
   (( resid 18   and name  HB2 ))
   (( resid 19   and name  HN  ))

      2.850     1.050     1.050
 assi 
   (( resid 19   and name  HN  ))
   (( resid 19   and name  HG1 ))

      2.990     1.190     1.190
 assi 
   (( resid 19   and name  HN  ))
   (  resid 26   and name  HG2#)

      2.940     1.140     1.140
 assi 
   (( resid 127  and name  HN  ))
   (( resid 128  and name  HN  ))

      3.195     1.395     1.395
 assi 
   (( resid 128  and name  HN  ))
   (( resid 128  and name  HB1 ))

      2.830     1.030     1.030
 assi 
   (( resid 128  and name  HN  ))
   (( resid 128  and name  HB2 ))

      2.830     1.030     1.030
 assi 
   (( resid 128  and name  HN  ))
   (( resid 131  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 127  and name  HB1 ))
   (( resid 128  and name  HN  ))

      2.700     0.900     0.900
 assi 
   (( resid 128  and name  HN  ))
   (( resid 131  and name  HB2 ))

      2.870     1.070     1.070
 assi 
   (( resid 127  and name  HB2 ))
   (( resid 128  and name  HN  ))

      2.700     0.900     0.900
 assi 
   (  resid 126  and name  HG2#)
   (( resid 128  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 153  and name  HG2 ))
   (( resid 154  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 153  and name  HG1 ))
   (( resid 154  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 153  and name  HB1 ))
   (( resid 154  and name  HN  ))

      3.180     1.380     1.380
 assi 
   (  resid 152  and name  HB# )
   (( resid 154  and name  HN  ))

      3.520     1.720     1.720
 assi 
   (( resid 153  and name  HA  ))
   (( resid 154  and name  HN  ))

      2.540     0.740     0.740
 assi 
   (( resid 153  and name  HB2 ))
   (( resid 154  and name  HN  ))

      3.180     1.380     1.380
 assi 
   (( resid 154  and name  HN  ))
   (  resid 154  and name  HG2#)

      2.975     1.175     1.175
 assi 
   (( resid 47   and name  HN  ))
   (( resid 47   and name  HB1 ))

      2.940     1.140     1.140
 assi 
   (( resid 47   and name  HN  ))
   (( resid 47   and name  HB2 ))

      2.940     1.140     1.140
 assi 
   (( resid 47   and name  HN  ))
   (( resid 47   and name  HD1 ))

      2.965     1.165     1.165
 assi 
   (( resid 47   and name  HN  ))
   (( resid 47   and name  HD2 ))

      2.965     1.165     1.165
 assi 
   (( resid 47   and name  HN  ))
   (  resid 47   and name  HG# )

      2.955     1.155     1.155
 assi 
   (( resid 67   and name  HA  ))
   (( resid 68   and name  HN  ))

      2.495     0.695     0.695
 assi 
   (( resid 43   and name  HA  ))
   (( resid 68   and name  HN  ))

      3.260     1.460     1.460
 assi 
   (( resid 67   and name  HB2 ))
   (( resid 68   and name  HN  ))

      2.950     1.150     1.150
 assi 
   (( resid 67   and name  HB1 ))
   (( resid 68   and name  HN  ))

      2.870     1.070     1.070
 assi 
   (( resid 42   and name  HB1 ))
   (( resid 68   and name  HN  ))

      3.360     1.560     1.560
 assi 
   (  resid 57   and name  HE# )
   (( resid 68   and name  HN  ))

      2.995     1.195     1.195
 assi 
   (( resid 42   and name  HB2 ))
   (( resid 68   and name  HN  ))

      3.360     1.560     1.560
 assi 
   (( resid 68   and name  HN  ))
   (  resid 68   and name  HG2#)

      2.950     1.150     1.150
 assi 
   (  resid 41   and name  HB# )
   (( resid 68   and name  HN  ))

      2.890     1.090     1.090
 assi 
   (( resid 68   and name  HN  ))
   (  resid 70   and name  HG2#)

      3.355     1.555     1.555
 assi 
   (( resid 119  and name  HN  ))
   (( resid 146  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 145  and name  HN  ))
   (( resid 146  and name  HN  ))

      2.560     0.760     0.760
 assi 
   (( resid 117  and name  HA  ))
   (( resid 146  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 144  and name  HA  ))
   (( resid 146  and name  HN  ))

      2.805     1.005     1.005
 assi 
   (( resid 117  and name  HB1 ))
   (( resid 146  and name  HN  ))

      2.735     0.935     0.935
 assi 
   (( resid 116  and name  HB  ))
   (( resid 146  and name  HN  ))

      3.420     1.620     1.620
 assi 
   (  resid 145  and name  HG2#)
   (( resid 146  and name  HN  ))

      2.925     1.125     1.125
 assi 
   (( resid 118  and name  HA  ))
   (( resid 146  and name  HN  ))

      3.155     1.355     1.355
 assi 
   (( resid 146  and name  HN  ))
   (( resid 148  and name  HN  ))

      3.535     1.735     1.735
 assi 
   (( resid 29   and name  HN  ))
   (( resid 29   and name  HG1 ))

      2.990     1.190     1.190
 assi 
   (( resid 29   and name  HN  ))
   (( resid 32   and name  HB2 ))

      3.135     1.335     1.335
 assi 
   (( resid 29   and name  HN  ))
   (( resid 32   and name  HB1 ))

      3.135     1.335     1.335
 assi 
   (( resid 29   and name  HN  ))
   (( resid 29   and name  HB2 ))

      2.820     1.020     1.020
 assi 
   (( resid 29   and name  HN  ))
   (( resid 29   and name  HG2 ))

      2.990     1.190     1.190
 assi 
   (( resid 29   and name  HN  ))
   (( resid 29   and name  HB1 ))

      2.820     1.020     1.020
 assi 
   (( resid 28   and name  HN  ))
   (( resid 29   and name  HN  ))

      3.285     1.485     1.485
 assi 
   (( resid 38   and name  HA  ))
   (( resid 39   and name  HN  ))

      2.585     0.785     0.785
 assi 
   (( resid 38   and name  HB1 ))
   (( resid 39   and name  HN  ))

      3.120     1.320     1.320
 assi 
   (( resid 38   and name  HB2 ))
   (( resid 39   and name  HN  ))

      3.120     1.320     1.320
 assi 
   (( resid 37   and name  HB1 ))
   (( resid 39   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 39   and name  HN  ))
   (( resid 77   and name  HG  ))

      3.650     1.850     1.850
 assi 
   (( resid 39   and name  HN  ))
   (  resid 53   and name  HG2#)

      2.840     1.040     1.040
 assi 
   (( resid 39   and name  HN  ))
   (( resid 53   and name  HA  ))

      2.825     1.025     1.025
 assi 
   (( resid 39   and name  HN  ))
   (( resid 53   and name  HB  ))

      3.605     1.805     1.805
 assi 
   (( resid 39   and name  HN  ))
   (( resid 39   and name  HB  ))

      2.955     1.155     1.155
 assi 
   (( resid 39   and name  HN  ))
   (  resid 39   and name  HG1#)

      2.855     1.055     1.055
 assi 
   (( resid 39   and name  HN  ))
   (  resid 77   and name  HD1#)

      3.100     1.300     1.300
 assi 
   (( resid 73   and name  HN  ))
   (( resid 74   and name  HN  ))

      2.620     0.820     0.820
 assi 
   (( resid 74   and name  HN  ))
   (( resid 75   and name  HA  ))

      3.595     1.795     1.795
 assi 
   (  resid 49   and name  HD1#)
   (( resid 74   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 74   and name  HN  ))
   (( resid 74   and name  HB1 ))

      2.775     0.975     0.975
 assi 
   (( resid 74   and name  HN  ))
   (( resid 74   and name  HB2 ))

      2.775     0.975     0.975
 assi 
   (  resid 49   and name  HG2#)
   (( resid 74   and name  HN  ))

      3.255     1.455     1.455
 assi 
   (( resid 46   and name  HN  ))
   (( resid 47   and name  HN  ))

      2.585     0.785     0.785
 assi 
   (( resid 46   and name  HN  ))
   (( resid 46   and name  HB1 ))

      2.810     1.010     1.010
 assi 
   (( resid 46   and name  HN  ))
   (( resid 46   and name  HB2 ))

      2.810     1.010     1.010
 assi 
   (( resid 45   and name  HB2 ))
   (( resid 46   and name  HN  ))

      3.070     1.270     1.270
 assi 
   (( resid 33   and name  HA  ))
   (( resid 34   and name  HN  ))

      2.700     0.900     0.900
 assi 
   (( resid 92   and name  HN  ))
   (( resid 93   and name  HN  ))

      3.200     1.400     1.400
 assi 
   (( resid 92   and name  HN  ))
   (( resid 104  and name  HN  ))

      3.375     1.575     1.575
 assi 
   (( resid 91   and name  HN  ))
   (( resid 92   and name  HN  ))

      2.760     0.960     0.960
 assi 
   (( resid 92   and name  HN  ))
   (( resid 93   and name  HA  ))

      3.900     2.100     2.100
 assi 
   (( resid 92   and name  HN  ))
   (( resid 103  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 90   and name  HA  ))
   (( resid 92   and name  HN  ))

      3.125     1.325     1.325
 assi 
   (( resid 91   and name  HD1 ))
   (( resid 92   and name  HN  ))

      3.245     1.445     1.445
 assi 
   (( resid 90   and name  HB1 ))
   (( resid 92   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 90   and name  HB2 ))
   (( resid 92   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 92   and name  HN  ))
   (( resid 104  and name  HB2 ))

      3.585     1.785     1.785
 assi 
   (( resid 17   and name  HN  ))
   (( resid 17   and name  HB1 ))

      2.960     1.160     1.160
 assi 
   (( resid 17   and name  HN  ))
   (( resid 17   and name  HZ3 ))

      3.080     1.280     1.280
 assi 
   (( resid 15   and name  HG2 ))
   (( resid 17   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 15   and name  HG1 ))
   (( resid 17   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 15   and name  HB1 ))
   (( resid 17   and name  HN  ))

      3.245     1.445     1.445
 assi 
   (( resid 15   and name  HB2 ))
   (( resid 17   and name  HN  ))

      3.245     1.445     1.445
 assi 
   (( resid 17   and name  HN  ))
   (  resid 59   and name  HG2#)

      3.235     1.435     1.435
 assi 
   (( resid 31   and name  HN  ))
   (( resid 33   and name  HN  ))

      3.170     1.370     1.370
 assi 
   (( resid 31   and name  HN  ))
   (  resid 31   and name  HD# )

      2.785     0.985     0.985
 assi 
   (( resid 31   and name  HN  ))
   (( resid 31   and name  HB2 ))

      2.885     1.085     1.085
 assi 
   (( resid 31   and name  HN  ))
   (( resid 31   and name  HB1 ))

      2.800     1.000     1.000
 assi 
   (( resid 29   and name  HB2 ))
   (( resid 31   and name  HN  ))

      3.105     1.305     1.305
 assi 
   (( resid 29   and name  HB1 ))
   (( resid 31   and name  HN  ))

      3.105     1.305     1.305
 assi 
   (( resid 53   and name  HN  ))
   (( resid 56   and name  HN  ))

      3.375     1.575     1.575
 assi 
   (( resid 53   and name  HN  ))
   (( resid 57   and name  HB1 ))

      3.245     1.445     1.445
 assi 
   (( resid 52   and name  HB1 ))
   (( resid 53   and name  HN  ))

      2.575     0.775     0.775
 assi 
   (  resid 39   and name  HG2#)
   (( resid 53   and name  HN  ))

      3.255     1.455     1.455
 assi 
   (  resid 52   and name  HD1#)
   (( resid 53   and name  HN  ))

      3.475     1.675     1.675
 assi 
   (( resid 63   and name  HB1 ))
   (( resid 64   and name  HN  ))

      3.125     1.325     1.325
 assi 
   (( resid 63   and name  HB2 ))
   (( resid 64   and name  HN  ))

      3.125     1.325     1.325
 assi 
   (( resid 64   and name  HN  ))
   (( resid 65   and name  HB2 ))

      3.215     1.415     1.415
 assi 
   (( resid 137  and name  HB1 ))
   (( resid 139  and name  HN  ))

      3.525     1.725     1.725
 assi 
   (( resid 138  and name  HG1 ))
   (( resid 139  and name  HN  ))

      3.420     1.620     1.620
 assi 
   (( resid 138  and name  HG2 ))
   (( resid 139  and name  HN  ))

      3.420     1.620     1.620
 assi 
   (( resid 139  and name  HN  ))
   (( resid 140  and name  HB1 ))

      3.420     1.620     1.620
 assi 
   (( resid 139  and name  HN  ))
   (( resid 140  and name  HB2 ))

      3.420     1.620     1.620
 assi 
   (( resid 22   and name  HN  ))
   (( resid 23   and name  HN  ))

      3.020     1.220     1.220
 assi 
   (( resid 22   and name  HA  ))
   (( resid 23   and name  HN  ))

      2.605     0.805     0.805
 assi 
   (( resid 23   and name  HN  ))
   (( resid 23   and name  HB2 ))

      2.930     1.130     1.130
 assi 
   (( resid 22   and name  HB1 ))
   (( resid 23   and name  HN  ))

      3.115     1.315     1.315
 assi 
   (( resid 22   and name  HB2 ))
   (( resid 23   and name  HN  ))

      3.205     1.405     1.405
 assi 
   (( resid 20   and name  HG  ))
   (( resid 23   and name  HN  ))

      3.300     1.500     1.500
 assi 
   (( resid 23   and name  HN  ))
   (( resid 24   and name  HG2 ))

      3.185     1.385     1.385
 assi 
   (( resid 70   and name  HN  ))
   (( resid 71   and name  HN  ))

      3.205     1.405     1.405
 assi 
   (( resid 71   and name  HN  ))
   (( resid 72   and name  HN  ))

      3.320     1.520     1.520
 assi 
   (  resid 70   and name  HG2#)
   (( resid 71   and name  HN  ))

      2.750     0.950     0.950
 assi 
   (  resid 49   and name  HG2#)
   (( resid 71   and name  HN  ))

      3.330     1.530     1.530
 assi 
   (( resid 70   and name  HA  ))
   (( resid 71   and name  HN  ))

      2.595     0.795     0.795
 assi 
   (( resid 70   and name  HB  ))
   (( resid 71   and name  HN  ))

      2.540     0.740     0.740
 assi 
   (( resid 129  and name  HA  ))
   (( resid 133  and name  HN  ))

      3.385     1.585     1.585
 assi 
   (( resid 130  and name  HA  ))
   (( resid 133  and name  HN  ))

      3.285     1.485     1.485
 assi 
   (( resid 133  and name  HN  ))
   (  resid 134  and name  HB# )

      3.105     1.305     1.305
 assi 
   (  resid 37   and name  HD1#)
   (( resid 133  and name  HN  ))

      3.235     1.435     1.435
 assi 
   (( resid 113  and name  HN  ))
   (( resid 114  and name  HN  ))

      3.235     1.435     1.435
 assi 
   (( resid 113  and name  HN  ))
   (( resid 129  and name  HB1 ))

      3.325     1.525     1.525
 assi 
   (( resid 112  and name  HG1 ))
   (( resid 113  and name  HN  ))

      3.570     1.770     1.770
 assi 
   (( resid 112  and name  HG2 ))
   (( resid 113  and name  HN  ))

      3.570     1.770     1.770
 assi 
   (( resid 113  and name  HN  ))
   (( resid 129  and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 120  and name  HA  ))
   (( resid 122  and name  HN  ))

      2.750     0.950     0.950
 assi 
   (( resid 121  and name  HB1 ))
   (( resid 122  and name  HN  ))

      3.175     1.375     1.375
 assi 
   (( resid 121  and name  HB2 ))
   (( resid 122  and name  HN  ))

      3.250     1.450     1.450
 assi 
   (( resid 119  and name  HG2 ))
   (( resid 122  and name  HN  ))

      2.775     0.975     0.975
 assi 
   (( resid 134  and name  HN  ))
   (( resid 135  and name  HN  ))

      2.810     1.010     1.010
 assi 
   (( resid 132  and name  HA  ))
   (( resid 134  and name  HN  ))

      3.425     1.625     1.625
 assi 
   (( resid 48   and name  HN  ))
   (( resid 49   and name  HN  ))

      3.160     1.360     1.360
 assi 
   (( resid 42   and name  HA  ))
   (( resid 49   and name  HN  ))

      3.315     1.515     1.515
 assi 
   (( resid 48   and name  HB2 ))
   (( resid 49   and name  HN  ))

      2.480     0.680     0.680
 assi 
   (( resid 49   and name  HN  ))
   (( resid 49   and name  HB  ))

      2.570     0.770     0.770
 assi 
   (( resid 49   and name  HN  ))
   (  resid 49   and name  HD1#)

      2.710     0.910     0.910
 assi 
   (( resid 75   and name  HA  ))
   (( resid 76   and name  HN  ))

      2.505     0.705     0.705
 assi 
   (( resid 76   and name  HN  ))
   (( resid 76   and name  HB  ))

      2.530     0.730     0.730
 assi 
   (( resid 51   and name  HD1 ))
   (( resid 76   and name  HN  ))

      3.145     1.345     1.345
 assi 
   (( resid 75   and name  HB1 ))
   (( resid 76   and name  HN  ))

      2.760     0.960     0.960
 assi 
   (( resid 75   and name  HB2 ))
   (( resid 76   and name  HN  ))

      2.635     0.835     0.835
 assi 
   (( resid 51   and name  HB1 ))
   (( resid 76   and name  HN  ))

      3.315     1.515     1.515
 assi 
   (( resid 76   and name  HN  ))
   (  resid 76   and name  HG2#)

      2.930     1.130     1.130
 assi 
   (  resid 49   and name  HG2#)
   (( resid 76   and name  HN  ))

      3.615     1.815     1.815
 assi 
   (( resid 76   and name  HN  ))
   (  resid 77   and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 73   and name  HN  ))
   (( resid 73   and name  HB2 ))

      2.890     1.090     1.090
 assi 
   (( resid 72   and name  HB1 ))
   (( resid 73   and name  HN  ))

      3.015     1.215     1.215
 assi 
   (( resid 72   and name  HB2 ))
   (( resid 73   and name  HN  ))

      3.135     1.335     1.335
 assi 
   (( resid 106  and name  HN  ))
   (( resid 107  and name  HN  ))

      2.755     0.955     0.955
 assi 
   (( resid 105  and name  HA  ))
   (( resid 107  and name  HN  ))

      3.190     1.390     1.390
 assi 
   (( resid 107  and name  HN  ))
   (( resid 107  and name  HB1 ))

      2.820     1.020     1.020
 assi 
   (( resid 105  and name  HB1 ))
   (( resid 107  and name  HN  ))

      2.830     1.030     1.030
 assi 
   (( resid 105  and name  HB2 ))
   (( resid 107  and name  HN  ))

      2.830     1.030     1.030
 assi 
   (  resid 106  and name  HB# )
   (( resid 107  and name  HN  ))

      2.595     0.795     0.795
 assi 
   (( resid 10   and name  HN  ))
   (( resid 11   and name  HN  ))

      3.275     1.475     1.475
 assi 
   (( resid 9    and name  HN  ))
   (( resid 10   and name  HN  ))

      3.195     1.395     1.395
 assi 
   (( resid 9    and name  HA  ))
   (( resid 10   and name  HN  ))

      2.580     0.780     0.780
 assi 
   (( resid 21   and name  HG2 ))
   (( resid 22   and name  HN  ))

      3.325     1.525     1.525
 assi 
   (( resid 21   and name  HB1 ))
   (( resid 22   and name  HN  ))

      3.185     1.385     1.385
 assi 
   (( resid 21   and name  HG1 ))
   (( resid 22   and name  HN  ))

      3.170     1.370     1.370
 assi 
   (( resid 151  and name  HN  ))
   (( resid 152  and name  HN  ))

      2.585     0.785     0.785
 assi 
   (( resid 48   and name  HA  ))
   (( resid 49   and name  HN  ))

      2.255     0.455     0.455
 assi 
   (( resid 150  and name  HA  ))
   (( resid 151  and name  HN  ))

      2.435     0.635     0.635
 assi 
   (( resid 150  and name  HB1 ))
   (( resid 151  and name  HN  ))

      2.830     1.030     1.030
 assi 
   (( resid 151  and name  HN  ))
   (  resid 151  and name  HB# )

      2.365     0.565     0.565
 assi 
   (( resid 150  and name  HB2 ))
   (( resid 151  and name  HN  ))

      2.830     1.030     1.030
 assi 
   (( resid 65   and name  HN  ))
   (( resid 65   and name  HB1 ))

      2.805     1.005     1.005
 assi 
   (( resid 60   and name  HA  ))
   (( resid 65   and name  HN  ))

      3.420     1.620     1.620
 assi 
   (( resid 44   and name  HN  ))
   (( resid 68   and name  HN  ))

      3.465     1.665     1.665
 assi 
   (( resid 44   and name  HN  ))
   (  resid 67   and name  HD# )

      3.145     1.345     1.345
 assi 
   (( resid 44   and name  HN  ))
   (( resid 67   and name  HA  ))

      2.900     1.100     1.100
 assi 
   (( resid 43   and name  HA  ))
   (( resid 44   and name  HN  ))

      2.520     0.720     0.720
 assi 
   (( resid 43   and name  HB1 ))
   (( resid 44   and name  HN  ))

      3.210     1.410     1.410
 assi 
   (( resid 44   and name  HN  ))
   (  resid 67   and name  HE# )

      3.305     1.505     1.505
 assi 
   (( resid 44   and name  HN  ))
   (( resid 44   and name  HB2 ))

      2.625     0.825     0.825
 assi 
   (( resid 43   and name  HB2 ))
   (( resid 44   and name  HN  ))

      3.210     1.410     1.410
 assi 
   (( resid 44   and name  HN  ))
   (( resid 44   and name  HB1 ))

      2.805     1.005     1.005
 assi 
   (( resid 41   and name  HN  ))
   (( resid 50   and name  HN  ))

      2.805     1.005     1.005
 assi 
   (( resid 42   and name  HA  ))
   (( resid 50   and name  HN  ))

      2.830     1.030     1.030
 assi 
   (( resid 49   and name  HA  ))
   (( resid 50   and name  HN  ))

      2.555     0.755     0.755
 assi 
   (( resid 50   and name  HN  ))
   (( resid 51   and name  HD1 ))

      3.545     1.745     1.745
 assi 
   (( resid 50   and name  HN  ))
   (( resid 51   and name  HD2 ))

      3.650     1.850     1.850
 assi 
   (( resid 50   and name  HN  ))
   (( resid 50   and name  HG  ))

      3.145     1.345     1.345
 assi 
   (  resid 41   and name  HB# )
   (( resid 50   and name  HN  ))

      3.200     1.400     1.400
 assi 
   (( resid 50   and name  HN  ))
   (  resid 50   and name  HD1#)

      3.035     1.235     1.235
 assi 
   (  resid 49   and name  HG2#)
   (( resid 50   and name  HN  ))

      2.580     0.780     0.780
 assi 
   (( resid 141  and name  HN  ))
   (( resid 142  and name  HN  ))

      3.115     1.315     1.315
 assi 
   (( resid 7    and name  HN  ))
   (( resid 8    and name  HN  ))

      3.315     1.515     1.515
 assi 
   (( resid 140  and name  HA  ))
   (( resid 141  and name  HN  ))

      2.375     0.575     0.575
 assi 
   (( resid 140  and name  HG1 ))
   (( resid 141  and name  HN  ))

      2.765     0.965     0.965
 assi 
   (( resid 140  and name  HB1 ))
   (( resid 141  and name  HN  ))

      3.130     1.330     1.330
 assi 
   (( resid 61   and name  HN  ))
   (( resid 61   and name  HD2 ))

      3.585     1.785     1.785
 assi 
   (( resid 58   and name  HA  ))
   (( resid 61   and name  HN  ))

      2.860     1.060     1.060
 assi 
   (( resid 61   and name  HN  ))
   (( resid 61   and name  HB1 ))

      2.600     0.800     0.800
 assi 
   (( resid 61   and name  HN  ))
   (( resid 61   and name  HB2 ))

      2.600     0.800     0.800
 assi 
   (( resid 59   and name  HB  ))
   (( resid 61   and name  HN  ))

      3.450     1.650     1.650
 assi 
   (( resid 60   and name  HB1 ))
   (( resid 61   and name  HN  ))

      3.060     1.260     1.260
 assi 
   (( resid 60   and name  HB2 ))
   (( resid 61   and name  HN  ))

      3.060     1.260     1.260
 assi 
   (  resid 60   and name  HD2#)
   (( resid 61   and name  HN  ))

      3.270     1.470     1.470
 assi 
   (  resid 60   and name  HD1#)
   (( resid 61   and name  HN  ))

      3.270     1.470     1.470
 assi 
   (( resid 40   and name  HN  ))
   (( resid 52   and name  HN  ))

      3.415     1.615     1.615
 assi 
   (( resid 39   and name  HA  ))
   (( resid 40   and name  HN  ))

      2.465     0.665     0.665
 assi 
   (( resid 40   and name  HN  ))
   (( resid 40   and name  HB2 ))

      2.790     0.990     0.990
 assi 
   (( resid 40   and name  HN  ))
   (( resid 40   and name  HB1 ))

      2.725     0.925     0.925
 assi 
   (( resid 40   and name  HN  ))
   (  resid 77   and name  HD2#)

      3.105     1.305     1.305
 assi 
   (( resid 109  and name  HN  ))
   (( resid 110  and name  HN  ))

      3.290     1.490     1.490
 assi 
   (  resid 78   and name  HG# )
   (( resid 79   and name  HN  ))

      2.700     0.900     0.900
 assi 
   (( resid 109  and name  HB1 ))
   (( resid 110  and name  HN  ))

      3.115     1.315     1.315
 assi 
   (( resid 109  and name  HB2 ))
   (( resid 110  and name  HN  ))

      3.115     1.315     1.315
 assi 
   (( resid 134  and name  HA  ))
   (( resid 137  and name  HN  ))

      3.240     1.440     1.440
 assi 
   (( resid 137  and name  HN  ))
   (( resid 137  and name  HB2 ))

      2.960     1.160     1.160
 assi 
   (( resid 137  and name  HN  ))
   (( resid 137  and name  HB1 ))

      2.945     1.145     1.145
 assi 
   (( resid 138  and name  HE  ))
   (( resid 140  and name  HN  ))

      3.185     1.385     1.385
 assi 
   (( resid 45   and name  HA  ))
   (( resid 45   and name  HE  ))

      3.275     1.475     1.475
 assi 
   (( resid 72   and name  HE  ))
   (( resid 73   and name  HA  ))

      3.265     1.465     1.465
 assi 
   (( resid 17   and name  HE1 ))
   (( resid 62   and name  HB1 ))

      3.110     1.310     1.310
 assi 
   (( resid 17   and name  HB2 ))
   (( resid 17   and name  HE1 ))

      3.350     1.550     1.550
 assi 
   (( resid 17   and name  HE1 ))
   (( resid 62   and name  HB2 ))

      3.110     1.310     1.310
 assi 
   (( resid 17   and name  HE1 ))
   (( resid 18   and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 125  and name  HB1 ))
   (( resid 125  and name  HE22))

      3.205     1.405     1.405
 assi 
   (( resid 125  and name  HE22))
   (  resid 127  and name  HE# )

      2.995     1.195     1.195
 assi 
   (  resid 120  and name  HG1#)
   (( resid 125  and name  HE22))

      3.650     1.850     1.850
 assi 
   (  resid 120  and name  HG2#)
   (( resid 125  and name  HE22))

      3.650     1.850     1.850
 assi 
   (( resid 125  and name  HB1 ))
   (( resid 125  and name  HE21))

      3.205     1.405     1.405
 assi 
   (( resid 125  and name  HE21))
   (  resid 127  and name  HE# )

      2.995     1.195     1.195
 assi 
   (  resid 120  and name  HG1#)
   (( resid 125  and name  HE21))

      3.650     1.850     1.850
 assi 
   (  resid 120  and name  HG2#)
   (( resid 125  and name  HE21))

      3.650     1.850     1.850
 assi 
   (( resid 21   and name  HB2 ))
   (( resid 21   and name  HE21))

      3.030     1.230     1.230
 assi 
   (( resid 21   and name  HE21))
   (  resid 26   and name  HG1#)

      3.125     1.325     1.325
 assi 
   (( resid 21   and name  HE21))
   (  resid 26   and name  HG2#)

      3.150     1.350     1.350
 assi 
   (( resid 21   and name  HE21))
   (( resid 22   and name  HB1 ))

      3.385     1.585     1.585
 assi 
   (( resid 42   and name  HE22))
   (( resid 47   and name  HE2 ))

      3.650     1.850     1.850
 assi 
   (( resid 42   and name  HE22))
   (( resid 47   and name  HE1 ))

      3.650     1.850     1.850
 assi 
   (( resid 21   and name  HE22))
   (  resid 26   and name  HG1#)

      3.170     1.370     1.370
 assi 
   (( resid 21   and name  HE22))
   (  resid 26   and name  HG2#)

      2.980     1.180     1.180
 assi 
   (( resid 121  and name  HA  ))
   (( resid 121  and name  HD22))

      3.105     1.305     1.305
 assi 
   (( resid 121  and name  HB2 ))
   (( resid 121  and name  HD22))

      2.810     1.010     1.010
 assi 
   (( resid 121  and name  HA  ))
   (( resid 121  and name  HD21))

      3.210     1.410     1.410
 assi 
   (( resid 120  and name  HB  ))
   (( resid 121  and name  HD21))

      3.305     1.505     1.505
 assi 
   (( resid 121  and name  HB2 ))
   (( resid 121  and name  HD21))

      2.550     0.750     0.750
 assi 
   (( resid 66   and name  HB2 ))
   (( resid 66   and name  HD21))

      2.600     0.800     0.800
 assi 
   (( resid 44   and name  HB2 ))
   (( resid 66   and name  HD21))

      3.045     1.245     1.245
 assi 
   (( resid 66   and name  HB2 ))
   (( resid 66   and name  HD22))

      2.740     0.940     0.940
 assi 
   (( resid 21   and name  HG1 ))
   (( resid 22   and name  HD21))

      3.175     1.375     1.375
 assi 
   (( resid 22   and name  HB2 ))
   (( resid 22   and name  HD22))

      2.665     0.865     0.865
 assi 
   (( resid 29   and name  HA  ))
   (( resid 63   and name  HE21))

      3.150     1.350     1.350
 assi 
   (  resid 29   and name  HE# )
   (( resid 63   and name  HE21))

      3.330     1.530     1.530
 assi 
   (( resid 29   and name  HA  ))
   (( resid 63   and name  HE22))

      3.135     1.335     1.335
 assi 
   (( resid 63   and name  HG1 ))
   (( resid 63   and name  HE22))

      2.945     1.145     1.145
 assi 
   (( resid 63   and name  HG2 ))
   (( resid 63   and name  HE22))

      2.945     1.145     1.145
 assi 
   (  resid 29   and name  HE# )
   (( resid 63   and name  HE22))

      3.010     1.210     1.210
 assi 
   (  resid 59   and name  HG1#)
   (( resid 63   and name  HE22))

      3.110     1.310     1.310
 assi 
   (( resid 42   and name  HA  ))
   (( resid 42   and name  HE21))

      3.450     1.650     1.650
 assi 
   (( resid 42   and name  HE21))
   (( resid 47   and name  HA  ))

      2.890     1.090     1.090
 assi 
   (( resid 42   and name  HE21))
   (( resid 47   and name  HB1 ))

      3.175     1.375     1.375
 assi 
   (( resid 42   and name  HE21))
   (( resid 47   and name  HB2 ))

      3.175     1.375     1.375
 assi 
   (( resid 42   and name  HE21))
   (  resid 47   and name  HG# )

      3.650     1.850     1.850
 assi 
   (( resid 42   and name  HE21))
   (  resid 49   and name  HD1#)

      3.025     1.225     1.225
 assi 
   (( resid 42   and name  HE22))
   (( resid 47   and name  HA  ))

      2.980     1.180     1.180
 assi 
   (( resid 42   and name  HB1 ))
   (( resid 42   and name  HE22))

      3.305     1.505     1.505
 assi 
   (( resid 42   and name  HB2 ))
   (( resid 42   and name  HE22))

      3.305     1.505     1.505
 assi 
   (( resid 42   and name  HE22))
   (  resid 68   and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 9    and name  HA  ))
   (( resid 9    and name  HE22))

      3.535     1.735     1.735
 assi 
   (( resid 140  and name  HA  ))
   (( resid 140  and name  HE22))

      3.625     1.825     1.825
 assi 
   (( resid 140  and name  HG2 ))
   (( resid 140  and name  HE22))

      2.925     1.125     1.125
 assi 
   (( resid 140  and name  HG2 ))
   (( resid 140  and name  HE21))

      2.925     1.125     1.125
 assi 
   (( resid 9    and name  HA  ))
   (( resid 9    and name  HE21))

      3.535     1.735     1.735
 assi 
   (( resid 140  and name  HA  ))
   (( resid 140  and name  HE21))

      3.625     1.825     1.825
 assi 
   (( resid 54   and name  HN  ))
   (( resid 54   and name  HB  ))

      2.845     1.045     1.045
 assi 
   (  resid 53   and name  HG2#)
   (( resid 54   and name  HN  ))

      2.900     1.100     1.100
 assi 
   (( resid 38   and name  HA  ))
   (( resid 54   and name  HN  ))

      3.060     1.260     1.260
 assi 
   (( resid 114  and name  HN  ))
   (  resid 116  and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 91   and name  HN  ))
   (( resid 130  and name  HA  ))

      3.470     1.670     1.670
 assi 
   (  resid 90   and name  HD1#)
   (( resid 91   and name  HN  ))

      3.185     1.385     1.385
 assi 
   (( resid 91   and name  HN  ))
   (( resid 91   and name  HE3 ))

      3.015     1.215     1.215
 assi 
   (( resid 134  and name  HA  ))
   (( resid 136  and name  HN  ))

      3.130     1.330     1.330
 assi 
   (( resid 135  and name  HA  ))
   (( resid 140  and name  HN  ))

      3.175     1.375     1.375
 assi 
   (( resid 133  and name  HA2 ))
   (( resid 136  and name  HN  ))

      2.945     1.145     1.145
 assi 
   (( resid 133  and name  HA1 ))
   (( resid 136  and name  HN  ))

      3.410     1.610     1.610
 assi 
   (( resid 135  and name  HB1 ))
   (( resid 136  and name  HN  ))

      2.865     1.065     1.065
 assi 
   (( resid 28   and name  HN  ))
   (( resid 63   and name  HE21))

      3.650     1.850     1.850
 assi 
   (( resid 21   and name  HN  ))
   (( resid 26   and name  HN  ))

      2.920     1.120     1.120
 assi 
   (( resid 39   and name  HN  ))
   (( resid 40   and name  HN  ))

      3.375     1.575     1.575
 assi 
   (( resid 39   and name  HN  ))
   (( resid 54   and name  HN  ))

      3.500     1.700     1.700
 assi 
   (( resid 36   and name  HB2 ))
   (( resid 37   and name  HN  ))

      3.290     1.490     1.490
 assi 
   (( resid 43   and name  HN  ))
   (( resid 50   and name  HN  ))

      3.010     1.210     1.210
 assi 
   (( resid 42   and name  HE21))
   (( resid 47   and name  HN  ))

      3.460     1.660     1.660
 assi 
   (( resid 37   and name  HN  ))
   (( resid 55   and name  HN  ))

      3.200     1.400     1.400
 assi 
   (( resid 68   and name  HA  ))
   (( resid 69   and name  HN  ))

      2.420     0.620     0.620
 assi 
   (( resid 68   and name  HB  ))
   (( resid 69   and name  HN  ))

      3.160     1.360     1.360
 assi 
   (( resid 69   and name  HN  ))
   (( resid 69   and name  HB2 ))

      2.390     0.590     0.590
 assi 
   (  resid 68   and name  HG2#)
   (( resid 69   and name  HN  ))

      2.700     0.900     0.900
 assi 
   (( resid 69   and name  HN  ))
   (  resid 70   and name  HG2#)

      3.245     1.445     1.445
 assi 
   (( resid 69   and name  HN  ))
   (  resid 69   and name  HD2#)

      3.165     1.365     1.365
 assi 
   (( resid 107  and name  HN  ))
   (( resid 108  and name  HN  ))

      2.710     0.910     0.910
 assi 
   (( resid 107  and name  HN  ))
   (( resid 109  and name  HN  ))

      3.305     1.505     1.505
 assi 
   (( resid 112  and name  HN  ))
   (( resid 113  and name  HN  ))

      2.615     0.815     0.815
 assi 
   (( resid 111  and name  HA  ))
   (( resid 112  and name  HN  ))

      2.900     1.100     1.100
 assi 
   (( resid 112  and name  HN  ))
   (( resid 112  and name  HG2 ))

      2.890     1.090     1.090
 assi 
   (( resid 115  and name  HN  ))
   (( resid 116  and name  HN  ))

      3.205     1.405     1.405
 assi 
   (( resid 118  and name  HN  ))
   (( resid 127  and name  HN  ))

      2.940     1.140     1.140
 assi 
   (( resid 128  and name  HN  ))
   (( resid 132  and name  HN  ))

      2.905     1.105     1.105
 assi 
   (( resid 128  and name  HN  ))
   (( resid 131  and name  HN  ))

      3.065     1.265     1.265
 assi 
   (( resid 140  and name  HN  ))
   (( resid 141  and name  HN  ))

      3.240     1.440     1.440
 assi 
   (( resid 142  and name  HN  ))
   (( resid 143  and name  HN  ))

      3.160     1.360     1.360
 assi 
   (( resid 144  and name  HN  ))
   (( resid 145  and name  HN  ))

      3.295     1.495     1.495
 assi 
   (( resid 146  and name  HN  ))
   (( resid 147  and name  HN  ))

      3.125     1.325     1.325
 assi 
   (( resid 127  and name  HN  ))
   (( resid 150  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 111  and name  HN  ))
   (( resid 112  and name  HN  ))

      3.320     1.520     1.520
 assi 
   (( resid 150  and name  HN  ))
   (( resid 151  and name  HN  ))

      3.500     1.700     1.700
 assi 
   (( resid 153  and name  HN  ))
   (( resid 154  and name  HN  ))

      2.875     1.075     1.075
 assi 
   (( resid 123  and name  HB2 ))
   (( resid 124  and name  HN  ))

      2.905     1.105     1.105
 assi 
   (  resid 54   and name  HG1#)
   (  resid 114  and name  HE# )

      3.650     1.850     1.850
 assi 
   (( resid 17   and name  HB1 ))
   (  resid 114  and name  HE# )

      3.050     1.250     1.250
 assi 
   (( resid 55   and name  HA  ))
   (  resid 114  and name  HE# )

      3.040     1.240     1.240
 assi 
   (( resid 29   and name  HB1 ))
   (  resid 31   and name  HE# )

      3.065     1.265     1.265
 assi 
   (( resid 17   and name  HN  ))
   (( resid 17   and name  HE3 ))

      3.210     1.410     1.410
 assi 
   (( resid 29   and name  HB2 ))
   (  resid 31   and name  HD# )

      3.110     1.310     1.310
 assi 
   (( resid 17   and name  HD1 ))
   (( resid 62   and name  HB2 ))

      3.130     1.330     1.330
 assi 
   (  resid 39   and name  HG2#)
   (( resid 54   and name  HB  ))

      3.425     1.625     1.625
 assi 
   (  resid 39   and name  HG2#)
   (( resid 57   and name  HB2 ))

      3.560     1.760     1.760
 assi 
   (  resid 39   and name  HG2#)
   (  resid 41   and name  HB# )

      2.750     0.950     0.950
 assi 
   (  resid 39   and name  HG2#)
   (( resid 52   and name  HB2 ))

      2.910     1.110     1.110
 assi 
   (( resid 38   and name  HA  ))
   (  resid 39   and name  HG2#)

      2.875     1.075     1.075
 assi 
   (  resid 39   and name  HG2#)
   (( resid 53   and name  HB  ))

      3.650     1.850     1.850
 assi 
   (  resid 39   and name  HG2#)
   (( resid 147  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (  resid 39   and name  HG2#)
   (( resid 54   and name  HN  ))

      3.185     1.385     1.385
 assi 
   (( resid 39   and name  HN  ))
   (  resid 39   and name  HG2#)

      2.675     0.875     0.875
 assi 
   (( resid 140  and name  HA  ))
   (  resid 142  and name  HD1#)

      3.405     1.605     1.605
 assi 
   (  resid 142  and name  HD1#)
   (( resid 143  and name  HA  ))

      3.435     1.635     1.635
 assi 
   (( resid 136  and name  HN  ))
   (  resid 142  and name  HD1#)

      3.110     1.310     1.310
 assi 
   (( resid 142  and name  HN  ))
   (  resid 142  and name  HD1#)

      2.895     1.095     1.095
 assi 
   (  resid 142  and name  HG2#)
   (( resid 142  and name  HG12))

      2.580     0.780     0.780
 assi 
   (( resid 101  and name  HA  ))
   (  resid 102  and name  HG1#)

      3.650     1.850     1.850
 assi 
   (  resid 49   and name  HG2#)
   (( resid 70   and name  HB  ))

      2.790     0.990     0.990
 assi 
   (( resid 141  and name  HA  ))
   (  resid 142  and name  HG2#)

      2.840     1.040     1.040
 assi 
   (( resid 49   and name  HN  ))
   (  resid 49   and name  HG2#)

      2.830     1.030     1.030
 assi 
   (  resid 49   and name  HG2#)
   (( resid 75   and name  HN  ))

      2.835     1.035     1.035
 assi 
   (  resid 142  and name  HG2#)
   (( resid 143  and name  HN  ))

      2.925     1.125     1.125
 assi 
   (( resid 102  and name  HN  ))
   (  resid 102  and name  HG1#)

      2.895     1.095     1.095
 assi 
   (  resid 116  and name  HG2#)
   (( resid 116  and name  HG11))

      2.570     0.770     0.770
 assi 
   (( resid 114  and name  HB2 ))
   (  resid 116  and name  HG2#)

      2.965     1.165     1.165
 assi 
   (( resid 114  and name  HB1 ))
   (  resid 116  and name  HG2#)

      2.965     1.165     1.165
 assi 
   (( resid 57   and name  HG2 ))
   (  resid 147  and name  HG2#)

      2.780     0.980     0.980
 assi 
   (  resid 57   and name  HE# )
   (  resid 147  and name  HG2#)

      3.020     1.220     1.220
 assi 
   (( resid 146  and name  HA  ))
   (  resid 147  and name  HG2#)

      2.835     1.035     1.035
 assi 
   (( resid 146  and name  HB2 ))
   (  resid 147  and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 146  and name  HB1 ))
   (  resid 147  and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 150  and name  HB2 ))
   (  resid 152  and name  HB# )

      2.910     1.110     1.110
 assi 
   (( resid 125  and name  HG1 ))
   (  resid 152  and name  HB# )

      2.790     0.990     0.990
 assi 
   (( resid 78   and name  HB2 ))
   (  resid 79   and name  HB# )

      2.715     0.915     0.915
 assi 
   (  resid 78   and name  HG# )
   (  resid 79   and name  HB# )

      2.900     1.100     1.100
 assi 
   (( resid 10   and name  HN  ))
   (  resid 10   and name  HB# )

      2.445     0.645     0.645
 assi 
   (  resid 79   and name  HB# )
   (( resid 80   and name  HN  ))

      2.600     0.800     0.800
 assi 
   (( resid 37   and name  HB2 ))
   (  resid 116  and name  HG2#)

      3.050     1.250     1.250
 assi 
   (  resid 81   and name  HB# )
   (( resid 82   and name  HN  ))

      2.540     0.740     0.740
 assi 
   (( resid 120  and name  HN  ))
   (  resid 120  and name  HG2#)

      2.930     1.130     1.130
 assi 
   (( resid 26   and name  HN  ))
   (  resid 26   and name  HG1#)

      2.705     0.905     0.905
 assi 
   (  resid 53   and name  HG2#)
   (( resid 54   and name  HB  ))

      3.345     1.545     1.545
 assi 
   (( resid 42   and name  HB2 ))
   (  resid 68   and name  HG2#)

      2.960     1.160     1.160
 assi 
   (  resid 68   and name  HG2#)
   (( resid 69   and name  HB2 ))

      3.160     1.360     1.360
 assi 
   (( resid 75   and name  HB2 ))
   (  resid 76   and name  HG2#)

      3.630     1.830     1.830
 assi 
   (( resid 41   and name  HA  ))
   (  resid 68   and name  HG2#)

      3.545     1.745     1.745
 assi 
   (( resid 75   and name  HA  ))
   (  resid 76   and name  HG2#)

      3.650     1.850     1.850
 assi 
   (  resid 39   and name  HG2#)
   (  resid 54   and name  HG1#)

      3.200     1.400     1.400
 assi 
   (( resid 54   and name  HN  ))
   (  resid 54   and name  HG1#)

      3.040     1.240     1.240
 assi 
   (( resid 119  and name  HN  ))
   (  resid 145  and name  HG2#)

      2.735     0.935     0.935
 assi 
   (( resid 145  and name  HN  ))
   (  resid 145  and name  HG2#)

      2.785     0.985     0.985
 assi 
   (  resid 54   and name  HG2#)
   (( resid 114  and name  HB2 ))

      3.530     1.730     1.730
 assi 
   (( resid 93   and name  HA  ))
   (( resid 93   and name  HG1 ))

      2.890     1.090     1.090
 assi 
   (( resid 54   and name  HN  ))
   (  resid 54   and name  HG2#)

      3.040     1.240     1.240
 assi 
   (( resid 37   and name  HN  ))
   (  resid 54   and name  HG2#)

      3.150     1.350     1.350
 assi 
   (( resid 70   and name  HN  ))
   (  resid 70   and name  HG2#)

      2.780     0.980     0.980
 assi 
   (( resid 40   and name  HA  ))
   (  resid 41   and name  HB# )

      3.055     1.255     1.255
 assi 
   (( resid 24   and name  HG1 ))
   (  resid 26   and name  HG2#)

      2.930     1.130     1.130
 assi 
   (( resid 45   and name  HA  ))
   (( resid 45   and name  HG1 ))

      2.850     1.050     1.050
 assi 
   (( resid 20   and name  HG  ))
   (( resid 23   and name  HA  ))

      3.220     1.420     1.420
 assi 
   (( resid 20   and name  HN  ))
   (( resid 20   and name  HG  ))

      3.115     1.315     1.315
 assi 
   (( resid 13   and name  HA  ))
   (( resid 13   and name  HD2 ))

      3.185     1.385     1.385
 assi 
   (( resid 13   and name  HA  ))
   (( resid 13   and name  HD1 ))

      3.185     1.385     1.385
 assi 
   (( resid 140  and name  HB2 ))
   (( resid 141  and name  HN  ))

      3.130     1.330     1.330
 assi 
   (( resid 131  and name  HB2 ))
   (( resid 132  and name  HN  ))

      3.025     1.225     1.225
 assi 
   (( resid 43   and name  HA  ))
   (( resid 44   and name  HB2 ))

      3.190     1.390     1.390
 assi 
   (  resid 106  and name  HB# )
   (( resid 131  and name  HB1 ))

      2.890     1.090     1.090
 assi 
   (( resid 128  and name  HN  ))
   (( resid 131  and name  HB1 ))

      3.210     1.410     1.410
 assi 
   (( resid 130  and name  HN  ))
   (( resid 131  and name  HB1 ))

      3.515     1.715     1.715
 assi 
   (( resid 144  and name  HB  ))
   (( resid 146  and name  HN  ))

      3.455     1.655     1.655
 assi 
   (( resid 110  and name  HN  ))
   (( resid 110  and name  HB1 ))

      2.890     1.090     1.090
 assi 
   (( resid 45   and name  HB1 ))
   (( resid 46   and name  HN  ))

      3.070     1.270     1.270
 assi 
   (( resid 48   and name  HN  ))
   (( resid 48   and name  HB1 ))

      2.825     1.025     1.025
 assi 
   (( resid 16   and name  HN  ))
   (( resid 16   and name  HG1 ))

      3.055     1.255     1.255
 assi 
   (( resid 78   and name  HB1 ))
   (( resid 79   and name  HN  ))

      2.960     1.160     1.160
 assi 
   (  resid 116  and name  HD1#)
   (( resid 127  and name  HG2 ))

      3.440     1.640     1.640
 assi 
   (( resid 127  and name  HG2 ))
   (  resid 127  and name  HE# )

      2.845     1.045     1.045
 assi 
   (( resid 17   and name  HB2 ))
   (( resid 58   and name  HB1 ))

      3.085     1.285     1.285
 assi 
   (( resid 118  and name  HN  ))
   (( resid 127  and name  HG2 ))

      3.590     1.790     1.790
 assi 
   (( resid 127  and name  HG2 ))
   (( resid 128  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 127  and name  HG2 ))
   (( resid 132  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 127  and name  HG1 ))
   (( resid 132  and name  HA  ))

      3.140     1.340     1.340
 assi 
   (( resid 127  and name  HG1 ))
   (( resid 132  and name  HN  ))

      3.385     1.585     1.585
 assi 
   (( resid 118  and name  HN  ))
   (( resid 127  and name  HG1 ))

      3.360     1.560     1.560
 assi 
   (( resid 127  and name  HG1 ))
   (( resid 128  and name  HN  ))

      3.590     1.790     1.790
 assi 
   (( resid 57   and name  HA  ))
   (( resid 57   and name  HG1 ))

      2.885     1.085     1.085
 assi 
   (( resid 57   and name  HN  ))
   (( resid 57   and name  HG1 ))

      3.105     1.305     1.305
 assi 
   (( resid 12   and name  HB2 ))
   (( resid 13   and name  HN  ))

      2.780     0.980     0.980
 assi 
   (( resid 57   and name  HN  ))
   (( resid 57   and name  HG2 ))

      3.335     1.535     1.535
 assi 
   (( resid 125  and name  HG1 ))
   (( resid 126  and name  HN  ))

      3.015     1.215     1.215
 assi 
   (( resid 22   and name  HB1 ))
   (( resid 24   and name  HB1 ))

      3.260     1.460     1.460
 assi 
   (( resid 24   and name  HB1 ))
   (( resid 25   and name  HN  ))

      2.860     1.060     1.060
 assi 
   (( resid 21   and name  HG2 ))
   (( resid 22   and name  HB2 ))

      3.075     1.275     1.275
 assi 
   (( resid 60   and name  HA  ))
   (( resid 63   and name  HG1 ))

      3.080     1.280     1.280
 assi 
   (( resid 63   and name  HA  ))
   (( resid 63   and name  HG2 ))

      2.835     1.035     1.035
 assi 
   (( resid 60   and name  HA  ))
   (( resid 63   and name  HG2 ))

      3.080     1.280     1.280
 assi 
   (( resid 113  and name  HA1 ))
   (( resid 129  and name  HB1 ))

      3.100     1.300     1.300
 assi 
   (( resid 123  and name  HN  ))
   (( resid 123  and name  HB1 ))

      2.865     1.065     1.065
 assi 
   (( resid 123  and name  HB1 ))
   (( resid 124  and name  HN  ))

      2.905     1.105     1.105
 assi 
   (( resid 123  and name  HN  ))
   (( resid 123  and name  HB2 ))

      2.865     1.065     1.065
 assi 
   (( resid 83   and name  HB2 ))
   (( resid 84   and name  HN  ))

      3.120     1.320     1.320
 assi 
   (( resid 21   and name  HG1 ))
   (  resid 26   and name  HG1#)

      3.000     1.200     1.200
 assi 
   (( resid 21   and name  HG1 ))
   (( resid 24   and name  HN  ))

      3.410     1.610     1.610
 assi 
   (( resid 18   and name  HB1 ))
   (( resid 19   and name  HN  ))

      2.920     1.120     1.120
 assi 
   (( resid 119  and name  HG1 ))
   (  resid 145  and name  HG2#)

      2.895     1.095     1.095
 assi 
   (( resid 119  and name  HN  ))
   (( resid 119  and name  HG1 ))

      3.250     1.450     1.450
 assi 
   (( resid 119  and name  HG1 ))
   (( resid 122  and name  HN  ))

      3.100     1.300     1.300
 assi 
   (( resid 119  and name  HG1 ))
   (( resid 123  and name  HN  ))

      3.175     1.375     1.375
 assi 
   (( resid 112  and name  HN  ))
   (( resid 112  and name  HG1 ))

      2.890     1.090     1.090
 assi 
   (( resid 93   and name  HB1 ))
   (( resid 93   and name  HE2 ))

      3.650     1.850     1.850
 assi 
   (( resid 93   and name  HB1 ))
   (( resid 93   and name  HE1 ))

      3.650     1.850     1.850
 assi 
   (( resid 110  and name  HA  ))
   (( resid 110  and name  HG1 ))

      2.980     1.180     1.180
 assi 
   (( resid 82   and name  HN  ))
   (( resid 82   and name  HG1 ))

      2.965     1.165     1.165
 assi 
   (( resid 110  and name  HA  ))
   (( resid 110  and name  HG2 ))

      2.980     1.180     1.180
 assi 
   (( resid 82   and name  HN  ))
   (( resid 82   and name  HG2 ))

      2.965     1.165     1.165
 assi 
   (( resid 21   and name  HB2 ))
   (( resid 22   and name  HB2 ))

      2.900     1.100     1.100
 assi 
   (( resid 124  and name  HN  ))
   (( resid 124  and name  HG2 ))

      3.025     1.225     1.225
 assi 
   (( resid 48   and name  HA  ))
   (( resid 49   and name  HB  ))

      3.595     1.795     1.795
 assi 
   (( resid 40   and name  HB2 ))
   (  resid 49   and name  HG2#)

      3.225     1.425     1.425
 assi 
   (( resid 40   and name  HB2 ))
   (  resid 77   and name  HD1#)

      3.340     1.540     1.540
 assi 
   (( resid 73   and name  HN  ))
   (( resid 73   and name  HB1 ))

      2.890     1.090     1.090
 assi 
   (( resid 77   and name  HB2 ))
   (( resid 78   and name  HD1 ))

      3.395     1.595     1.595
 assi 
   (( resid 77   and name  HB2 ))
   (( resid 78   and name  HD2 ))

      3.055     1.255     1.255
 assi 
   (( resid 77   and name  HB1 ))
   (( resid 78   and name  HD1 ))

      3.220     1.420     1.420
 assi 
   (( resid 77   and name  HB1 ))
   (( resid 78   and name  HD2 ))

      3.020     1.220     1.220
 assi 
   (( resid 20   and name  HB1 ))
   (( resid 21   and name  HN  ))

      3.210     1.410     1.410
 assi 
   (( resid 20   and name  HB2 ))
   (( resid 21   and name  HN  ))

      3.210     1.410     1.410
 assi 
   (( resid 48   and name  HN  ))
   (( resid 48   and name  HD2 ))

      3.650     1.850     1.850
 assi 
   (( resid 46   and name  HB1 ))
   (( resid 48   and name  HD1 ))

      3.595     1.795     1.795
 assi 
   (( resid 135  and name  HA  ))
   (( resid 138  and name  HD2 ))

      3.425     1.625     1.625
 assi 
   (( resid 148  and name  HN  ))
   (( resid 148  and name  HD1 ))

      3.565     1.765     1.765
 assi 
   (( resid 123  and name  HE2 ))
   (( resid 124  and name  HN  ))

      3.425     1.625     1.625
 assi 
   (( resid 123  and name  HE1 ))
   (( resid 124  and name  HN  ))

      3.425     1.625     1.625
 assi 
   (( resid 50   and name  HB2 ))
   (  resid 52   and name  HD1#)

      3.640     1.840     1.840
 assi 
   (( resid 37   and name  HB2 ))
   (( resid 54   and name  HN  ))

      3.295     1.495     1.495
 assi 
   (( resid 37   and name  HB1 ))
   (  resid 54   and name  HG2#)

      3.640     1.840     1.840
 assi 
   (( resid 37   and name  HB1 ))
   (( resid 54   and name  HN  ))

      3.320     1.520     1.520
 assi 
   (( resid 48   and name  HN  ))
   (( resid 48   and name  HD1 ))

      3.650     1.850     1.850
 assi 
   (( resid 148  and name  HN  ))
   (( resid 148  and name  HD2 ))

      3.565     1.765     1.765
 assi 
   (( resid 113  and name  HA2 ))
   (( resid 129  and name  HB1 ))

      3.100     1.300     1.300
 assi 
   (( resid 119  and name  HG2 ))
   (( resid 122  and name  HA1 ))

      3.525     1.725     1.725
 assi 
   (( resid 10   and name  HA  ))
   (( resid 11   and name  HN  ))

      2.505     0.705     0.705
 assi 
   (( resid 42   and name  HG1 ))
   (( resid 43   and name  HA  ))

      3.510     1.710     1.710
 assi 
   (( resid 15   and name  HA  ))
   (( resid 17   and name  HN  ))

      3.160     1.360     1.360
 assi 
   (( resid 118  and name  HB  ))
   (( resid 132  and name  HA  ))

      3.525     1.725     1.725
 assi 
   (( resid 127  and name  HB2 ))
   (( resid 132  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 13   and name  HA  ))
   (( resid 13   and name  HG1 ))

      3.010     1.210     1.210
 assi 
   (( resid 22   and name  HA  ))
   (( resid 23   and name  HA  ))

      3.555     1.755     1.755
 assi 
   (( resid 117  and name  HA  ))
   (( resid 118  and name  HA  ))

      3.160     1.360     1.360
 assi 
   (( resid 37   and name  HA  ))
   (  resid 53   and name  HG2#)

      2.945     1.145     1.145
 assi 
   (( resid 48   and name  HA  ))
   (( resid 48   and name  HD1 ))

      3.555     1.755     1.755
 assi 
   (( resid 141  and name  HA  ))
   (( resid 142  and name  HN  ))

      2.370     0.570     0.570
 assi 
   (( resid 47   and name  HA  ))
   (( resid 47   and name  HD1 ))

      2.860     1.060     1.060
 assi 
   (( resid 72   and name  HA  ))
   (( resid 74   and name  HN  ))

      3.130     1.330     1.330
 assi 
   (( resid 45   and name  HA  ))
   (( resid 45   and name  HG2 ))

      2.850     1.050     1.050
 assi 
   (( resid 60   and name  HA  ))
   (( resid 63   and name  HB1 ))

      3.175     1.375     1.375
 assi 
   (  resid 49   and name  HD1#)
   (( resid 74   and name  HA  ))

      3.535     1.735     1.735
 assi 
   (  resid 106  and name  HB# )
   (( resid 107  and name  HA  ))

      2.915     1.115     1.115
 assi 
   (( resid 16   and name  HA  ))
   (  resid 114  and name  HD# )

      3.605     1.805     1.805
 assi 
   (  resid 106  and name  HB# )
   (( resid 131  and name  HA  ))

      2.875     1.075     1.075
 assi 
   (( resid 116  and name  HA  ))
   (  resid 126  and name  HG2#)

      3.225     1.425     1.425
 assi 
   (( resid 39   and name  HA  ))
   (  resid 77   and name  HD1#)

      2.955     1.155     1.155
 assi 
   (( resid 116  and name  HG11))
   (( resid 129  and name  HA  ))

      3.290     1.490     1.490
 assi 
   (( resid 114  and name  HA  ))
   (( resid 115  and name  HA  ))

      3.115     1.315     1.315
 assi 
   (( resid 107  and name  HA  ))
   (( resid 109  and name  HN  ))

      3.020     1.220     1.220
 assi 
   (( resid 17   and name  HD1 ))
   (( resid 62   and name  HA  ))

      3.500     1.700     1.700
 assi 
   (( resid 57   and name  HN  ))
   (( resid 58   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 56   and name  HA  ))
   (  resid 59   and name  HG1#)

      3.195     1.395     1.395
 assi 
   (( resid 56   and name  HA  ))
   (  resid 59   and name  HG2#)

      3.090     1.290     1.290
 assi 
   (( resid 76   and name  HA  ))
   (  resid 77   and name  HD1#)

      3.435     1.635     1.635
 assi 
   (( resid 76   and name  HA  ))
   (( resid 77   and name  HB2 ))

      3.090     1.290     1.290
 assi 
   (( resid 129  and name  HB1 ))
   (( resid 130  and name  HA  ))

      2.945     1.145     1.145
 assi 
   (( resid 55   and name  HA  ))
   (  resid 114  and name  HD# )

      2.785     0.985     0.985
 assi 
   (( resid 141  and name  HB2 ))
   (( resid 142  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 141  and name  HB1 ))
   (( resid 142  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 107  and name  HN  ))
   (( resid 107  and name  HB2 ))

      2.820     1.020     1.020
 assi 
   (( resid 126  and name  HA  ))
   (( resid 127  and name  HG1 ))

      3.265     1.465     1.465
 assi 
   (( resid 125  and name  HG2 ))
   (( resid 126  and name  HA  ))

      3.185     1.385     1.385
 assi 
   (( resid 126  and name  HA  ))
   (( resid 127  and name  HA  ))

      3.130     1.330     1.330
 assi 
   (( resid 118  and name  HN  ))
   (( resid 126  and name  HA  ))

      3.120     1.320     1.320
 assi 
   (( resid 23   and name  HN  ))
   (( resid 23   and name  HB1 ))

      2.930     1.130     1.130
 assi 
   (( resid 117  and name  HA  ))
   (( resid 149  and name  HA  ))

      3.170     1.370     1.370
 assi 
   (( resid 36   and name  HB1 ))
   (( resid 55   and name  HB1 ))

      3.245     1.445     1.445
 assi 
   (( resid 115  and name  HB1 ))
   (  resid 116  and name  HG2#)

      3.650     1.850     1.850
 assi 
   (  resid 116  and name  HG2#)
   (( resid 149  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 116  and name  HA  ))
   (( resid 149  and name  HA  ))

      3.280     1.480     1.480
 assi 
   (( resid 142  and name  HA  ))
   (( resid 143  and name  HB2 ))

      3.100     1.300     1.300
 assi 
   (( resid 143  and name  HB2 ))
   (( resid 144  and name  HN  ))

      3.375     1.575     1.575
 assi 
   (( resid 119  and name  HN  ))
   (( resid 143  and name  HB2 ))

      3.210     1.410     1.410
 assi 
   (( resid 143  and name  HB1 ))
   (( resid 144  and name  HN  ))

      3.015     1.215     1.215
 assi 
   (( resid 30   and name  HA  ))
   (  resid 59   and name  HG1#)

      2.790     0.990     0.990
 assi 
   (( resid 145  and name  HB  ))
   (( resid 146  and name  HA  ))

      3.515     1.715     1.715
 assi 
   (( resid 70   and name  HN  ))
   (( resid 70   and name  HB  ))

      2.870     1.070     1.070
 assi 
   (( resid 154  and name  HN  ))
   (( resid 154  and name  HB  ))

      2.875     1.075     1.075
 assi 
   (( resid 154  and name  HB  ))
   (( resid 155  and name  HN  ))

      2.990     1.190     1.190
 assi 
   (( resid 68   and name  HN  ))
   (( resid 68   and name  HB  ))

      2.695     0.895     0.895
 assi 
   (( resid 38   and name  HB2 ))
   (  resid 77   and name  HD1#)

      2.890     1.090     1.090
 assi 
   (( resid 38   and name  HN  ))
   (( resid 38   and name  HB2 ))

      2.930     1.130     1.130
 assi 
   (( resid 52   and name  HB2 ))
   (( resid 53   and name  HN  ))

      3.150     1.350     1.350
 assi 
   (( resid 51   and name  HA  ))
   (( resid 52   and name  HG  ))

      3.350     1.550     1.550
 assi 
   (( resid 50   and name  HG  ))
   (  resid 52   and name  HD1#)

      2.770     0.970     0.970
 assi 
   (  resid 52   and name  HD1#)
   (  resid 67   and name  HD# )

      2.780     0.980     0.980
 assi 
   (( resid 52   and name  HB2 ))
   (  resid 52   and name  HD2#)

      2.560     0.760     0.760
 assi 
   (  resid 52   and name  HD2#)
   (( resid 53   and name  HN  ))

      2.810     1.010     1.010
 assi 
   (  resid 52   and name  HD2#)
   (( resid 57   and name  HN  ))

      3.180     1.380     1.380
 assi 
   (( resid 52   and name  HN  ))
   (  resid 52   and name  HD2#)

      3.290     1.490     1.490
 assi 
   (( resid 51   and name  HG1 ))
   (( resid 77   and name  HA  ))

      3.420     1.620     1.620
 assi 
   (( resid 119  and name  HG2 ))
   (( resid 122  and name  HA2 ))

      3.000     1.200     1.200
 assi 
   (( resid 119  and name  HG2 ))
   (( resid 143  and name  HB2 ))

      3.245     1.445     1.445
 assi 
   (( resid 19   and name  HN  ))
   (( resid 19   and name  HG2 ))

      2.990     1.190     1.190
 assi 
   (  resid 39   and name  HG1#)
   (( resid 147  and name  HA  ))

      3.075     1.275     1.275
 assi 
   (  resid 39   and name  HG1#)
   (( resid 53   and name  HA  ))

      3.120     1.320     1.320
 assi 
   (( resid 38   and name  HA  ))
   (  resid 39   and name  HG1#)

      3.005     1.205     1.205
 assi 
   (( resid 21   and name  HG1 ))
   (( resid 24   and name  HG2 ))

      2.975     1.175     1.175
 assi 
   (( resid 21   and name  HG1 ))
   (( resid 24   and name  HG1 ))

      3.040     1.240     1.240
 assi 
   (( resid 43   and name  HN  ))
   (( resid 48   and name  HG1 ))

      3.270     1.470     1.470
 assi 
   (( resid 48   and name  HN  ))
   (( resid 48   and name  HG1 ))

      2.920     1.120     1.120
 assi 
   (( resid 43   and name  HN  ))
   (( resid 48   and name  HG2 ))

      3.270     1.470     1.470
 assi 
   (( resid 48   and name  HN  ))
   (( resid 48   and name  HG2 ))

      2.920     1.120     1.120
 assi 
   (( resid 42   and name  HB1 ))
   (  resid 49   and name  HD1#)

      3.080     1.280     1.280
 assi 
   (  resid 49   and name  HD1#)
   (( resid 74   and name  HB1 ))

      2.805     1.005     1.005
 assi 
   (( resid 42   and name  HE22))
   (  resid 49   and name  HD1#)

      3.080     1.280     1.280
 assi 
   (  resid 50   and name  HD1#)
   (( resid 51   and name  HD2 ))

      3.060     1.260     1.260
 assi 
   (  resid 50   and name  HD2#)
   (( resid 51   and name  HD2 ))

      3.060     1.260     1.260
 assi 
   (  resid 50   and name  HD2#)
   (  resid 67   and name  HD# )

      3.160     1.360     1.360
 assi 
   (( resid 43   and name  HN  ))
   (  resid 50   and name  HD2#)

      3.320     1.520     1.520
 assi 
   (( resid 50   and name  HN  ))
   (  resid 50   and name  HD2#)

      3.035     1.235     1.235
 assi 
   (( resid 55   and name  HA  ))
   (  resid 59   and name  HG2#)

      3.085     1.285     1.285
 assi 
   (( resid 29   and name  HA  ))
   (  resid 59   and name  HG1#)

      2.830     1.030     1.030
 assi 
   (  resid 59   and name  HG1#)
   (( resid 63   and name  HE21))

      2.950     1.150     1.150
 assi 
   (( resid 60   and name  HB1 ))
   (  resid 60   and name  HD1#)

      2.670     0.870     0.870
 assi 
   (( resid 57   and name  HB2 ))
   (  resid 60   and name  HD1#)

      3.275     1.475     1.475
 assi 
   (  resid 60   and name  HD1#)
   (  resid 67   and name  HD# )

      3.005     1.205     1.205
 assi 
   (( resid 60   and name  HB2 ))
   (  resid 60   and name  HD2#)

      2.670     0.870     0.870
 assi 
   (( resid 60   and name  HN  ))
   (  resid 60   and name  HD2#)

      3.065     1.265     1.265
 assi 
   (( resid 69   and name  HN  ))
   (  resid 69   and name  HD1#)

      3.165     1.365     1.365
 assi 
   (( resid 41   and name  HA  ))
   (  resid 69   and name  HD2#)

      3.495     1.695     1.695
 assi 
   (( resid 36   and name  HA  ))
   (  resid 90   and name  HD2#)

      3.180     1.380     1.380
 assi 
   (  resid 90   and name  HD2#)
   (( resid 91   and name  HN  ))

      3.185     1.385     1.385
 assi 
   (( resid 77   and name  HB2 ))
   (  resid 77   and name  HD1#)

      2.645     0.845     0.845
 assi 
   (( resid 51   and name  HB1 ))
   (  resid 77   and name  HD1#)

      2.670     0.870     0.870
 assi 
   (( resid 51   and name  HB2 ))
   (  resid 77   and name  HD1#)

      2.930     1.130     1.130
 assi 
   (( resid 77   and name  HA  ))
   (  resid 77   and name  HD1#)

      2.525     0.725     0.725
 assi 
   (( resid 40   and name  HA  ))
   (  resid 77   and name  HD1#)

      3.000     1.200     1.200
 assi 
   (( resid 51   and name  HA  ))
   (  resid 77   and name  HD1#)

      2.865     1.065     1.065
 assi 
   (  resid 77   and name  HD1#)
   (  resid 78   and name  HG# )

      3.245     1.445     1.445
 assi 
   (( resid 77   and name  HG  ))
   (  resid 78   and name  HG# )

      3.800     2.000     2.000
 assi 
   (  resid 134  and name  HB# )
   (( resid 135  and name  HB2 ))

      3.435     1.635     1.635
 assi 
   (( resid 131  and name  HB2 ))
   (  resid 134  and name  HB# )

      3.650     1.850     1.850
 assi 
   (  resid 134  and name  HB# )
   (( resid 135  and name  HA  ))

      3.140     1.340     1.340
 assi 
   (( resid 91   and name  HD1 ))
   (  resid 134  and name  HB# )

      3.360     1.560     1.560
 assi 
   (( resid 13   and name  HN  ))
   (( resid 13   and name  HD2 ))

      3.650     1.850     1.850
 assi 
   (( resid 13   and name  HN  ))
   (( resid 13   and name  HD1 ))

      3.650     1.850     1.850
 assi 
   (( resid 105  and name  HG1 ))
   (( resid 106  and name  HN  ))

      3.425     1.625     1.625
 assi 
   (( resid 105  and name  HN  ))
   (( resid 105  and name  HG1 ))

      2.870     1.070     1.070
 assi 
   (( resid 105  and name  HG2 ))
   (( resid 106  and name  HN  ))

      3.425     1.625     1.625
 assi 
   (( resid 108  and name  HN  ))
   (( resid 108  and name  HG2 ))

      3.630     1.830     1.830
 assi 
   (( resid 108  and name  HN  ))
   (( resid 108  and name  HG1 ))

      3.630     1.830     1.830
 assi 
   (( resid 114  and name  HB1 ))
   (  resid 116  and name  HD1#)

      3.650     1.850     1.850
 assi 
   (  resid 116  and name  HD1#)
   (( resid 127  and name  HG1 ))

      3.180     1.380     1.380
 assi 
   (( resid 37   and name  HB1 ))
   (  resid 116  and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 37   and name  HG  ))
   (  resid 116  and name  HD1#)

      3.650     1.850     1.850
 assi 
   (  resid 120  and name  HG1#)
   (( resid 121  and name  HN  ))

      2.990     1.190     1.190
 assi 
   (( resid 119  and name  HG2 ))
   (( resid 124  and name  HA  ))

      3.510     1.710     1.710
 assi 
   (( resid 15   and name  HN  ))
   (( resid 18   and name  HB2 ))

      3.035     1.235     1.235
 assi 
   (( resid 125  and name  HB1 ))
   (  resid 127  and name  HE# )

      2.620     0.820     0.820
 assi 
   (( resid 125  and name  HG1 ))
   (( resid 126  and name  HB  ))

      3.190     1.390     1.390
 assi 
   (( resid 126  and name  HN  ))
   (  resid 126  and name  HG2#)

      2.855     1.055     1.055
 assi 
   (( resid 131  and name  HN  ))
   (( resid 131  and name  HG2 ))

      3.470     1.670     1.670
 assi 
   (( resid 131  and name  HN  ))
   (( resid 131  and name  HG1 ))

      3.470     1.670     1.670
 assi 
   (( resid 135  and name  HB2 ))
   (( resid 142  and name  HG12))

      3.650     1.850     1.850
 assi 
   (( resid 142  and name  HG12))
   (( resid 144  and name  HB  ))

      3.650     1.850     1.850
 assi 
   (( resid 136  and name  HA  ))
   (( resid 142  and name  HG12))

      3.270     1.470     1.470
 assi 
   (( resid 136  and name  HA  ))
   (( resid 142  and name  HG11))

      3.185     1.385     1.385
 assi 
   (( resid 142  and name  HN  ))
   (( resid 142  and name  HG11))

      3.015     1.215     1.215
 assi 
   (( resid 147  and name  HA  ))
   (  resid 147  and name  HD1#)

      3.050     1.250     1.250
 assi 
   (  resid 147  and name  HD1#)
   (( resid 148  and name  HN  ))

      3.090     1.290     1.290
 assi 
   (( resid 90   and name  HA  ))
   (  resid 90   and name  HD1#)

      3.080     1.280     1.280
 assi 
   (  resid 29   and name  HE# )
   (  resid 31   and name  HD# )

      3.320     1.520     1.520
 assi 
   (  resid 29   and name  HE# )
   (  resid 31   and name  HE# )

      2.840     1.040     1.040
 assi 
   (  resid 57   and name  HE# )
   (  resid 147  and name  HD1#)

      2.730     0.930     0.930
 assi 
   (( resid 57   and name  HB1 ))
   (  resid 57   and name  HE# )

      2.725     0.925     0.925
 assi 
   (  resid 57   and name  HE# )
   (( resid 69   and name  HN  ))

      3.245     1.445     1.445
 assi 
   (  resid 57   and name  HE# )
   (( resid 67   and name  HN  ))

      3.120     1.320     1.320
 assi 
   (  resid 127  and name  HE# )
   (  resid 132  and name  HB# )

      2.970     1.170     1.170
 assi 
   (( resid 118  and name  HA  ))
   (  resid 127  and name  HE# )

      3.650     1.850     1.850
 assi 
   (( resid 124  and name  HA  ))
   (  resid 127  and name  HE# )

      3.650     1.850     1.850
 assi 
   (( resid 127  and name  HA  ))
   (  resid 127  and name  HE# )

      3.480     1.680     1.680
 assi 
   (  resid 127  and name  HE# )
   (( resid 132  and name  HA  ))

      3.040     1.240     1.240
 assi 
   (( resid 127  and name  HG1 ))
   (  resid 127  and name  HE# )

      2.555     0.755     0.755
 assi 
   (( resid 118  and name  HN  ))
   (  resid 127  and name  HE# )

      3.080     1.280     1.280
 assi 
   (( resid 135  and name  HN  ))
   (  resid 135  and name  HD2#)

      2.865     1.065     1.065
 assi 
   (( resid 40   and name  HB1 ))
   (( resid 75   and name  HB1 ))

      3.210     1.410     1.410
 assi 
   (( resid 103  and name  HB2 ))
   (( resid 137  and name  HB2 ))

      3.320     1.520     1.520
 assi 
   (( resid 17   and name  HE3 ))
   (  resid 114  and name  HD# )

      3.315     1.515     1.515
 assi 
   (  resid 67   and name  HD# )
   (( resid 68   and name  HN  ))

      3.075     1.275     1.275
 assi 
   (( resid 81   and name  HA  ))
   (( resid 82   and name  HN  ))

      2.600     0.800     0.800
 assi 
   (( resid 82   and name  HA  ))
   (( resid 83   and name  HN  ))

      2.350     0.550     0.550
 assi 
   (( resid 114  and name  HN  ))
   (  resid 114  and name  HE# )

      3.475     1.675     1.675
 assi 
   (( resid 16   and name  HN  ))
   (  resid 114  and name  HE# )

      3.650     1.850     1.850
 assi 
   (  resid 114  and name  HE# )
   (( resid 115  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 146  and name  HB1 ))
   (( resid 148  and name  HN  ))

      3.045     1.245     1.245
 assi 
   (  resid 120  and name  HG2#)
   (  resid 127  and name  HE# )

      2.595     0.795     0.795
 assi 
   (  resid 49   and name  HD1#)
   (( resid 50   and name  HN  ))

      3.335     1.535     1.535
 assi 
   (  resid 57   and name  HE# )
   (( resid 68   and name  HB  ))

      3.650     1.850     1.850
 assi 
   (( resid 16   and name  HG1 ))
   (  resid 114  and name  HE# )

      3.580     1.780     1.780
 assi 
   (( resid 16   and name  HG2 ))
   (  resid 114  and name  HE# )

      3.580     1.780     1.780
 assi 
   (  resid 54   and name  HG2#)
   (  resid 114  and name  HE# )

      3.650     1.850     1.850
 assi 
   (( resid 114  and name  HA  ))
   (  resid 114  and name  HE# )

      3.130     1.330     1.330
 assi 
   (( resid 58   and name  HD2 ))
   (  resid 114  and name  HE# )

      3.575     1.775     1.775
 assi 
   (( resid 58   and name  HD2 ))
   (( resid 147  and name  HB  ))

      3.450     1.650     1.650
 assi 
   (( resid 57   and name  HG2 ))
   (( resid 58   and name  HD2 ))

      3.650     1.850     1.850
 assi 
   (( resid 58   and name  HD2 ))
   (  resid 114  and name  HD# )

      3.445     1.645     1.645
 assi 
   (( resid 58   and name  HB2 ))
   (  resid 114  and name  HD# )

      3.210     1.410     1.410
 assi 
   (( resid 58   and name  HB1 ))
   (  resid 114  and name  HD# )

      3.650     1.850     1.850
 assi 
   (( resid 54   and name  HB  ))
   (  resid 114  and name  HD# )

      3.650     1.850     1.850
 assi 
   (( resid 37   and name  HG  ))
   (( resid 91   and name  HZ2 ))

      3.530     1.730     1.730
 assi 
   (  resid 31   and name  HE# )
   (( resid 32   and name  HA  ))

      3.535     1.735     1.735
 assi 
   (( resid 29   and name  HG1 ))
   (  resid 31   and name  HE# )

      3.170     1.370     1.370
 assi 
   (( resid 29   and name  HG2 ))
   (  resid 31   and name  HE# )

      3.170     1.370     1.370
 assi 
   (( resid 29   and name  HB2 ))
   (  resid 31   and name  HE# )

      3.065     1.265     1.265
 assi 
   (( resid 37   and name  HG  ))
   (( resid 91   and name  HH2 ))

      3.300     1.500     1.500
 assi 
   (( resid 37   and name  HB2 ))
   (( resid 91   and name  HH2 ))

      3.440     1.640     1.640
 assi 
   (( resid 91   and name  HZ3 ))
   (( resid 130  and name  HA  ))

      3.625     1.825     1.825
 assi 
   (( resid 37   and name  HB2 ))
   (( resid 91   and name  HZ3 ))

      3.605     1.805     1.805
 assi 
   (  resid 37   and name  HD1#)
   (( resid 91   and name  HZ3 ))

      3.630     1.830     1.830
 assi 
   (( resid 91   and name  HE3 ))
   (( resid 130  and name  HA  ))

      3.035     1.235     1.235
 assi 
   (( resid 91   and name  HE3 ))
   (( resid 133  and name  HA1 ))

      3.240     1.440     1.440
 assi 
   (  resid 37   and name  HD1#)
   (( resid 91   and name  HE3 ))

      3.650     1.850     1.850
 assi 
   (( resid 29   and name  HB1 ))
   (  resid 31   and name  HD# )

      3.110     1.310     1.310
 assi 
   (  resid 31   and name  HD# )
   (  resid 59   and name  HG1#)

      3.650     1.850     1.850
 assi 
   (( resid 31   and name  HA  ))
   (  resid 31   and name  HD# )

      2.930     1.130     1.130
 assi 
   (  resid 31   and name  HD# )
   (( resid 32   and name  HA  ))

      3.095     1.295     1.295
 assi 
   (( resid 57   and name  HA  ))
   (  resid 67   and name  HE# )

      3.650     1.850     1.850
 assi 
   (( resid 43   and name  HA  ))
   (  resid 67   and name  HE# )

      3.030     1.230     1.230
 assi 
   (( resid 65   and name  HD2 ))
   (  resid 67   and name  HE# )

      3.650     1.850     1.850
 assi 
   (( resid 65   and name  HD1 ))
   (  resid 67   and name  HE# )

      3.650     1.850     1.850
 assi 
   (( resid 65   and name  HB1 ))
   (  resid 67   and name  HE# )

      2.785     0.985     0.985
 assi 
   (( resid 65   and name  HB2 ))
   (  resid 67   and name  HE# )

      2.650     0.850     0.850
 assi 
   (  resid 41   and name  HB# )
   (  resid 67   and name  HE# )

      2.985     1.185     1.185
 assi 
   (  resid 50   and name  HD1#)
   (  resid 67   and name  HE# )

      2.745     0.945     0.945
 assi 
   (  resid 52   and name  HD2#)
   (  resid 67   and name  HE# )

      3.145     1.345     1.345
 assi 
   (  resid 52   and name  HD1#)
   (  resid 67   and name  HE# )

      2.810     1.010     1.010
 assi 
   (( resid 67   and name  HA  ))
   (  resid 67   and name  HE# )

      3.255     1.455     1.455
 assi 
   (( resid 65   and name  HA  ))
   (  resid 67   and name  HE# )

      3.370     1.570     1.570
 assi 
   (( resid 91   and name  HD1 ))
   (( resid 103  and name  HA  ))

      3.215     1.415     1.415
 assi 
   (( resid 91   and name  HD1 ))
   (( resid 134  and name  HA  ))

      3.070     1.270     1.270
 assi 
   (( resid 91   and name  HD1 ))
   (( resid 137  and name  HB2 ))

      3.050     1.250     1.250
 assi 
   (( resid 91   and name  HD1 ))
   (( resid 137  and name  HB1 ))

      3.265     1.465     1.465
 assi 
   (( resid 17   and name  HD1 ))
   (( resid 62   and name  HB1 ))

      3.130     1.330     1.330
 assi 
   (( resid 57   and name  HB2 ))
   (  resid 67   and name  HD# )

      3.650     1.850     1.850
 assi 
   (  resid 52   and name  HD2#)
   (  resid 67   and name  HD# )

      3.460     1.660     1.660
 assi 
   (( resid 65   and name  HB1 ))
   (  resid 67   and name  HD# )

      3.055     1.255     1.255
 assi 
   (( resid 65   and name  HB2 ))
   (  resid 67   and name  HD# )

      3.145     1.345     1.345
 assi 
   (  resid 60   and name  HD2#)
   (  resid 67   and name  HD# )

      3.005     1.205     1.205
 assi 
   (( resid 65   and name  HA  ))
   (  resid 67   and name  HD# )

      3.445     1.645     1.645
 assi 
   (( resid 57   and name  HA  ))
   (  resid 67   and name  HD# )

      3.460     1.660     1.660
 assi 
   (  resid 39   and name  HG2#)
   (  resid 147  and name  HD1#)

      3.170     1.370     1.370
 assi 
   (  resid 39   and name  HG2#)
   (( resid 54   and name  HA  ))

      3.045     1.245     1.245
 assi 
   (  resid 39   and name  HG2#)
   (( resid 57   and name  HG2 ))

      3.025     1.225     1.225
 assi 
   (  resid 39   and name  HG2#)
   (( resid 53   and name  HA  ))

      2.860     1.060     1.060
 assi 
   (  resid 39   and name  HG2#)
   (( resid 40   and name  HA  ))

      3.160     1.360     1.360
 assi 
   (  resid 39   and name  HG2#)
   (( resid 52   and name  HA  ))

      3.420     1.620     1.620
 assi 
   (( resid 39   and name  HA  ))
   (  resid 39   and name  HG2#)

      2.720     0.920     0.920
 assi 
   (( resid 140  and name  HG2 ))
   (  resid 142  and name  HD1#)

      3.200     1.400     1.400
 assi 
   (( resid 140  and name  HG1 ))
   (  resid 142  and name  HD1#)

      3.280     1.480     1.480
 assi 
   (( resid 135  and name  HB2 ))
   (  resid 142  and name  HD1#)

      2.680     0.880     0.880
 assi 
   (( resid 136  and name  HB1 ))
   (  resid 142  and name  HD1#)

      2.805     1.005     1.005
 assi 
   (( resid 142  and name  HB  ))
   (  resid 142  and name  HD1#)

      2.820     1.020     1.020
 assi 
   (( resid 136  and name  HD2 ))
   (  resid 142  and name  HD1#)

      3.265     1.465     1.465
 assi 
   (( resid 136  and name  HD1 ))
   (  resid 142  and name  HD1#)

      3.265     1.465     1.465
 assi 
   (( resid 136  and name  HA  ))
   (  resid 142  and name  HD1#)

      2.840     1.040     1.040
 assi 
   (( resid 132  and name  HA  ))
   (  resid 142  and name  HD1#)

      3.380     1.580     1.580
 assi 
   (( resid 135  and name  HA  ))
   (  resid 142  and name  HD1#)

      3.485     1.685     1.685
 assi 
   (( resid 141  and name  HB2 ))
   (  resid 142  and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 141  and name  HB1 ))
   (  resid 142  and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 142  and name  HA  ))
   (  resid 142  and name  HD1#)

      2.755     0.955     0.955
 assi 
   (( resid 135  and name  HN  ))
   (  resid 142  and name  HD1#)

      3.415     1.615     1.615
 assi 
   (( resid 140  and name  HG1 ))
   (  resid 142  and name  HG2#)

      2.720     0.920     0.920
 assi 
   (( resid 120  and name  HB  ))
   (  resid 142  and name  HG2#)

      2.850     1.050     1.050
 assi 
   (( resid 135  and name  HB2 ))
   (  resid 142  and name  HG2#)

      2.795     0.995     0.995
 assi 
   (  resid 49   and name  HG2#)
   (( resid 74   and name  HB2 ))

      2.770     0.970     0.970
 assi 
   (( resid 49   and name  HA  ))
   (  resid 49   and name  HG2#)

      2.425     0.625     0.625
 assi 
   (( resid 120  and name  HA  ))
   (  resid 142  and name  HG2#)

      2.865     1.065     1.065
 assi 
   (  resid 49   and name  HG2#)
   (( resid 74   and name  HB1 ))

      2.770     0.970     0.970
 assi 
   (  resid 106  and name  HB# )
   (( resid 131  and name  HB2 ))

      2.680     0.880     0.880
 assi 
   (( resid 105  and name  HA  ))
   (  resid 106  and name  HB# )

      3.025     1.225     1.225
 assi 
   (  resid 106  and name  HB# )
   (( resid 132  and name  HN  ))

      3.640     1.840     1.840
 assi 
   (  resid 106  and name  HB# )
   (( resid 134  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (  resid 116  and name  HG2#)
   (( resid 128  and name  HA  ))

      3.350     1.550     1.550
 assi 
   (  resid 116  and name  HG2#)
   (( resid 148  and name  HA  ))

      3.490     1.690     1.690
 assi 
   (  resid 116  and name  HG2#)
   (( resid 117  and name  HN  ))

      2.960     1.160     1.160
 assi 
   (  resid 39   and name  HG2#)
   (  resid 147  and name  HG2#)

      2.785     0.985     0.985
 assi 
   (( resid 54   and name  HA  ))
   (  resid 147  and name  HG2#)

      2.825     1.025     1.025
 assi 
   (( resid 150  and name  HB1 ))
   (  resid 152  and name  HB# )

      2.910     1.110     1.110
 assi 
   (( resid 125  and name  HB2 ))
   (  resid 152  and name  HB# )

      2.830     1.030     1.030
 assi 
   (  resid 132  and name  HB# )
   (( resid 133  and name  HA2 ))

      2.885     1.085     1.085
 assi 
   (  resid 116  and name  HD1#)
   (  resid 132  and name  HB# )

      2.405     0.605     0.605
 assi 
   (  resid 132  and name  HB# )
   (( resid 133  and name  HA1 ))

      3.095     1.295     1.295
 assi 
   (( resid 127  and name  HG1 ))
   (  resid 132  and name  HB# )

      2.775     0.975     0.975
 assi 
   (( resid 118  and name  HB  ))
   (  resid 132  and name  HB# )

      2.910     1.110     1.110
 assi 
   (( resid 118  and name  HA  ))
   (  resid 132  and name  HB# )

      3.640     1.840     1.840
 assi 
   (( resid 128  and name  HA  ))
   (  resid 132  and name  HB# )

      3.650     1.850     1.850
 assi 
   (  resid 132  and name  HB# )
   (( resid 133  and name  HN  ))

      2.800     1.000     1.000
 assi 
   (  resid 132  and name  HB# )
   (( resid 135  and name  HN  ))

      3.435     1.635     1.635
 assi 
   (( resid 21   and name  HG2 ))
   (  resid 26   and name  HG2#)

      2.475     0.675     0.675
 assi 
   (( resid 21   and name  HB1 ))
   (  resid 26   and name  HG2#)

      2.690     0.890     0.890
 assi 
   (( resid 21   and name  HA  ))
   (  resid 26   and name  HG2#)

      3.410     1.610     1.610
 assi 
   (( resid 11   and name  HA  ))
   (  resid 11   and name  HG1#)

      2.575     0.775     0.775
 assi 
   (  resid 120  and name  HG2#)
   (( resid 125  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (  resid 84   and name  HB# )
   (( resid 85   and name  HA  ))

      3.400     1.600     1.600
 assi 
   (  resid 84   and name  HB# )
   (( resid 100  and name  HA  ))

      3.300     1.600     1.600
 assi 
   (  resid 11   and name  HG2#)
   (( resid 12   and name  HD1 ))

      3.325     1.525     1.525
 assi 
   (  resid 11   and name  HG2#)
   (( resid 12   and name  HD2 ))

      3.325     1.525     1.525
 assi 
   (( resid 11   and name  HA  ))
   (  resid 11   and name  HG2#)

      2.575     0.775     0.775
 assi 
   (( resid 26   and name  HA  ))
   (  resid 26   and name  HG1#)

      2.400     0.600     0.600
 assi 
   (( resid 67   and name  HB1 ))
   (  resid 68   and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 42   and name  HB1 ))
   (  resid 68   and name  HG2#)

      2.960     1.160     1.160
 assi 
   (( resid 68   and name  HA  ))
   (  resid 68   and name  HG2#)

      2.385     0.585     0.585
 assi 
   (( resid 8    and name  HA  ))
   (  resid 8    and name  HG2#)

      2.520     0.720     0.720
 assi 
   (( resid 76   and name  HA  ))
   (  resid 76   and name  HG2#)

      2.735     0.935     0.935
 assi 
   (( resid 154  and name  HA  ))
   (  resid 154  and name  HG2#)

      2.690     0.890     0.890
 assi 
   (( resid 144  and name  HA  ))
   (  resid 144  and name  HG1#)

      2.675     0.875     0.875
 assi 
   (( resid 144  and name  HA  ))
   (  resid 144  and name  HG2#)

      2.675     0.875     0.875
 assi 
   (( resid 37   and name  HB1 ))
   (  resid 54   and name  HG1#)

      3.640     1.840     1.840
 assi 
   (( resid 37   and name  HB2 ))
   (  resid 54   and name  HG1#)

      3.185     1.385     1.385
 assi 
   (  resid 54   and name  HG1#)
   (  resid 147  and name  HD1#)

      3.650     1.850     1.850
 assi 
   (  resid 54   and name  HG1#)
   (( resid 114  and name  HB2 ))

      3.530     1.730     1.730
 assi 
   (  resid 54   and name  HG1#)
   (( resid 147  and name  HB  ))

      2.800     1.000     1.000
 assi 
   (  resid 54   and name  HG1#)
   (( resid 147  and name  HA  ))

      3.045     1.245     1.245
 assi 
   (  resid 54   and name  HG1#)
   (( resid 114  and name  HB1 ))

      3.530     1.730     1.730
 assi 
   (( resid 36   and name  HA  ))
   (  resid 54   and name  HG1#)

      3.290     1.490     1.490
 assi 
   (  resid 54   and name  HG1#)
   (( resid 58   and name  HD2 ))

      3.385     1.585     1.585
 assi 
   (( resid 119  and name  HB2 ))
   (  resid 145  and name  HG2#)

      2.425     0.625     0.625
 assi 
   (( resid 42   and name  HB1 ))
   (  resid 70   and name  HG2#)

      2.625     0.825     0.825
 assi 
   (( resid 124  and name  HG1 ))
   (  resid 145  and name  HG2#)

      2.975     1.175     1.175
 assi 
   (( resid 145  and name  HA  ))
   (  resid 145  and name  HG2#)

      2.375     0.575     0.575
 assi 
   (( resid 118  and name  HA  ))
   (  resid 145  and name  HG2#)

      2.770     0.970     0.970
 assi 
   (  resid 54   and name  HG2#)
   (  resid 147  and name  HD1#)

      3.650     1.850     1.850
 assi 
   (  resid 39   and name  HG2#)
   (  resid 54   and name  HG2#)

      3.200     1.400     1.400
 assi 
   (  resid 54   and name  HG2#)
   (( resid 147  and name  HB  ))

      2.800     1.000     1.000
 assi 
   (( resid 37   and name  HB2 ))
   (  resid 54   and name  HG2#)

      3.185     1.385     1.385
 assi 
   (( resid 54   and name  HA  ))
   (  resid 54   and name  HG2#)

      2.695     0.895     0.895
 assi 
   (  resid 54   and name  HG2#)
   (( resid 58   and name  HD2 ))

      3.385     1.585     1.585
 assi 
   (( resid 36   and name  HA  ))
   (  resid 54   and name  HG2#)

      3.290     1.490     1.490
 assi 
   (( resid 42   and name  HB2 ))
   (  resid 70   and name  HG2#)

      2.625     0.825     0.825
 assi 
   (( resid 68   and name  HB  ))
   (  resid 70   and name  HG2#)

      2.755     0.955     0.955
 assi 
   (( resid 70   and name  HA  ))
   (  resid 70   and name  HG2#)

      2.440     0.640     0.640
 assi 
   (  resid 41   and name  HB# )
   (( resid 67   and name  HB1 ))

      2.675     0.875     0.875
 assi 
   (  resid 41   and name  HB# )
   (( resid 67   and name  HB2 ))

      2.860     1.060     1.060
 assi 
   (( resid 13   and name  HA  ))
   (( resid 13   and name  HG2 ))

      3.010     1.210     1.210
 assi 
   (  resid 41   and name  HB# )
   (( resid 69   and name  HA  ))

      2.665     0.865     0.865
 assi 
   (  resid 41   and name  HB# )
   (  resid 67   and name  HD# )

      2.725     0.925     0.925
 assi 
   (  resid 41   and name  HB# )
   (  resid 147  and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 37   and name  HB1 ))
   (  resid 37   and name  HD2#)

      2.820     1.020     1.020
 assi 
   (( resid 37   and name  HB2 ))
   (  resid 37   and name  HD2#)

      2.755     0.955     0.955
 assi 
   (  resid 37   and name  HD2#)
   (  resid 132  and name  HB# )

      2.975     1.175     1.175
 assi 
   (  resid 37   and name  HD2#)
   (( resid 129  and name  HG2 ))

      3.910     2.110     2.110
 assi 
   (  resid 37   and name  HD2#)
   (( resid 133  and name  HA2 ))

      3.410     1.610     1.610
 assi 
   (( resid 37   and name  HA  ))
   (  resid 37   and name  HD2#)

      2.975     1.175     1.175
 assi 
   (  resid 37   and name  HD2#)
   (( resid 129  and name  HA  ))

      3.295     1.495     1.495
 assi 
   (  resid 37   and name  HD2#)
   (( resid 133  and name  HN  ))

      3.235     1.435     1.435
 assi 
   (  resid 37   and name  HD2#)
   (( resid 91   and name  HE3 ))

      3.650     1.850     1.850
 assi 
   (  resid 37   and name  HD2#)
   (( resid 91   and name  HZ3 ))

      3.630     1.830     1.830
 assi 
   (( resid 24   and name  HG1 ))
   (  resid 26   and name  HG1#)

      2.545     0.745     0.745
 assi 
   (( resid 22   and name  HB2 ))
   (( resid 24   and name  HG2 ))

      2.915     1.115     1.115
 assi 
   (( resid 24   and name  HA  ))
   (( resid 24   and name  HG1 ))

      2.760     0.960     0.960
 assi 
   (( resid 50   and name  HG  ))
   (  resid 67   and name  HD# )

      3.570     1.770     1.770
 assi 
   (( resid 50   and name  HG  ))
   (  resid 67   and name  HE# )

      3.005     1.205     1.205
 assi 
   (( resid 50   and name  HG  ))
   (( resid 52   and name  HG  ))

      2.695     0.895     0.895
 assi 
   (( resid 20   and name  HA  ))
   (( resid 20   and name  HG  ))

      2.820     1.020     1.020
 assi 
   (( resid 20   and name  HG  ))
   (( resid 21   and name  HA  ))

      3.215     1.415     1.415
 assi 
   (( resid 135  and name  HB1 ))
   (( resid 140  and name  HB1 ))

      3.005     1.205     1.205
 assi 
   (( resid 127  and name  HA  ))
   (( resid 131  and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 44   and name  HB1 ))
   (( resid 67   and name  HA  ))

      3.620     1.820     1.820
 assi 
   (( resid 44   and name  HB2 ))
   (( resid 66   and name  HB2 ))

      2.750     0.950     0.950
 assi 
   (( resid 44   and name  HB2 ))
   (( resid 66   and name  HA  ))

      3.590     1.790     1.790
 assi 
   (( resid 72   and name  HB2 ))
   (( resid 73   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 72   and name  HB2 ))
   (( resid 72   and name  HD2 ))

      2.915     1.115     1.115
 assi 
   (( resid 72   and name  HB2 ))
   (( resid 72   and name  HD1 ))

      2.915     1.115     1.115
 assi 
   (( resid 44   and name  HB2 ))
   (( resid 67   and name  HA  ))

      3.480     1.680     1.680
 assi 
   (( resid 131  and name  HB1 ))
   (  resid 132  and name  HB# )

      3.245     1.445     1.445
 assi 
   (( resid 44   and name  HB1 ))
   (( resid 66   and name  HB2 ))

      2.735     0.935     0.935
 assi 
   (( resid 127  and name  HA  ))
   (( resid 131  and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 119  and name  HB1 ))
   (  resid 145  and name  HG2#)

      2.725     0.925     0.925
 assi 
   (( resid 118  and name  HN  ))
   (( resid 124  and name  HB1 ))

      3.400     1.600     1.600
 assi 
   (( resid 46   and name  HB1 ))
   (( resid 48   and name  HB1 ))

      3.300     1.500     1.500
 assi 
   (( resid 60   and name  HA  ))
   (( resid 65   and name  HB2 ))

      3.565     1.765     1.765
 assi 
   (( resid 78   and name  HB1 ))
   (  resid 79   and name  HB# )

      3.380     1.580     1.580
 assi 
   (( resid 57   and name  HG2 ))
   (( resid 58   and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 127  and name  HG2 ))
   (  resid 132  and name  HB# )

      3.250     1.450     1.450
 assi 
   (( resid 127  and name  HA  ))
   (( resid 127  and name  HG2 ))

      2.930     1.130     1.130
 assi 
   (( resid 127  and name  HN  ))
   (( resid 127  and name  HG2 ))

      3.145     1.345     1.345
 assi 
   (( resid 126  and name  HA  ))
   (( resid 127  and name  HG2 ))

      3.340     1.540     1.540
 assi 
   (( resid 126  and name  HB  ))
   (( resid 127  and name  HG2 ))

      3.650     1.850     1.850
 assi 
   (( resid 127  and name  HG2 ))
   (( resid 132  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 124  and name  HB2 ))
   (( resid 125  and name  HN  ))

      3.230     1.430     1.430
 assi 
   (( resid 56   and name  HA  ))
   (( resid 59   and name  HB  ))

      2.735     0.935     0.935
 assi 
   (( resid 51   and name  HB2 ))
   (( resid 52   and name  HA  ))

      3.115     1.315     1.315
 assi 
   (( resid 36   and name  HA  ))
   (( resid 54   and name  HB  ))

      3.650     1.850     1.850
 assi 
   (( resid 57   and name  HG2 ))
   (  resid 69   and name  HD1#)

      2.945     1.145     1.145
 assi 
   (( resid 57   and name  HG2 ))
   (  resid 69   and name  HD2#)

      2.945     1.145     1.145
 assi 
   (( resid 13   and name  HB1 ))
   (( resid 13   and name  HE2 ))

      3.650     1.850     1.850
 assi 
   (( resid 13   and name  HB1 ))
   (( resid 13   and name  HE1 ))

      3.650     1.850     1.850
 assi 
   (( resid 13   and name  HB2 ))
   (( resid 13   and name  HE2 ))

      3.650     1.850     1.850
 assi 
   (( resid 13   and name  HB2 ))
   (( resid 13   and name  HE1 ))

      3.650     1.850     1.850
 assi 
   (( resid 24   and name  HB2 ))
   (  resid 26   and name  HG1#)

      2.875     1.075     1.075
 assi 
   (( resid 42   and name  HB2 ))
   (  resid 49   and name  HD1#)

      3.080     1.280     1.280
 assi 
   (( resid 54   and name  HA  ))
   (( resid 57   and name  HG1 ))

      3.200     1.400     1.400
 assi 
   (( resid 57   and name  HG1 ))
   (( resid 58   and name  HB2 ))

      3.175     1.375     1.375
 assi 
   (( resid 125  and name  HA  ))
   (( resid 125  and name  HG1 ))

      2.990     1.190     1.190
 assi 
   (( resid 124  and name  HA  ))
   (( resid 125  and name  HB1 ))

      3.225     1.425     1.425
 assi 
   (( resid 113  and name  HA2 ))
   (( resid 129  and name  HB2 ))

      3.155     1.355     1.355
 assi 
   (( resid 128  and name  HA  ))
   (( resid 129  and name  HB2 ))

      3.215     1.415     1.415
 assi 
   (( resid 125  and name  HN  ))
   (( resid 125  and name  HG2 ))

      3.040     1.240     1.240
 assi 
   (( resid 120  and name  HB  ))
   (( resid 121  and name  HB2 ))

      3.450     1.650     1.650
 assi 
   (( resid 120  and name  HB  ))
   (( resid 142  and name  HA  ))

      3.050     1.250     1.250
 assi 
   (( resid 135  and name  HB1 ))
   (( resid 140  and name  HG2 ))

      2.915     1.115     1.115
 assi 
   (( resid 135  and name  HB1 ))
   (( resid 140  and name  HG1 ))

      3.205     1.405     1.405
 assi 
   (( resid 21   and name  HG2 ))
   (( resid 22   and name  HB1 ))

      3.270     1.470     1.470
 assi 
   (( resid 135  and name  HA  ))
   (( resid 140  and name  HG2 ))

      3.235     1.435     1.435
 assi 
   (( resid 140  and name  HA  ))
   (( resid 140  and name  HG1 ))

      2.485     0.685     0.685
 assi 
   (( resid 63   and name  HA  ))
   (( resid 63   and name  HG1 ))

      2.835     1.035     1.035
 assi 
   (  resid 59   and name  HG1#)
   (( resid 63   and name  HG2 ))

      3.020     1.220     1.220
 assi 
   (  resid 59   and name  HG1#)
   (( resid 63   and name  HG1 ))

      3.020     1.220     1.220
 assi 
   (  resid 37   and name  HD1#)
   (( resid 129  and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (  resid 37   and name  HD2#)
   (( resid 129  and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (  resid 52   and name  HD2#)
   (( resid 56   and name  HB2 ))

      3.380     1.580     1.580
 assi 
   (  resid 52   and name  HD2#)
   (( resid 56   and name  HB1 ))

      3.380     1.580     1.580
 assi 
   (( resid 54   and name  HA  ))
   (( resid 57   and name  HB2 ))

      3.585     1.785     1.785
 assi 
   (( resid 123  and name  HB1 ))
   (( resid 123  and name  HE2 ))

      3.490     1.690     1.690
 assi 
   (( resid 123  and name  HB1 ))
   (( resid 123  and name  HE1 ))

      3.490     1.690     1.690
 assi 
   (( resid 123  and name  HB2 ))
   (( resid 123  and name  HE2 ))

      3.490     1.690     1.690
 assi 
   (( resid 123  and name  HB2 ))
   (( resid 123  and name  HE1 ))

      3.490     1.690     1.690
 assi 
   (( resid 82   and name  HA  ))
   (( resid 83   and name  HB2 ))

      3.490     1.690     1.690
 assi 
   (( resid 21   and name  HG1 ))
   (  resid 26   and name  HG2#)

      2.895     1.095     1.095
 assi 
   (( resid 21   and name  HG1 ))
   (( resid 22   and name  HB2 ))

      3.030     1.230     1.230
 assi 
   (( resid 21   and name  HA  ))
   (( resid 21   and name  HG1 ))

      2.805     1.005     1.005
 assi 
   (( resid 119  and name  HG1 ))
   (( resid 124  and name  HA  ))

      2.890     1.090     1.090
 assi 
   (( resid 119  and name  HA  ))
   (( resid 119  and name  HG1 ))

      2.695     0.895     0.895
 assi 
   (( resid 51   and name  HD1 ))
   (( resid 75   and name  HB1 ))

      3.205     1.405     1.405
 assi 
   (( resid 22   and name  HB1 ))
   (  resid 26   and name  HG1#)

      3.295     1.495     1.495
 assi 
   (( resid 121  and name  HB2 ))
   (( resid 122  and name  HA1 ))

      3.650     1.850     1.850
 assi 
   (( resid 21   and name  HG1 ))
   (( resid 22   and name  HB1 ))

      3.055     1.255     1.255
 assi 
   (  resid 134  and name  HB# )
   (( resid 137  and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 127  and name  HB1 ))
   (  resid 132  and name  HB# )

      3.255     1.455     1.455
 assi 
   (( resid 124  and name  HA  ))
   (( resid 124  and name  HG1 ))

      2.925     1.125     1.125
 assi 
   (( resid 124  and name  HG1 ))
   (( resid 125  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 124  and name  HG2 ))
   (  resid 145  and name  HG2#)

      2.975     1.175     1.175
 assi 
   (( resid 124  and name  HA  ))
   (( resid 124  and name  HG2 ))

      2.925     1.125     1.125
 assi 
   (( resid 124  and name  HG2 ))
   (( resid 125  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 49   and name  HB  ))
   (  resid 49   and name  HD1#)

      2.610     0.810     0.810
 assi 
   (( resid 42   and name  HA  ))
   (( resid 49   and name  HB  ))

      3.530     1.730     1.730
 assi 
   (( resid 40   and name  HB1 ))
   (  resid 49   and name  HD1#)

      3.310     1.510     1.510
 assi 
   (( resid 40   and name  HB1 ))
   (  resid 49   and name  HG2#)

      3.145     1.345     1.345
 assi 
   (( resid 36   and name  HB2 ))
   (( resid 55   and name  HB1 ))

      3.245     1.445     1.445
 assi 
   (( resid 36   and name  HB2 ))
   (( resid 55   and name  HB2 ))

      3.245     1.445     1.445
 assi 
   (( resid 120  and name  HA  ))
   (( resid 142  and name  HB  ))

      3.335     1.535     1.535
 assi 
   (( resid 57   and name  HA  ))
   (( resid 67   and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 148  and name  HA  ))
   (( resid 148  and name  HD1 ))

      3.180     1.380     1.380
 assi 
   (( resid 50   and name  HB2 ))
   (  resid 50   and name  HD1#)

      2.960     1.160     1.160
 assi 
   (( resid 50   and name  HB2 ))
   (  resid 52   and name  HD2#)

      3.650     1.850     1.850
 assi 
   (( resid 50   and name  HB2 ))
   (( resid 51   and name  HG2 ))

      3.350     1.550     1.550
 assi 
   (( resid 50   and name  HB2 ))
   (( resid 51   and name  HG1 ))

      3.650     1.850     1.850
 assi 
   (( resid 50   and name  HB2 ))
   (( resid 51   and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 50   and name  HB2 ))
   (( resid 51   and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 50   and name  HB1 ))
   (  resid 50   and name  HD1#)

      2.905     1.105     1.105
 assi 
   (( resid 50   and name  HB1 ))
   (  resid 50   and name  HD2#)

      2.905     1.105     1.105
 assi 
   (( resid 37   and name  HB1 ))
   (  resid 39   and name  HG1#)

      2.930     1.130     1.130
 assi 
   (( resid 37   and name  HB1 ))
   (( resid 54   and name  HB  ))

      3.600     1.800     1.800
 assi 
   (( resid 37   and name  HB2 ))
   (  resid 37   and name  HD1#)

      2.755     0.955     0.955
 assi 
   (( resid 148  and name  HA  ))
   (( resid 148  and name  HD2 ))

      3.180     1.380     1.380
 assi 
   (( resid 113  and name  HA1 ))
   (( resid 129  and name  HB2 ))

      3.155     1.355     1.355
 assi 
   (( resid 119  and name  HG1 ))
   (( resid 122  and name  HA1 ))

      3.640     1.840     1.840
 assi 
   (( resid 119  and name  HG1 ))
   (( resid 122  and name  HA2 ))

      3.380     1.580     1.580
 assi 
   (( resid 11   and name  HA  ))
   (( resid 12   and name  HD1 ))

      2.505     0.705     0.705
 assi 
   (( resid 11   and name  HA  ))
   (( resid 12   and name  HD2 ))

      2.505     0.705     0.705
 assi 
   (( resid 84   and name  HA  ))
   (( resid 85   and name  HA  ))

      3.400     1.600     1.600
 assi 
   (( resid 41   and name  HA  ))
   (( resid 69   and name  HA  ))

      2.725     0.925     0.925
 assi 
   (( resid 40   and name  HB1 ))
   (( resid 41   and name  HA  ))

      3.555     1.755     1.755
 assi 
   (( resid 41   and name  HA  ))
   (( resid 67   and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 41   and name  HA  ))
   (  resid 57   and name  HE# )

      2.980     1.180     1.180
 assi 
   (( resid 41   and name  HA  ))
   (  resid 70   and name  HG2#)

      3.000     1.200     1.200
 assi 
   (( resid 41   and name  HA  ))
   (  resid 49   and name  HG2#)

      3.110     1.310     1.310
 assi 
   (  resid 39   and name  HG2#)
   (( resid 41   and name  HA  ))

      3.600     1.800     1.800
 assi 
   (( resid 10   and name  HA  ))
   (( resid 11   and name  HB  ))

      3.565     1.765     1.765
 assi 
   (( resid 79   and name  HA  ))
   (( resid 80   and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 79   and name  HA  ))
   (( resid 80   and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 14   and name  HA  ))
   (( resid 25   and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 14   and name  HA  ))
   (( resid 25   and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 14   and name  HA  ))
   (( resid 18   and name  HB1 ))

      3.210     1.410     1.410
 assi 
   (( resid 125  and name  HA  ))
   (( resid 152  and name  HA  ))

      3.295     1.495     1.495
 assi 
   (( resid 77   and name  HA  ))
   (( resid 78   and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 51   and name  HB1 ))
   (( resid 77   and name  HA  ))

      2.870     1.070     1.070
 assi 
   (( resid 51   and name  HA  ))
   (( resid 77   and name  HA  ))

      3.300     1.500     1.500
 assi 
   (( resid 39   and name  HA  ))
   (( resid 40   and name  HA  ))

      3.270     1.470     1.470
 assi 
   (( resid 39   and name  HB  ))
   (( resid 40   and name  HA  ))

      3.375     1.575     1.575
 assi 
   (( resid 40   and name  HA  ))
   (( resid 51   and name  HB1 ))

      3.595     1.795     1.795
 assi 
   (( resid 50   and name  HA  ))
   (  resid 50   and name  HD1#)

      2.970     1.170     1.170
 assi 
   (( resid 50   and name  HA  ))
   (( resid 75   and name  HB1 ))

      3.240     1.440     1.440
 assi 
   (  resid 49   and name  HG2#)
   (( resid 50   and name  HA  ))

      3.035     1.235     1.235
 assi 
   (  resid 41   and name  HB# )
   (( resid 43   and name  HA  ))

      3.410     1.610     1.610
 assi 
   (( resid 42   and name  HG2 ))
   (( resid 43   and name  HA  ))

      3.510     1.710     1.710
 assi 
   (( resid 43   and name  HA  ))
   (  resid 67   and name  HD# )

      3.030     1.230     1.230
 assi 
   (( resid 93   and name  HA  ))
   (( resid 93   and name  HG2 ))

      2.890     1.090     1.090
 assi 
   (( resid 61   and name  HD2 ))
   (( resid 66   and name  HA  ))

      3.330     1.530     1.530
 assi 
   (( resid 66   and name  HA  ))
   (  resid 67   and name  HD# )

      3.325     1.525     1.525
 assi 
   (( resid 42   and name  HA  ))
   (( resid 49   and name  HA  ))

      2.720     0.920     0.920
 assi 
   (( resid 42   and name  HA  ))
   (  resid 49   and name  HG2#)

      2.800     1.000     1.000
 assi 
   (( resid 65   and name  HA  ))
   (( resid 66   and name  HB2 ))

      3.395     1.595     1.595
 assi 
   (( resid 148  and name  HA  ))
   (( resid 149  and name  HA  ))

      3.210     1.410     1.410
 assi 
   (( resid 149  and name  HA  ))
   (( resid 150  and name  HA  ))

      3.120     1.320     1.320
 assi 
   (( resid 117  and name  HB2 ))
   (( resid 150  and name  HA  ))

      2.760     0.960     0.960
 assi 
   (( resid 150  and name  HA  ))
   (  resid 151  and name  HB# )

      3.025     1.225     1.225
 assi 
   (  resid 126  and name  HG2#)
   (( resid 150  and name  HA  ))

      3.420     1.620     1.620
 assi 
   (( resid 117  and name  HA  ))
   (( resid 150  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 121  and name  HA  ))
   (( resid 122  and name  HA2 ))

      3.470     1.670     1.670
 assi 
   (( resid 121  and name  HA  ))
   (( resid 121  and name  HB1 ))

      2.395     0.595     0.595
 assi 
   (( resid 25   and name  HA  ))
   (  resid 26   and name  HG1#)

      2.880     1.080     1.080
 assi 
   (  resid 126  and name  HG2#)
   (( resid 127  and name  HA  ))

      2.780     0.980     0.980
 assi 
   (( resid 127  and name  HA  ))
   (( resid 127  and name  HG1 ))

      2.805     1.005     1.005
 assi 
   (( resid 126  and name  HB  ))
   (( resid 127  and name  HA  ))

      3.460     1.660     1.660
 assi 
   (( resid 125  and name  HA  ))
   (( resid 125  and name  HG2 ))

      2.775     0.975     0.975
 assi 
   (( resid 125  and name  HA  ))
   (( resid 125  and name  HB2 ))

      2.380     0.580     0.580
 assi 
   (( resid 72   and name  HA  ))
   (( resid 73   and name  HA  ))

      3.475     1.675     1.675
 assi 
   (( resid 73   and name  HA  ))
   (( resid 74   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 18   and name  HA  ))
   (( resid 27   and name  HA  ))

      2.780     0.980     0.980
 assi 
   (( resid 17   and name  HB2 ))
   (( resid 18   and name  HA  ))

      3.425     1.625     1.625
 assi 
   (( resid 14   and name  HB1 ))
   (( resid 18   and name  HA  ))

      3.570     1.770     1.770
 assi 
   (( resid 14   and name  HB2 ))
   (( resid 18   and name  HA  ))

      3.570     1.770     1.770
 assi 
   (( resid 18   and name  HA  ))
   (( resid 18   and name  HG1 ))

      2.865     1.065     1.065
 assi 
   (( resid 18   and name  HA  ))
   (( resid 18   and name  HG2 ))

      2.865     1.065     1.065
 assi 
   (( resid 125  and name  HA  ))
   (  resid 126  and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 125  and name  HA  ))
   (  resid 152  and name  HB# )

      2.580     0.780     0.780
 assi 
   (( resid 20   and name  HA  ))
   (( resid 25   and name  HA  ))

      2.610     0.810     0.810
 assi 
   (( resid 21   and name  HA  ))
   (( resid 22   and name  HB2 ))

      3.205     1.405     1.405
 assi 
   (  resid 39   and name  HG2#)
   (( resid 69   and name  HA  ))

      3.600     1.800     1.800
 assi 
   (( resid 36   and name  HA  ))
   (( resid 37   and name  HB2 ))

      3.135     1.335     1.335
 assi 
   (( resid 36   and name  HA  ))
   (  resid 90   and name  HD1#)

      3.180     1.380     1.380
 assi 
   (( resid 36   and name  HA  ))
   (( resid 91   and name  HH2 ))

      3.650     1.850     1.850
 assi 
   (( resid 36   and name  HA  ))
   (  resid 114  and name  HD# )

      3.650     1.850     1.850
 assi 
   (( resid 36   and name  HA  ))
   (( resid 91   and name  HZ3 ))

      3.590     1.790     1.790
 assi 
   (( resid 132  and name  HA  ))
   (( resid 135  and name  HB2 ))

      2.900     1.100     1.100
 assi 
   (( resid 132  and name  HA  ))
   (( resid 135  and name  HN  ))

      3.310     1.510     1.510
 assi 
   (( resid 127  and name  HB1 ))
   (( resid 132  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 131  and name  HB2 ))
   (( resid 132  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 17   and name  HD1 ))
   (( resid 27   and name  HA  ))

      3.475     1.675     1.675
 assi 
   (  resid 8    and name  HG2#)
   (( resid 9    and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 135  and name  HB1 ))
   (( resid 140  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 117  and name  HA  ))
   (  resid 126  and name  HG2#)

      3.145     1.345     1.345
 assi 
   (( resid 117  and name  HA  ))
   (( resid 118  and name  HB  ))

      3.310     1.510     1.510
 assi 
   (( resid 116  and name  HB  ))
   (( resid 117  and name  HA  ))

      3.480     1.680     1.680
 assi 
   (( resid 116  and name  HA  ))
   (( resid 117  and name  HA  ))

      3.250     1.450     1.450
 assi 
   (( resid 117  and name  HA  ))
   (( resid 126  and name  HB  ))

      3.510     1.710     1.710
 assi 
   (( resid 117  and name  HA  ))
   (( resid 127  and name  HN  ))

      3.090     1.290     1.290
 assi 
   (( resid 103  and name  HA  ))
   (( resid 137  and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 119  and name  HA  ))
   (( resid 143  and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 119  and name  HA  ))
   (( resid 124  and name  HA  ))

      2.590     0.790     0.790
 assi 
   (( resid 118  and name  HN  ))
   (( resid 124  and name  HA  ))

      3.290     1.490     1.490
 assi 
   (( resid 106  and name  HA  ))
   (( resid 131  and name  HB2 ))

      3.200     1.400     1.400
 assi 
   (( resid 105  and name  HA  ))
   (( resid 106  and name  HA  ))

      3.130     1.330     1.330
 assi 
   (( resid 106  and name  HA  ))
   (( resid 134  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (  resid 81   and name  HB# )
   (( resid 82   and name  HA  ))

      3.245     1.445     1.445
 assi 
   (( resid 142  and name  HB  ))
   (( resid 143  and name  HA  ))

      3.315     1.515     1.515
 assi 
   (( resid 142  and name  HG11))
   (( resid 143  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 143  and name  HA  ))
   (  resid 145  and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 17   and name  HA  ))
   (( resid 17   and name  HE3 ))

      3.250     1.450     1.450
 assi 
   (( resid 138  and name  HA  ))
   (( resid 138  and name  HD2 ))

      3.650     1.850     1.850
 assi 
   (( resid 138  and name  HA  ))
   (( resid 138  and name  HD1 ))

      3.650     1.850     1.850
 assi 
   (  resid 59   and name  HG1#)
   (( resid 63   and name  HA  ))

      3.505     1.705     1.705
 assi 
   (( resid 37   and name  HA  ))
   (( resid 37   and name  HG  ))

      2.535     0.735     0.735
 assi 
   (( resid 48   and name  HA  ))
   (( resid 48   and name  HD2 ))

      3.555     1.755     1.755
 assi 
   (( resid 142  and name  HG12))
   (( resid 143  and name  HA  ))

      2.840     1.040     1.040
 assi 
   (( resid 17   and name  HA  ))
   (  resid 59   and name  HG2#)

      2.740     0.940     0.940
 assi 
   (( resid 17   and name  HA  ))
   (( resid 59   and name  HB  ))

      3.575     1.775     1.775
 assi 
   (( resid 17   and name  HA  ))
   (  resid 114  and name  HD# )

      3.650     1.850     1.850
 assi 
   (  resid 49   and name  HG2#)
   (( resid 75   and name  HA  ))

      2.805     1.005     1.005
 assi 
   (( resid 75   and name  HA  ))
   (( resid 76   and name  HB  ))

      3.440     1.640     1.640
 assi 
   (( resid 51   and name  HD1 ))
   (( resid 75   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 48   and name  HA  ))
   (  resid 49   and name  HD1#)

      3.005     1.205     1.205
 assi 
   (( resid 67   and name  HA  ))
   (  resid 67   and name  HD# )

      2.950     1.150     1.150
 assi 
   (( resid 43   and name  HA  ))
   (( resid 67   and name  HA  ))

      2.860     1.060     1.060
 assi 
   (( resid 44   and name  HG2 ))
   (( resid 67   and name  HA  ))

      3.420     1.620     1.620
 assi 
   (( resid 44   and name  HG1 ))
   (( resid 67   and name  HA  ))

      3.420     1.620     1.620
 assi 
   (  resid 41   and name  HB# )
   (( resid 67   and name  HA  ))

      3.305     1.505     1.505
 assi 
   (  resid 57   and name  HE# )
   (( resid 67   and name  HA  ))

      3.375     1.575     1.575
 assi 
   (  resid 152  and name  HB# )
   (( resid 153  and name  HA  ))

      3.005     1.205     1.205
 assi 
   (( resid 31   and name  HB2 ))
   (( resid 32   and name  HA  ))

      3.430     1.630     1.630
 assi 
   (( resid 37   and name  HA  ))
   (( resid 91   and name  HZ3 ))

      3.110     1.310     1.310
 assi 
   (  resid 126  and name  HG2#)
   (( resid 128  and name  HA  ))

      3.475     1.675     1.675
 assi 
   (( resid 115  and name  HA  ))
   (( resid 128  and name  HA  ))

      2.680     0.880     0.880
 assi 
   (( resid 140  and name  HG1 ))
   (( resid 141  and name  HA  ))

      3.080     1.280     1.280
 assi 
   (( resid 47   and name  HA  ))
   (( resid 47   and name  HD2 ))

      2.860     1.060     1.060
 assi 
   (( resid 47   and name  HA  ))
   (  resid 47   and name  HG# )

      2.900     1.100     1.100
 assi 
   (  resid 79   and name  HB# )
   (( resid 80   and name  HA  ))

      2.985     1.185     1.185
 assi 
   (( resid 90   and name  HA  ))
   (  resid 90   and name  HD2#)

      3.080     1.280     1.280
 assi 
   (( resid 115  and name  HA  ))
   (  resid 126  and name  HG2#)

      2.910     1.110     1.110
 assi 
   (( resid 115  and name  HA  ))
   (  resid 116  and name  HG2#)

      2.925     1.125     1.125
 assi 
   (( resid 115  and name  HA  ))
   (( resid 129  and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 115  and name  HA  ))
   (( resid 149  and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 115  and name  HA  ))
   (( resid 129  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 72   and name  HA  ))
   (  resid 77   and name  HD2#)

      3.260     1.460     1.460
 assi 
   (( resid 18   and name  HB1 ))
   (( resid 26   and name  HA  ))

      3.205     1.405     1.405
 assi 
   (( resid 26   and name  HA  ))
   (  resid 26   and name  HG2#)

      2.630     0.830     0.830
 assi 
   (( resid 135  and name  HA  ))
   (( resid 138  and name  HD1 ))

      3.425     1.625     1.625
 assi 
   (( resid 135  and name  HA  ))
   (  resid 135  and name  HD2#)

      2.845     1.045     1.045
 assi 
   (( resid 119  and name  HB1 ))
   (( resid 142  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 142  and name  HA  ))
   (( resid 142  and name  HG12))

      3.020     1.220     1.220
 assi 
   (( resid 142  and name  HA  ))
   (  resid 142  and name  HG2#)

      2.460     0.660     0.660
 assi 
   (  resid 49   and name  HG2#)
   (( resid 74   and name  HA  ))

      2.960     1.160     1.160
 assi 
   (( resid 49   and name  HB  ))
   (( resid 74   and name  HA  ))

      3.590     1.790     1.790
 assi 
   (( resid 16   and name  HA  ))
   (( resid 16   and name  HG1 ))

      2.735     0.935     0.935
 assi 
   (( resid 116  and name  HA  ))
   (  resid 116  and name  HG2#)

      2.620     0.820     0.820
 assi 
   (( resid 68   and name  HA  ))
   (( resid 69   and name  HB2 ))

      3.440     1.640     1.640
 assi 
   (( resid 69   and name  HB1 ))
   (( resid 70   and name  HA  ))

      3.460     1.660     1.660
 assi 
   (( resid 23   and name  HA  ))
   (( resid 24   and name  HA  ))

      3.150     1.350     1.350
 assi 
   (  resid 57   and name  HE# )
   (( resid 68   and name  HA  ))

      2.980     1.180     1.180
 assi 
   (( resid 67   and name  HB1 ))
   (( resid 68   and name  HA  ))

      3.330     1.530     1.530
 assi 
   (( resid 129  and name  HA  ))
   (  resid 132  and name  HB# )

      2.855     1.055     1.055
 assi 
   (  resid 116  and name  HG2#)
   (( resid 129  and name  HA  ))

      2.880     1.080     1.080
 assi 
   (  resid 116  and name  HD1#)
   (( resid 129  and name  HA  ))

      2.730     0.930     0.930
 assi 
   (( resid 129  and name  HA  ))
   (( resid 129  and name  HG2 ))

      2.950     1.150     1.150
 assi 
   (( resid 129  and name  HA  ))
   (( resid 129  and name  HG1 ))

      2.950     1.150     1.150
 assi 
   (( resid 129  and name  HA  ))
   (( resid 132  and name  HN  ))

      3.380     1.580     1.580
 assi 
   (( resid 114  and name  HA  ))
   (  resid 114  and name  HD# )

      3.115     1.315     1.315
 assi 
   (( resid 91   and name  HD1 ))
   (( resid 137  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 58   and name  HA  ))
   (  resid 147  and name  HD1#)

      3.400     1.600     1.600
 assi 
   (( resid 58   and name  HA  ))
   (( resid 61   and name  HB1 ))

      2.895     1.095     1.095
 assi 
   (( resid 58   and name  HA  ))
   (( resid 61   and name  HB2 ))

      2.895     1.095     1.095
 assi 
   (( resid 120  and name  HA  ))
   (( resid 142  and name  HA  ))

      2.805     1.005     1.005
 assi 
   (( resid 120  and name  HA  ))
   (( resid 122  and name  HA2 ))

      3.650     1.850     1.850
 assi 
   (( resid 119  and name  HG2 ))
   (( resid 120  and name  HA  ))

      2.880     1.080     1.080
 assi 
   (( resid 120  and name  HA  ))
   (  resid 120  and name  HG1#)

      2.615     0.815     0.815
 assi 
   (( resid 120  and name  HA  ))
   (  resid 120  and name  HG2#)

      2.615     0.815     0.815
 assi 
   (( resid 33   and name  HB1 ))
   (( resid 56   and name  HA  ))

      3.365     1.565     1.565
 assi 
   (( resid 33   and name  HB2 ))
   (( resid 56   and name  HA  ))

      3.365     1.565     1.565
 assi 
   (( resid 130  and name  HA  ))
   (( resid 134  and name  HN  ))

      3.635     1.835     1.835
 assi 
   (( resid 55   and name  HA  ))
   (( resid 58   and name  HB1 ))

      3.235     1.435     1.435
 assi 
   (( resid 55   and name  HA  ))
   (( resid 58   and name  HB2 ))

      3.115     1.315     1.315
 assi 
   (( resid 55   and name  HA  ))
   (( resid 58   and name  HD2 ))

      3.180     1.380     1.380
 assi 
   (( resid 118  and name  HB  ))
   (( resid 126  and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 126  and name  HA  ))
   (( resid 149  and name  HA  ))

      3.270     1.470     1.470
 assi 
   (( resid 115  and name  HB1 ))
   (( resid 116  and name  HN  ))

      3.245     1.445     1.445
 assi 
   (( resid 116  and name  HN  ))
   (( resid 149  and name  HA  ))

      3.575     1.775     1.775
 assi 
   (( resid 77   and name  HB1 ))
   (( resid 78   and name  HA  ))

      3.540     1.740     1.740
 assi 
   (( resid 78   and name  HA  ))
   (  resid 79   and name  HB# )

      3.650     1.850     1.850
 assi 
   (  resid 116  and name  HG2#)
   (( resid 147  and name  HA  ))

      2.630     0.830     0.830
 assi 
   (( resid 147  and name  HA  ))
   (  resid 147  and name  HG2#)

      2.720     0.920     0.920
 assi 
   (  resid 54   and name  HG2#)
   (( resid 147  and name  HA  ))

      3.045     1.245     1.245
 assi 
   (( resid 117  and name  HB2 ))
   (( resid 149  and name  HA  ))

      2.825     1.025     1.025
 assi 
   (( resid 115  and name  HB2 ))
   (  resid 116  and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 115  and name  HB2 ))
   (( resid 128  and name  HA  ))

      3.490     1.690     1.690
 assi 
   (( resid 115  and name  HB1 ))
   (( resid 128  and name  HA  ))

      3.490     1.690     1.690
 assi 
   (( resid 118  and name  HB  ))
   (( resid 144  and name  HA  ))

      3.095     1.295     1.295
 assi 
   (( resid 36   and name  HB1 ))
   (( resid 55   and name  HB2 ))

      3.245     1.445     1.445
 assi 
   (( resid 118  and name  HA  ))
   (( resid 144  and name  HA  ))

      2.695     0.895     0.895
 assi 
   (( resid 119  and name  HB1 ))
   (( resid 143  and name  HB2 ))

      2.695     0.895     0.895
 assi 
   (( resid 119  and name  HB2 ))
   (( resid 143  and name  HB2 ))

      3.330     1.530     1.530
 assi 
   (( resid 143  and name  HB2 ))
   (  resid 145  and name  HG2#)

      3.355     1.555     1.555
 assi 
   (( resid 120  and name  HA  ))
   (( resid 143  and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 46   and name  HB2 ))
   (( resid 48   and name  HD2 ))

      3.595     1.795     1.795
 assi 
   (( resid 46   and name  HB2 ))
   (( resid 48   and name  HD1 ))

      3.595     1.795     1.795
 assi 
   (( resid 119  and name  HB1 ))
   (( resid 143  and name  HB1 ))

      2.675     0.875     0.875
 assi 
   (( resid 46   and name  HB2 ))
   (( resid 48   and name  HB1 ))

      3.300     1.500     1.500
 assi 
   (( resid 119  and name  HB2 ))
   (( resid 143  and name  HB1 ))

      3.405     1.605     1.605
 assi 
   (( resid 143  and name  HB1 ))
   (  resid 145  and name  HG2#)

      2.805     1.005     1.005
 assi 
   (( resid 142  and name  HA  ))
   (( resid 143  and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 46   and name  HB1 ))
   (( resid 48   and name  HD2 ))

      3.595     1.795     1.795
 assi 
   (( resid 30   and name  HA  ))
   (  resid 59   and name  HG2#)

      2.970     1.170     1.170
 assi 
   (( resid 54   and name  HA  ))
   (( resid 57   and name  HB1 ))

      3.230     1.430     1.430
 assi 
   (( resid 54   and name  HA  ))
   (( resid 147  and name  HB  ))

      3.370     1.570     1.570
 assi 
   (( resid 54   and name  HA  ))
   (( resid 57   and name  HG2 ))

      3.070     1.270     1.270
 assi 
   (( resid 54   and name  HA  ))
   (  resid 54   and name  HG1#)

      2.695     0.895     0.895
 assi 
   (( resid 17   and name  HB1 ))
   (( resid 59   and name  HA  ))

      3.305     1.505     1.505
 assi 
   (( resid 58   and name  HB1 ))
   (( resid 59   and name  HA  ))

      3.520     1.720     1.720
 assi 
   (( resid 126  and name  HB  ))
   (( resid 149  and name  HB2 ))

      3.625     1.825     1.825
 assi 
   (( resid 125  and name  HG2 ))
   (( resid 126  and name  HB  ))

      3.650     1.850     1.850
 assi 
   (( resid 126  and name  HB  ))
   (( resid 149  and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 125  and name  HA  ))
   (( resid 126  and name  HB  ))

      3.325     1.525     1.525
 assi 
   (( resid 126  and name  HB  ))
   (( resid 127  and name  HN  ))

      3.160     1.360     1.360
 assi 
   (( resid 70   and name  HB  ))
   (( resid 74   and name  HB1 ))

      3.190     1.390     1.390
 assi 
   (( resid 70   and name  HB  ))
   (( resid 74   and name  HB2 ))

      3.190     1.390     1.390
 assi 
   (( resid 41   and name  HA  ))
   (( resid 70   and name  HB  ))

      3.650     1.850     1.850
 assi 
   (( resid 51   and name  HB1 ))
   (( resid 76   and name  HB  ))

      3.605     1.805     1.805
 assi 
   (( resid 42   and name  HB1 ))
   (( resid 68   and name  HB  ))

      2.935     1.135     1.135
 assi 
   (( resid 42   and name  HA  ))
   (( resid 68   and name  HB  ))

      3.650     1.850     1.850
 assi 
   (( resid 16   and name  HA  ))
   (( resid 16   and name  HG2 ))

      2.735     0.935     0.935
 assi 
   (( resid 38   and name  HB1 ))
   (( resid 39   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 67   and name  HB2 ))
   (( resid 68   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 38   and name  HB2 ))
   (( resid 39   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 46   and name  HA  ))
   (  resid 47   and name  HG# )

      3.165     1.365     1.365
 assi 
   (( resid 38   and name  HA  ))
   (( resid 53   and name  HB  ))

      3.305     1.505     1.505
 assi 
   (( resid 38   and name  HA  ))
   (( resid 53   and name  HA  ))

      2.895     1.095     1.095
 assi 
   (( resid 52   and name  HB1 ))
   (  resid 52   and name  HD2#)

      2.915     1.115     1.115
 assi 
   (( resid 52   and name  HB1 ))
   (  resid 52   and name  HD1#)

      2.810     1.010     1.010
 assi 
   (( resid 52   and name  HA  ))
   (( resid 52   and name  HG  ))

      2.920     1.120     1.120
 assi 
   (  resid 41   and name  HB# )
   (  resid 52   and name  HD1#)

      2.400     0.600     0.600
 assi 
   (( resid 52   and name  HB2 ))
   (  resid 52   and name  HD1#)

      2.620     0.820     0.820
 assi 
   (  resid 52   and name  HD1#)
   (( resid 67   and name  HB2 ))

      3.030     1.230     1.230
 assi 
   (  resid 52   and name  HD1#)
   (( resid 57   and name  HB2 ))

      2.870     1.070     1.070
 assi 
   (  resid 52   and name  HD1#)
   (( resid 57   and name  HB1 ))

      2.740     0.940     0.940
 assi 
   (  resid 52   and name  HD1#)
   (( resid 57   and name  HA  ))

      2.935     1.135     1.135
 assi 
   (( resid 41   and name  HA  ))
   (  resid 52   and name  HD1#)

      3.285     1.485     1.485
 assi 
   (( resid 40   and name  HA  ))
   (  resid 52   and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 51   and name  HA  ))
   (  resid 52   and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 52   and name  HA  ))
   (  resid 52   and name  HD1#)

      2.820     1.020     1.020
 assi 
   (  resid 52   and name  HD1#)
   (( resid 57   and name  HN  ))

      3.270     1.470     1.470
 assi 
   (  resid 52   and name  HD2#)
   (( resid 57   and name  HB2 ))

      3.500     1.700     1.700
 assi 
   (( resid 52   and name  HA  ))
   (  resid 52   and name  HD2#)

      2.60     0.800     0.800
 assi 
   (( resid 40   and name  HB2 ))
   (( resid 51   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 50   and name  HB2 ))
   (( resid 51   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 51   and name  HA  ))
   (( resid 77   and name  HG  ))

      3.650     1.850     1.850
 assi 
   (( resid 50   and name  HB2 ))
   (( resid 51   and name  HD2 ))

      2.750     0.950     0.950
 assi 
   (( resid 50   and name  HB1 ))
   (( resid 51   and name  HD2 ))

      2.815     1.015     1.015
 assi 
   (( resid 51   and name  HG2 ))
   (  resid 77   and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 51   and name  HG1 ))
   (  resid 77   and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 49   and name  HB  ))
   (( resid 75   and name  HB2 ))

      3.515     1.715     1.715
 assi 
   (( resid 51   and name  HD1 ))
   (( resid 75   and name  HB2 ))

      3.180     1.380     1.380
 assi 
   (( resid 102  and name  HA  ))
   (  resid 102  and name  HG2#)

      2.895     1.095     1.095
 assi 
   (( resid 102  and name  HA  ))
   (  resid 102  and name  HG1#)

      2.895     1.095     1.095
 assi 
   (( resid 101  and name  HA  ))
   (  resid 102  and name  HG2#)

      3.650     1.850     1.850
 assi 
   (( resid 94   and name  HA  ))
   (( resid 101  and name  HA  ))

      3.200     1.400     1.400
 assi 
   (( resid 119  and name  HG2 ))
   (  resid 145  and name  HG2#)

      3.220     1.420     1.420
 assi 
   (( resid 119  and name  HG2 ))
   (( resid 143  and name  HB1 ))

      3.585     1.785     1.785
 assi 
   (( resid 93   and name  HB2 ))
   (( resid 93   and name  HE2 ))

      3.650     1.850     1.850
 assi 
   (( resid 93   and name  HB2 ))
   (( resid 93   and name  HE1 ))

      3.650     1.850     1.850
 assi 
   (( resid 119  and name  HA  ))
   (( resid 119  and name  HG2 ))

      2.645     0.845     0.845
 assi 
   (( resid 136  and name  HA  ))
   (( resid 136  and name  HD2 ))

      3.620     1.820     1.820
 assi 
   (( resid 136  and name  HA  ))
   (( resid 136  and name  HD1 ))

      3.620     1.820     1.820
 assi 
   (  resid 11   and name  HG1#)
   (( resid 12   and name  HD1 ))

      3.325     1.525     1.525
 assi 
   (  resid 11   and name  HG1#)
   (( resid 12   and name  HD2 ))

      3.325     1.525     1.525
 assi 
   (( resid 29   and name  HA  ))
   (  resid 31   and name  HE# )

      3.300     1.500     1.500
 assi 
   (  resid 39   and name  HG1#)
   (  resid 147  and name  HD1#)

      3.530     1.730     1.730
 assi 
   (  resid 39   and name  HG1#)
   (( resid 54   and name  HA  ))

      3.375     1.575     1.575
 assi 
   (( resid 37   and name  HA  ))
   (  resid 39   and name  HG1#)

      3.375     1.575     1.575
 assi 
   (( resid 123  and name  HA  ))
   (( resid 123  and name  HG2 ))

      2.870     1.070     1.070
 assi 
   (  resid 49   and name  HG2#)
   (( resid 75   and name  HB1 ))

      2.495     0.695     0.695
 assi 
   (  resid 49   and name  HG2#)
   (( resid 75   and name  HB2 ))

      2.645     0.845     0.845
 assi 
   (  resid 49   and name  HG2#)
   (  resid 49   and name  HD1#)

      2.215     0.415     0.415
 assi 
   (  resid 49   and name  HD1#)
   (( resid 75   and name  HB1 ))

      3.900     2.100     2.100
 assi 
   (  resid 49   and name  HD1#)
   (( resid 70   and name  HB  ))

      2.695     0.895     0.895
 assi 
   (  resid 49   and name  HD1#)
   (( resid 74   and name  HB2 ))

      2.805     1.005     1.005
 assi 
   (( resid 42   and name  HA  ))
   (  resid 49   and name  HD1#)

      2.815     1.015     1.015
 assi 
   (( resid 49   and name  HA  ))
   (  resid 49   and name  HD1#)

      2.720     0.920     0.920
 assi 
   (  resid 49   and name  HD1#)
   (( resid 70   and name  HA  ))

      3.320     1.520     1.520
 assi 
   (( resid 43   and name  HB2 ))
   (  resid 50   and name  HD1#)

      3.545     1.745     1.745
 assi 
   (( resid 43   and name  HB1 ))
   (  resid 50   and name  HD1#)

      3.545     1.745     1.745
 assi 
   (( resid 43   and name  HA  ))
   (  resid 50   and name  HD1#)

      3.400     1.600     1.600
 assi 
   (  resid 50   and name  HD1#)
   (  resid 67   and name  HD# )

      3.160     1.360     1.360
 assi 
   (  resid 50   and name  HD2#)
   (  resid 52   and name  HD1#)

      2.690     0.890     0.890
 assi 
   (( resid 50   and name  HB2 ))
   (  resid 50   and name  HD2#)

      2.960     1.160     1.160
 assi 
   (( resid 43   and name  HB1 ))
   (  resid 50   and name  HD2#)

      3.545     1.745     1.745
 assi 
   (( resid 43   and name  HB2 ))
   (  resid 50   and name  HD2#)

      3.545     1.745     1.745
 assi 
   (( resid 43   and name  HA  ))
   (  resid 50   and name  HD2#)

      3.400     1.600     1.600
 assi 
   (( resid 50   and name  HA  ))
   (  resid 50   and name  HD2#)

      2.970     1.170     1.170
 assi 
   (  resid 50   and name  HD2#)
   (  resid 67   and name  HE# )

      2.745     0.945     0.945
 assi 
   (( resid 50   and name  HA  ))
   (( resid 50   and name  HG  ))

      2.825     1.025     1.025
 assi 
   (( resid 52   and name  HA  ))
   (( resid 56   and name  HB2 ))

      3.455     1.655     1.655
 assi 
   (( resid 52   and name  HA  ))
   (( resid 56   and name  HB1 ))

      3.455     1.655     1.655
 assi 
   (  resid 39   and name  HG2#)
   (( resid 57   and name  HB1 ))

      3.160     1.360     1.360
 assi 
   (( resid 57   and name  HB1 ))
   (  resid 147  and name  HD1#)

      3.325     1.525     1.525
 assi 
   (( resid 58   and name  HB1 ))
   (  resid 59   and name  HG2#)

      2.975     1.175     1.175
 assi 
   (( resid 17   and name  HB1 ))
   (  resid 59   and name  HG2#)

      2.745     0.945     0.945
 assi 
   (( resid 17   and name  HB2 ))
   (  resid 59   and name  HG2#)

      2.530     0.730     0.730
 assi 
   (( resid 59   and name  HA  ))
   (  resid 59   and name  HG2#)

      2.720     0.920     0.920
 assi 
   (( resid 17   and name  HD1 ))
   (  resid 59   and name  HG2#)

      3.290     1.490     1.490
 assi 
   (  resid 59   and name  HG2#)
   (  resid 114  and name  HD# )

      3.650     1.850     1.850
 assi 
   (( resid 59   and name  HA  ))
   (  resid 59   and name  HG1#)

      2.490     0.690     0.690
 assi 
   (( resid 60   and name  HB2 ))
   (  resid 60   and name  HD1#)

      2.670     0.870     0.870
 assi 
   (( resid 57   and name  HA  ))
   (  resid 60   and name  HD1#)

      2.760     0.960     0.960
 assi 
   (  resid 60   and name  HD1#)
   (  resid 67   and name  HE# )

      2.865     1.065     1.065
 assi 
   (( resid 60   and name  HB1 ))
   (  resid 60   and name  HD2#)

      2.670     0.870     0.870
 assi 
   (( resid 57   and name  HB2 ))
   (  resid 60   and name  HD2#)

      3.275     1.475     1.475
 assi 
   (( resid 57   and name  HA  ))
   (  resid 60   and name  HD2#)

      2.760     0.960     0.960
 assi 
   (( resid 135  and name  HA  ))
   (  resid 135  and name  HD1#)

      2.845     1.045     1.045
 assi 
   (  resid 60   and name  HD2#)
   (  resid 67   and name  HE# )

      2.865     1.065     1.065
 assi 
   (( resid 44   and name  HB1 ))
   (( resid 66   and name  HB1 ))

      3.230     1.430     1.430
 assi 
   (( resid 44   and name  HB2 ))
   (( resid 66   and name  HB1 ))

      3.080     1.280     1.280
 assi 
   (( resid 44   and name  HA  ))
   (( resid 66   and name  HB2 ))

      3.650     1.850     1.850
 assi 
   (( resid 41   and name  HA  ))
   (  resid 69   and name  HD1#)

      3.495     1.695     1.695
 assi 
   (( resid 77   and name  HB1 ))
   (  resid 77   and name  HD2#)

      2.400     0.600     0.600
 assi 
   (  resid 39   and name  HG2#)
   (  resid 77   and name  HD2#)

      3.440     1.640     1.640
 assi 
   (( resid 38   and name  HA  ))
   (  resid 77   and name  HD2#)

      3.355     1.555     1.555
 assi 
   (( resid 39   and name  HA  ))
   (  resid 77   and name  HD2#)

      2.535     0.735     0.735
 assi 
   (  resid 77   and name  HD2#)
   (( resid 78   and name  HD2 ))

      2.950     1.150     1.150
 assi 
   (( resid 39   and name  HN  ))
   (  resid 77   and name  HD2#)

      3.650     1.850     1.850
 assi 
   (  resid 90   and name  HD2#)
   (( resid 91   and name  HZ2 ))

      3.650     1.850     1.850
 assi 
   (  resid 90   and name  HD2#)
   (( resid 91   and name  HH2 ))

      3.450     1.650     1.650
 assi 
   (( resid 77   and name  HB1 ))
   (  resid 77   and name  HD1#)

      2.565     0.765     0.765
 assi 
   (( resid 38   and name  HB1 ))
   (  resid 77   and name  HD1#)

      2.890     1.090     1.090
 assi 
   (  resid 77   and name  HD1#)
   (( resid 78   and name  HD2 ))

      2.735     0.935     0.935
 assi 
   (( resid 39   and name  HA  ))
   (  resid 39   and name  HG1#)

      2.645     0.845     0.845
 assi 
   (  resid 77   and name  HD2#)
   (  resid 78   and name  HG# )

      3.365     1.565     1.565
 assi 
   (( resid 83   and name  HA  ))
   (( resid 83   and name  HD1 ))

      2.830     1.030     1.030
 assi 
   (( resid 83   and name  HA  ))
   (( resid 83   and name  HD2 ))

      2.830     1.030     1.030
 assi 
   (( resid 106  and name  HA  ))
   (  resid 134  and name  HB# )

      2.780     0.980     0.980
 assi 
   (( resid 131  and name  HA  ))
   (  resid 134  and name  HB# )

      2.600     0.800     0.800
 assi 
   (  resid 134  and name  HB# )
   (( resid 137  and name  HB1 ))

      3.275     1.475     1.475
 assi 
   (( resid 133  and name  HA1 ))
   (  resid 134  and name  HB# )

      3.230     1.430     1.430
 assi 
   (( resid 103  and name  HA  ))
   (  resid 134  and name  HB# )

      3.340     1.540     1.540
 assi 
   (( resid 91   and name  HE3 ))
   (  resid 134  and name  HB# )

      3.550     1.750     1.750
 assi 
   (( resid 134  and name  HN  ))
   (  resid 134  and name  HB# )

      2.530     0.730     0.730
 assi 
   (( resid 134  and name  HA  ))
   (( resid 137  and name  HB2 ))

      2.885     1.085     1.085
 assi 
   (( resid 103  and name  HA  ))
   (( resid 134  and name  HA  ))

      3.560     1.760     1.760
 assi 
   (( resid 84   and name  HA  ))
   (( resid 100  and name  HA  ))

      2.900     1.100     1.100
 assi 
   (( resid 136  and name  HB2 ))
   (  resid 142  and name  HD1#)

      2.805     1.005     1.005
 assi 
   (( resid 114  and name  HB2 ))
   (  resid 116  and name  HD1#)

      3.650     1.850     1.850
 assi 
   (  resid 116  and name  HD1#)
   (( resid 129  and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 116  and name  HB  ))
   (  resid 116  and name  HD1#)

      2.755     0.955     0.955
 assi 
   (  resid 116  and name  HD1#)
   (( resid 118  and name  HB  ))

      3.405     1.605     1.605
 assi 
   (( resid 37   and name  HB2 ))
   (  resid 116  and name  HD1#)

      3.310     1.510     1.510
 assi 
   (  resid 116  and name  HG2#)
   (  resid 116  and name  HD1#)

      2.255     0.455     0.455
 assi 
   (  resid 116  and name  HD1#)
   (( resid 128  and name  HA  ))

      3.240     1.440     1.440
 assi 
   (( resid 115  and name  HA  ))
   (  resid 116  and name  HD1#)

      3.230     1.430     1.430
 assi 
   (( resid 116  and name  HA  ))
   (  resid 116  and name  HD1#)

      2.825     1.025     1.025
 assi 
   (  resid 116  and name  HD1#)
   (( resid 132  and name  HN  ))

      3.245     1.445     1.445
 assi 
   (( resid 116  and name  HN  ))
   (( resid 116  and name  HG11))

      3.400     1.600     1.600
 assi 
   (( resid 22   and name  HB2 ))
   (  resid 26   and name  HG1#)

      3.650     1.850     1.850
 assi 
   (( resid 118  and name  HA  ))
   (  resid 118  and name  HG2#)

      2.525     0.725     0.725
 assi 
   (  resid 120  and name  HG1#)
   (( resid 125  and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 118  and name  HA  ))
   (  resid 118  and name  HG1#)

      2.525     0.725     0.725
 assi 
   (( resid 119  and name  HN  ))
   (( resid 119  and name  HG2 ))

      3.170     1.370     1.370
 assi 
   (( resid 123  and name  HA  ))
   (( resid 123  and name  HG1 ))

      2.870     1.070     1.070
 assi 
   (  resid 126  and name  HG2#)
   (( resid 149  and name  HB1 ))

      2.635     0.835     0.835
 assi 
   (  resid 126  and name  HG2#)
   (( resid 149  and name  HB2 ))

      2.605     0.805     0.805
 assi 
   (  resid 126  and name  HG2#)
   (( resid 149  and name  HA  ))

      2.520     0.720     0.720
 assi 
   (( resid 126  and name  HA  ))
   (  resid 126  and name  HG2#)

      2.605     0.805     0.805
 assi 
   (( resid 127  and name  HB2 ))
   (  resid 132  and name  HB# )

      3.255     1.455     1.455
 assi 
   (( resid 37   and name  HG  ))
   (( resid 129  and name  HG1 ))

      3.310     1.510     1.510
 assi 
   (  resid 54   and name  HG2#)
   (( resid 114  and name  HB1 ))

      3.530     1.730     1.730
 assi 
   (( resid 37   and name  HG  ))
   (( resid 129  and name  HG2 ))

      3.310     1.510     1.510
 assi 
   (( resid 136  and name  HD2 ))
   (( resid 142  and name  HG12))

      3.650     1.850     1.850
 assi 
   (( resid 136  and name  HD1 ))
   (( resid 142  and name  HG12))

      3.650     1.850     1.850
 assi 
   (  resid 142  and name  HG2#)
   (( resid 142  and name  HG11))

      2.610     0.810     0.810
 assi 
   (( resid 135  and name  HB2 ))
   (( resid 142  and name  HG11))

      2.920     1.120     1.120
 assi 
   (( resid 136  and name  HD2 ))
   (( resid 142  and name  HG11))

      3.440     1.640     1.640
 assi 
   (( resid 136  and name  HD1 ))
   (( resid 142  and name  HG11))

      3.440     1.640     1.640
 assi 
   (( resid 54   and name  HB  ))
   (  resid 147  and name  HD1#)

      3.610     1.810     1.810
 assi 
   (( resid 147  and name  HB  ))
   (  resid 147  and name  HD1#)

      2.520     0.720     0.720
 assi 
   (( resid 57   and name  HG2 ))
   (  resid 147  and name  HD1#)

      2.535     0.735     0.735
 assi 
   (  resid 147  and name  HG2#)
   (  resid 147  and name  HD1#)

      2.455     0.655     0.655
 assi 
   (( resid 54   and name  HA  ))
   (  resid 147  and name  HD1#)

      3.130     1.330     1.330
 assi 
   (( resid 58   and name  HD2 ))
   (  resid 147  and name  HD1#)

      3.245     1.445     1.445
 assi 
   (  resid 90   and name  HD1#)
   (( resid 91   and name  HZ2 ))

      3.650     1.850     1.850
 assi 
   (( resid 24   and name  HD2 ))
   (  resid 26   and name  HG1#)

      3.095     1.295     1.295
 assi 
   (( resid 24   and name  HD1 ))
   (  resid 26   and name  HG1#)

      3.095     1.295     1.295
 assi 
   (( resid 29   and name  HB2 ))
   (  resid 29   and name  HE# )

      2.805     1.005     1.005
 assi 
   (  resid 29   and name  HE# )
   (  resid 59   and name  HG1#)

      3.390     1.590     1.590
 assi 
   (( resid 29   and name  HG1 ))
   (  resid 29   and name  HE# )

      2.670     0.870     0.870
 assi 
   (( resid 29   and name  HG2 ))
   (  resid 29   and name  HE# )

      2.670     0.870     0.870
 assi 
   (( resid 29   and name  HA  ))
   (  resid 29   and name  HE# )

      2.830     1.030     1.030
 assi 
   (  resid 37   and name  HD1#)
   (( resid 129  and name  HG2 ))

      3.910     2.110     2.110
 assi 
   (( resid 37   and name  HB1 ))
   (  resid 37   and name  HD1#)

      2.820     1.020     1.020
 assi 
   (  resid 37   and name  HD1#)
   (  resid 132  and name  HB# )

      2.975     1.175     1.175
 assi 
   (( resid 37   and name  HA  ))
   (  resid 37   and name  HD1#)

      2.975     1.175     1.175
 assi 
   (  resid 37   and name  HD1#)
   (( resid 129  and name  HA  ))

      3.295     1.495     1.495
 assi 
   (  resid 37   and name  HD1#)
   (( resid 129  and name  HG1 ))

      3.910     2.110     2.110
 assi 
   (  resid 37   and name  HD1#)
   (( resid 133  and name  HA2 ))

      3.410     1.610     1.610
 assi 
   (  resid 41   and name  HB# )
   (  resid 57   and name  HE# )

      2.445     0.645     0.645
 assi 
   (  resid 57   and name  HE# )
   (  resid 69   and name  HD1#)

      2.620     0.820     0.820
 assi 
   (  resid 57   and name  HE# )
   (  resid 69   and name  HD2#)

      2.620     0.820     0.820
 assi 
   (  resid 39   and name  HG2#)
   (  resid 57   and name  HE# )

      2.955     1.155     1.155
 assi 
   (  resid 52   and name  HD1#)
   (  resid 57   and name  HE# )

      3.020     1.220     1.220
 assi 
   (  resid 57   and name  HE# )
   (( resid 69   and name  HA  ))

      2.705     0.905     0.905
 assi 
   (( resid 57   and name  HA  ))
   (  resid 57   and name  HE# )

      2.840     1.040     1.040
 assi 
   (( resid 54   and name  HA  ))
   (  resid 57   and name  HE# )

      3.610     1.810     1.810
 assi 
   (  resid 57   and name  HE# )
   (( resid 67   and name  HB2 ))

      2.670     0.870     0.870
 assi 
   (  resid 57   and name  HE# )
   (( resid 67   and name  HB1 ))

      2.635     0.835     0.835
 assi 
   (( resid 57   and name  HB2 ))
   (  resid 57   and name  HE# )

      2.600     0.800     0.800
 assi 
   (( resid 57   and name  HN  ))
   (  resid 57   and name  HE# )

      3.650     1.850     1.850
 assi 
   (  resid 57   and name  HE# )
   (( resid 70   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (  resid 57   and name  HE# )
   (  resid 67   and name  HD# )

      3.000     1.200     1.200
 assi 
   (  resid 120  and name  HG1#)
   (  resid 127  and name  HE# )

      2.595     0.795     0.795
 assi 
   (( resid 117  and name  HA  ))
   (  resid 127  and name  HE# )

      3.650     1.850     1.850
 assi 
   (( resid 126  and name  HA  ))
   (  resid 127  and name  HE# )

      3.650     1.850     1.850
 assi 
   (( resid 125  and name  HA  ))
   (  resid 127  and name  HE# )

      3.500     1.700     1.700
 assi 
   (( resid 125  and name  HG2 ))
   (  resid 127  and name  HE# )

      2.510     0.710     0.710
 assi 
   (( resid 125  and name  HN  ))
   (  resid 127  and name  HE# )

      3.100     1.300     1.300
 assi 
   (( resid 57   and name  HG1 ))
   (  resid 147  and name  HD1#)

      3.160     1.360     1.360
 assi 
   (( resid 53   and name  HB  ))
   (( resid 54   and name  HN  ))

      3.190     1.390     1.390
 assi 
   (( resid 53   and name  HB  ))
   (( resid 57   and name  HN  ))

      3.500     1.700     1.700
 assi 
   (  resid 50   and name  HD1#)
   (  resid 52   and name  HD1#)

      2.690     0.890     0.890
 assi 
   (( resid 29   and name  HB1 ))
   (  resid 29   and name  HE# )

      2.805     1.005     1.005
 assi 
   (  resid 39   and name  HG2#)
   (  resid 53   and name  HG2#)

      3.035     1.235     1.235
 assi 
   (  resid 53   and name  HG2#)
   (( resid 54   and name  HA  ))

      3.475     1.675     1.675
 assi 
   (( resid 38   and name  HA  ))
   (  resid 53   and name  HG2#)

      2.600     0.800     0.800
 assi 
   (( resid 53   and name  HA  ))
   (  resid 53   and name  HG2#)

      2.620     0.820     0.820
 assi 
   (( resid 57   and name  HB2 ))
   (  resid 147  and name  HD1#)

      3.430     1.630     1.630
 assi 
   (  resid 41   and name  HB# )
   (( resid 57   and name  HB2 ))

      2.965     1.165     1.165
 assi 
   (( resid 52   and name  HB2 ))
   (( resid 57   and name  HB2 ))

      3.260     1.460     1.460
 assi 
   (( resid 40   and name  HB1 ))
   (( resid 75   and name  HB2 ))

      3.630     1.830     1.830
 assi 
   (( resid 40   and name  HB2 ))
   (( resid 75   and name  HB1 ))

      3.650     1.850     1.850
 assi 
   (( resid 103  and name  HB1 ))
   (( resid 137  and name  HB2 ))

      3.320     1.520     1.520
 assi 
   (( resid 13   and name  HA  ))
   (( resid 14   and name  HA  ))

      3.175     1.375     1.375
 assi 
   (( resid 14   and name  HA  ))
   (( resid 15   and name  HA  ))

      3.075     1.275     1.275
 assi 
   (( resid 58   and name  HA  ))
   (( resid 61   and name  HD2 ))

      3.565     1.765     1.765
 assi 
   (( resid 27   and name  HA  ))
   (( resid 28   and name  HA  ))

      3.380     1.580     1.580
 assi 
   (( resid 37   and name  HA  ))
   (( resid 91   and name  HH2 ))

      3.040     1.240     1.240
 assi 
   (( resid 61   and name  HA  ))
   (( resid 61   and name  HD2 ))

      3.170     1.370     1.370
 assi 
   (( resid 42   and name  HA  ))
   (( resid 47   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 47   and name  HA  ))
   (( resid 48   and name  HA  ))

      3.195     1.395     1.395
 assi 
   (( resid 39   and name  HB  ))
   (( resid 53   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 17   and name  HE3 ))
   (( resid 58   and name  HD2 ))

      3.650     1.850     1.850
 assi 
   (( resid 56   and name  HA  ))
   (( resid 59   and name  HN  ))

      3.480     1.680     1.680
 assi 
   (( resid 17   and name  HD1 ))
   (( resid 59   and name  HA  ))

      3.530     1.730     1.730
 assi 
   (( resid 17   and name  HA  ))
   (( resid 59   and name  HA  ))

      3.455     1.655     1.655
 assi 
   (( resid 66   and name  HA  ))
   (( resid 67   and name  HA  ))

      3.360     1.560     1.560
 assi 
   (( resid 44   and name  HA  ))
   (( resid 67   and name  HA  ))

      3.650     1.850     1.850
 assi 
   (( resid 67   and name  HA  ))
   (( resid 68   and name  HB  ))

      3.400     1.600     1.600
 assi 
   (( resid 77   and name  HA  ))
   (( resid 78   and name  HD1 ))

      2.775     0.975     0.975
 assi 
   (( resid 103  and name  HA  ))
   (( resid 104  and name  HA  ))

      3.140     1.340     1.340
 assi 
   (( resid 116  and name  HA  ))
   (( resid 148  and name  HA  ))

      2.910     1.110     1.110
 assi 
   (( resid 117  and name  HN  ))
   (( resid 147  and name  HA  ))

      3.470     1.670     1.670
 assi 
   (( resid 146  and name  HA  ))
   (  resid 147  and name  HD1#)

      3.650     1.850     1.850
 assi 
   (( resid 135  and name  HB1 ))
   (( resid 140  and name  HB2 ))

      3.005     1.205     1.205
 assi 
   (( resid 120  and name  HA  ))
   (  resid 127  and name  HE# )

      3.460     1.660     1.660
 assi 
   (  resid 142  and name  HD1#)
   (( resid 144  and name  HN  ))

      3.585     1.785     1.785
 assi 
   (( resid 15   and name  HA  ))
   (( resid 17   and name  HZ3 ))

      3.650     1.850     1.850
 assi 
   (( resid 41   and name  HA  ))
   (( resid 68   and name  HB  ))

      3.650     1.850     1.850
 assi 
   (  resid 116  and name  HD1#)
   (( resid 126  and name  HA  ))

      3.535     1.735     1.735
 assi 
   (  resid 116  and name  HD1#)
   (( resid 117  and name  HA  ))

      3.430     1.630     1.630
 assi 
   (( resid 50   and name  HA  ))
   (( resid 51   and name  HD1 ))

      2.645     0.845     0.845
 assi 
   (  resid 52   and name  HD2#)
   (( resid 57   and name  HA  ))

      3.120     1.320     1.320
 assi 
   (( resid 42   and name  HB2 ))
   (( resid 68   and name  HB  ))

      2.935     1.135     1.135
 assi 
   (( resid 42   and name  HA  ))
   (  resid 70   and name  HG2#)

      3.315     1.515     1.515
 assi 
   (( resid 105  and name  HA  ))
   (  resid 134  and name  HB# )

      2.845     1.045     1.045
 assi 
   (( resid 116  and name  HB  ))
   (( resid 147  and name  HA  ))

      3.165     1.365     1.365
 assi 
   (( resid 134  and name  HA  ))
   (( resid 137  and name  HB1 ))

      2.910     1.110     1.110
 assi 
   (( resid 55   and name  HA  ))
   (( resid 59   and name  HN  ))

      3.650     1.850     1.850
 assi 
   (( resid 60   and name  HA  ))
   (( resid 63   and name  HB2 ))

      3.175     1.375     1.375
 assi 
   (  resid 90   and name  HD1#)
   (( resid 91   and name  HH2 ))

      3.450     1.650     1.650
 assi 
   (  resid 7    and name  HB# )
   (( resid 8    and name  HN  ))

      3.040     1.240     1.240
 assi 
   (( resid 9    and name  HN  ))
   (  resid 9    and name  HB# )

      2.660     0.860     0.860
 assi 
   (( resid 9    and name  HA  ))
   (  resid 9    and name  HE2#)

      3.180     1.380     1.380
 assi 
   (( resid 10   and name  HA  ))
   (  resid 11   and name  HG# )

      3.265     1.465     1.465
 assi 
   (  resid 10   and name  HB# )
   (  resid 12   and name  HD# )

      3.330     1.530     1.530
 assi 
   (( resid 11   and name  HN  ))
   (  resid 11   and name  HG# )

      2.545     0.745     0.745
 assi 
   (  resid 11   and name  HG# )
   (  resid 12   and name  HD# )

      2.490     0.690     0.690
 assi 
   (  resid 11   and name  HG# )
   (( resid 13   and name  HA  ))

      3.385     1.585     1.585
 assi 
   (( resid 12   and name  HA  ))
   (  resid 13   and name  HB# )

      3.360     1.560     1.560
 assi 
   (( resid 12   and name  HA  ))
   (  resid 13   and name  HG# )

      3.185     1.385     1.385
 assi 
   (( resid 12   and name  HA  ))
   (  resid 13   and name  HD# )

      3.570     1.770     1.770
 assi 
   (  resid 12   and name  HB# )
   (( resid 13   and name  HN  ))

      2.520     0.720     0.720
 assi 
   (  resid 12   and name  HB# )
   (  resid 20   and name  HD# )

      2.750     0.950     0.950
 assi 
   (  resid 12   and name  HG# )
   (  resid 20   and name  HB# )

      3.095     1.295     1.295
 assi 
   (  resid 12   and name  HG# )
   (  resid 20   and name  HD# )

      2.545     0.745     0.745
 assi 
   (  resid 12   and name  HD# )
   (  resid 20   and name  HD# )

      3.005     1.205     1.205
 assi 
   (( resid 13   and name  HN  ))
   (  resid 13   and name  HG# )

      2.760     0.960     0.960
 assi 
   (( resid 13   and name  HA  ))
   (  resid 13   and name  HG# )

      2.655     0.855     0.855
 assi 
   (( resid 13   and name  HA  ))
   (  resid 13   and name  HD# )

      2.870     1.070     1.070
 assi 
   (  resid 13   and name  HB# )
   (  resid 13   and name  HE# )

      2.965     1.165     1.165
 assi 
   (  resid 13   and name  HB# )
   (( resid 14   and name  HN  ))

      2.885     1.085     1.085
 assi 
   (  resid 13   and name  HG# )
   (  resid 13   and name  HE# )

      2.535     0.735     0.735
 assi 
   (  resid 13   and name  HG# )
   (( resid 14   and name  HN  ))

      3.210     1.410     1.410
 assi 
   (  resid 13   and name  HD# )
   (( resid 14   and name  HN  ))

      3.570     1.770     1.770
 assi 
   (( resid 14   and name  HN  ))
   (  resid 14   and name  HB# )

      2.550     0.750     0.750
 assi 
   (( resid 14   and name  HA  ))
   (  resid 15   and name  HG# )

      2.960     1.160     1.160
 assi 
   (  resid 14   and name  HB# )
   (( resid 15   and name  HN  ))

      2.785     0.985     0.985
 assi 
   (  resid 14   and name  HB# )
   (( resid 15   and name  HA  ))

      3.570     1.770     1.770
 assi 
   (  resid 14   and name  HB# )
   (  resid 15   and name  HB# )

      3.235     1.435     1.435
 assi 
   (  resid 14   and name  HB# )
   (( resid 18   and name  HN  ))

      3.025     1.225     1.225
 assi 
   (  resid 14   and name  HB# )
   (( resid 18   and name  HA  ))

      3.240     1.440     1.440
 assi 
   (  resid 14   and name  HB# )
   (( resid 18   and name  HB2 ))

      3.035     1.235     1.235
 assi 
   (  resid 14   and name  HB# )
   (( resid 18   and name  HB1 ))

      3.085     1.285     1.285
 assi 
   (  resid 14   and name  HB# )
   (  resid 18   and name  HG# )

      3.215     1.415     1.415
 assi 
   (  resid 14   and name  HB# )
   (( resid 19   and name  HN  ))

      3.230     1.430     1.430
 assi 
   (  resid 14   and name  HB# )
   (  resid 25   and name  HB# )

      2.955     1.155     1.155
 assi 
   (( resid 15   and name  HN  ))
   (  resid 15   and name  HG# )

      2.660     0.860     0.860
 assi 
   (( resid 15   and name  HN  ))
   (  resid 18   and name  HG# )

      3.055     1.255     1.255
 assi 
   (( resid 15   and name  HN  ))
   (  resid 25   and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 15   and name  HA  ))
   (  resid 15   and name  HG# )

      2.665     0.865     0.865
 assi 
   (( resid 15   and name  HA  ))
   (  resid 16   and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 15   and name  HA  ))
   (  resid 16   and name  HD# )

      3.570     1.770     1.770
 assi 
   (( resid 15   and name  HA  ))
   (  resid 18   and name  HG# )

      3.570     1.770     1.770
 assi 
   (  resid 15   and name  HB# )
   (( resid 16   and name  HN  ))

      2.635     0.835     0.835
 assi 
   (  resid 15   and name  HB# )
   (  resid 16   and name  HB# )

      3.450     1.650     1.650
 assi 
   (  resid 15   and name  HB# )
   (( resid 17   and name  HN  ))

      2.900     1.100     1.100
 assi 
   (  resid 15   and name  HB# )
   (  resid 18   and name  HG# )

      3.490     1.690     1.690
 assi 
   (  resid 15   and name  HG# )
   (( resid 17   and name  HE1 ))

      3.035     1.235     1.235
 assi 
   (  resid 15   and name  HG# )
   (( resid 17   and name  HZ2 ))

      2.820     1.020     1.020
 assi 
   (  resid 15   and name  HG# )
   (( resid 17   and name  HH2 ))

      3.090     1.290     1.290
 assi 
   (  resid 15   and name  HE2#)
   (( resid 16   and name  HN  ))

      3.570     1.770     1.770
 assi 
   (( resid 16   and name  HN  ))
   (  resid 16   and name  HB# )

      2.445     0.645     0.645
 assi 
   (( resid 16   and name  HN  ))
   (  resid 16   and name  HG# )

      3.095     1.295     1.295
 assi 
   (( resid 16   and name  HN  ))
   (  resid 16   and name  HD# )

      3.095     1.295     1.295
 assi 
   (( resid 16   and name  HA  ))
   (  resid 16   and name  HG# )

      2.485     0.685     0.685
 assi 
   (( resid 16   and name  HA  ))
   (  resid 16   and name  HD# )

      3.095     1.295     1.295
 assi 
   (  resid 16   and name  HB# )
   (  resid 16   and name  HD# )

      2.470     0.670     0.670
 assi 
   (  resid 16   and name  HB# )
   (( resid 16   and name  HE  ))

      3.365     1.565     1.565
 assi 
   (  resid 16   and name  HB# )
   (( resid 17   and name  HN  ))

      2.780     0.980     0.980
 assi 
   (  resid 16   and name  HB# )
   (( resid 17   and name  HE3 ))

      3.060     1.260     1.260
 assi 
   (  resid 16   and name  HB# )
   (( resid 17   and name  HZ3 ))

      3.030     1.230     1.230
 assi 
   (  resid 16   and name  HB# )
   (  resid 114  and name  HD# )

      3.040     1.240     1.240
 assi 
   (  resid 16   and name  HB# )
   (  resid 114  and name  HE# )

      3.235     1.435     1.435
 assi 
   (  resid 16   and name  HG# )
   (( resid 17   and name  HE3 ))

      3.515     1.715     1.715
 assi 
   (  resid 16   and name  HG# )
   (( resid 17   and name  HZ3 ))

      3.570     1.770     1.770
 assi 
   (  resid 16   and name  HG# )
   (( resid 114  and name  HA  ))

      3.090     1.290     1.290
 assi 
   (  resid 16   and name  HG# )
   (  resid 114  and name  HD# )

      2.945     1.145     1.145
 assi 
   (  resid 16   and name  HG# )
   (  resid 114  and name  HE# )

      3.230     1.430     1.430
 assi 
   (  resid 16   and name  HD# )
   (  resid 114  and name  HD# )

      3.070     1.270     1.270
 assi 
   (  resid 16   and name  HD# )
   (  resid 114  and name  HE# )

      2.970     1.170     1.170
 assi 
   (  resid 16   and name  HD# )
   (( resid 115  and name  HN  ))

      3.020     1.220     1.220
 assi 
   (  resid 16   and name  HD# )
   (  resid 115  and name  HB# )

      3.340     1.540     1.540
 assi 
   (( resid 17   and name  HB2 ))
   (  resid 62   and name  HB# )

      3.445     1.645     1.645
 assi 
   (( resid 17   and name  HD1 ))
   (  resid 18   and name  HG# )

      3.080     1.280     1.280
 assi 
   (( resid 17   and name  HD1 ))
   (  resid 27   and name  HB# )

      3.540     1.740     1.740
 assi 
   (( resid 17   and name  HD1 ))
   (  resid 62   and name  HB# )

      2.860     1.060     1.060
 assi 
   (( resid 17   and name  HE1 ))
   (  resid 18   and name  HG# )

      2.905     1.105     1.105
 assi 
   (( resid 17   and name  HE1 ))
   (  resid 62   and name  HB# )

      2.835     1.035     1.035
 assi 
   (( resid 18   and name  HN  ))
   (  resid 18   and name  HG# )

      2.705     0.905     0.905
 assi 
   (( resid 18   and name  HA  ))
   (  resid 19   and name  HG# )

      3.070     1.270     1.270
 assi 
   (( resid 18   and name  HA  ))
   (  resid 27   and name  HB# )

      3.085     1.285     1.285
 assi 
   (( resid 18   and name  HB2 ))
   (  resid 25   and name  HB# )

      3.390     1.590     1.590
 assi 
   (  resid 18   and name  HG# )
   (( resid 27   and name  HN  ))

      3.200     1.400     1.400
 assi 
   (  resid 18   and name  HG# )
   (( resid 27   and name  HA  ))

      3.015     1.215     1.215
 assi 
   (( resid 19   and name  HN  ))
   (  resid 19   and name  HB# )

      2.675     0.875     0.875
 assi 
   (( resid 19   and name  HN  ))
   (  resid 19   and name  HG# )

      2.675     0.875     0.875
 assi 
   (( resid 19   and name  HN  ))
   (  resid 25   and name  HB# )

      3.520     1.720     1.720
 assi 
   (( resid 19   and name  HA  ))
   (  resid 19   and name  HG# )

      2.755     0.955     0.955
 assi 
   (  resid 19   and name  HB# )
   (( resid 20   and name  HN  ))

      2.585     0.785     0.785
 assi 
   (  resid 19   and name  HG# )
   (  resid 26   and name  HG2#)

      3.120     1.320     1.320
 assi 
   (  resid 19   and name  HG# )
   (( resid 28   and name  HN  ))

      2.915     1.115     1.115
 assi 
   (  resid 19   and name  HG# )
   (( resid 28   and name  HA  ))

      2.930     1.130     1.130
 assi 
   (( resid 20   and name  HN  ))
   (  resid 20   and name  HB# )

      2.310     0.510     0.510
 assi 
   (  resid 20   and name  HB# )
   (  resid 20   and name  HD# )

      2.135     0.335     0.335
 assi 
   (  resid 20   and name  HB# )
   (( resid 25   and name  HA  ))

      3.070     1.270     1.270
 assi 
   (  resid 20   and name  HD# )
   (( resid 21   and name  HN  ))

      2.650     0.850     0.850
 assi 
   (  resid 20   and name  HD# )
   (( resid 23   and name  HN  ))

      2.830     1.030     1.030
 assi 
   (  resid 20   and name  HD# )
   (( resid 23   and name  HA  ))

      2.605     0.805     0.805
 assi 
   (  resid 20   and name  HD# )
   (  resid 23   and name  HB# )

      3.240     1.440     1.440
 assi 
   (  resid 20   and name  HD# )
   (( resid 24   and name  HN  ))

      2.665     0.865     0.865
 assi 
   (  resid 20   and name  HD# )
   (( resid 25   and name  HN  ))

      3.110     1.310     1.310
 assi 
   (  resid 20   and name  HD# )
   (( resid 25   and name  HA  ))

      3.085     1.285     1.285
 assi 
   (( resid 22   and name  HA  ))
   (  resid 23   and name  HB# )

      3.005     1.205     1.205
 assi 
   (( resid 23   and name  HN  ))
   (  resid 23   and name  HB# )

      2.560     0.760     0.760
 assi 
   (  resid 23   and name  HB# )
   (( resid 24   and name  HA  ))

      3.440     1.640     1.640
 assi 
   (( resid 24   and name  HB2 ))
   (  resid 24   and name  HD# )

      2.660     0.860     0.860
 assi 
   (( resid 24   and name  HB2 ))
   (  resid 25   and name  HB# )

      3.275     1.475     1.475
 assi 
   (  resid 24   and name  HD# )
   (( resid 25   and name  HN  ))

      3.050     1.250     1.250
 assi 
   (  resid 24   and name  HD# )
   (  resid 26   and name  HG1#)

      2.730     0.930     0.930
 assi 
   (( resid 25   and name  HN  ))
   (  resid 25   and name  HB# )

      2.615     0.815     0.815
 assi 
   (  resid 25   and name  HB# )
   (( resid 26   and name  HN  ))

      2.815     1.015     1.015
 assi 
   (  resid 25   and name  HB# )
   (  resid 26   and name  HG1#)

      3.355     1.555     1.555
 assi 
   (( resid 27   and name  HN  ))
   (  resid 27   and name  HB# )

      2.590     0.790     0.790
 assi 
   (  resid 27   and name  HB# )
   (( resid 28   and name  HN  ))

      2.875     1.075     1.075
 assi 
   (  resid 27   and name  HB# )
   (  resid 59   and name  HG1#)

      2.975     1.175     1.175
 assi 
   (  resid 27   and name  HB# )
   (( resid 62   and name  HN  ))

      3.570     1.770     1.770
 assi 
   (  resid 27   and name  HB# )
   (  resid 62   and name  HB# )

      3.175     1.375     1.375
 assi 
   (  resid 27   and name  HB# )
   (( resid 63   and name  HA  ))

      2.965     1.165     1.165
 assi 
   (  resid 27   and name  HB# )
   (  resid 63   and name  HG# )

      2.780     0.980     0.980
 assi 
   (  resid 27   and name  HB# )
   (( resid 63   and name  HE21))

      2.965     1.165     1.165
 assi 
   (( resid 28   and name  HN  ))
   (  resid 28   and name  HB# )

      2.650     0.850     0.850
 assi 
   (  resid 28   and name  HB# )
   (( resid 29   and name  HN  ))

      2.865     1.065     1.065
 assi 
   (  resid 28   and name  HB# )
   (  resid 59   and name  HG2#)

      2.995     1.195     1.195
 assi 
   (  resid 28   and name  HE# )
   (( resid 29   and name  HN  ))

      3.140     1.340     1.340
 assi 
   (( resid 29   and name  HN  ))
   (  resid 32   and name  HB# )

      2.820     1.020     1.020
 assi 
   (( resid 29   and name  HA  ))
   (  resid 32   and name  HB# )

      3.490     1.690     1.690
 assi 
   (  resid 29   and name  HB# )
   (  resid 29   and name  HE# )

      2.555     0.755     0.755
 assi 
   (  resid 29   and name  HB# )
   (  resid 32   and name  HB# )

      2.955     1.155     1.155
 assi 
   (  resid 29   and name  HG# )
   (  resid 31   and name  HD# )

      3.340     1.540     1.540
 assi 
   (  resid 29   and name  HG# )
   (  resid 31   and name  HE# )

      2.890     1.090     1.090
 assi 
   (  resid 30   and name  HB# )
   (( resid 31   and name  HN  ))

      2.895     1.095     1.095
 assi 
   (  resid 30   and name  HB# )
   (  resid 59   and name  HG1#)

      2.775     0.975     0.975
 assi 
   (  resid 30   and name  HG# )
   (( resid 31   and name  HN  ))

      2.940     1.140     1.140
 assi 
   (  resid 30   and name  HG# )
   (  resid 31   and name  HD# )

      2.915     1.115     1.115
 assi 
   (  resid 30   and name  HG# )
   (  resid 31   and name  HE# )

      3.405     1.605     1.605
 assi 
   (( resid 31   and name  HN  ))
   (  resid 32   and name  HB# )

      2.920     1.120     1.120
 assi 
   (  resid 31   and name  HD# )
   (  resid 32   and name  HB# )

      3.565     1.765     1.765
 assi 
   (( resid 32   and name  HN  ))
   (  resid 32   and name  HB# )

      2.565     0.765     0.765
 assi 
   (( resid 32   and name  HN  ))
   (  resid 33   and name  HB# )

      3.090     1.290     1.290
 assi 
   (  resid 32   and name  HB# )
   (( resid 33   and name  HN  ))

      3.085     1.285     1.285
 assi 
   (( resid 33   and name  HN  ))
   (  resid 33   and name  HB# )

      2.465     0.665     0.665
 assi 
   (( resid 33   and name  HN  ))
   (  resid 34   and name  HA# )

      3.570     1.770     1.770
 assi 
   (( resid 33   and name  HA  ))
   (  resid 55   and name  HB# )

      3.180     1.380     1.380
 assi 
   (  resid 33   and name  HB# )
   (( resid 34   and name  HN  ))

      2.890     1.090     1.090
 assi 
   (  resid 33   and name  HB# )
   (  resid 55   and name  HB# )

      2.865     1.065     1.065
 assi 
   (  resid 33   and name  HB# )
   (( resid 56   and name  HN  ))

      3.035     1.235     1.235
 assi 
   (  resid 33   and name  HB# )
   (( resid 56   and name  HA  ))

      3.045     1.245     1.245
 assi 
   (  resid 33   and name  HB# )
   (  resid 59   and name  HG2#)

      3.355     1.555     1.555
 assi 
   (( resid 34   and name  HN  ))
   (  resid 35   and name  HD# )

      3.070     1.270     1.270
 assi 
   (( resid 34   and name  HN  ))
   (  resid 55   and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 35   and name  HA  ))
   (  resid 36   and name  HB# )

      3.370     1.570     1.570
 assi 
   (( resid 35   and name  HA  ))
   (  resid 90   and name  HD# )

      2.675     0.875     0.875
 assi 
   (  resid 35   and name  HB# )
   (  resid 90   and name  HD# )

      2.625     0.825     0.825
 assi 
   (  resid 35   and name  HB# )
   (  resid 111  and name  HG# )

      2.595     0.795     0.795
 assi 
   (  resid 35   and name  HB# )
   (  resid 113  and name  HA# )

      3.215     1.415     1.415
 assi 
   (( resid 36   and name  HN  ))
   (  resid 54   and name  HG# )

      3.560     1.760     1.760
 assi 
   (( resid 36   and name  HN  ))
   (  resid 90   and name  HD# )

      3.150     1.350     1.350
 assi 
   (( resid 36   and name  HA  ))
   (  resid 54   and name  HG# )

      2.945     1.145     1.145
 assi 
   (( resid 36   and name  HA  ))
   (  resid 90   and name  HD# )

      2.865     1.065     1.065
 assi 
   (  resid 36   and name  HB# )
   (( resid 37   and name  HN  ))

      2.895     1.095     1.095
 assi 
   (  resid 36   and name  HB# )
   (( resid 53   and name  HA  ))

      3.375     1.575     1.575
 assi 
   (  resid 36   and name  HB# )
   (( resid 53   and name  HB  ))

      3.015     1.215     1.215
 assi 
   (  resid 36   and name  HB# )
   (  resid 53   and name  HG2#)

      2.680     0.880     0.880
 assi 
   (  resid 36   and name  HB# )
   (  resid 54   and name  HG# )

      2.750     0.950     0.950
 assi 
   (  resid 36   and name  HB# )
   (( resid 55   and name  HN  ))

      2.855     1.055     1.055
 assi 
   (  resid 36   and name  HB# )
   (  resid 55   and name  HB# )

      2.670     0.870     0.870
 assi 
   (( resid 37   and name  HN  ))
   (  resid 37   and name  HD# )

      3.075     1.275     1.275
 assi 
   (( resid 37   and name  HN  ))
   (  resid 54   and name  HG# )

      2.720     0.920     0.920
 assi 
   (( resid 37   and name  HN  ))
   (  resid 129  and name  HG# )

      3.285     1.485     1.485
 assi 
   (( resid 37   and name  HA  ))
   (  resid 37   and name  HD# )

      2.660     0.860     0.860
 assi 
   (( resid 37   and name  HA  ))
   (  resid 54   and name  HG# )

      2.855     1.055     1.055
 assi 
   (( resid 37   and name  HB2 ))
   (  resid 54   and name  HG# )

      2.780     0.980     0.980
 assi 
   (( resid 37   and name  HB2 ))
   (  resid 129  and name  HG# )

      2.880     1.080     1.080
 assi 
   (( resid 37   and name  HB1 ))
   (  resid 54   and name  HG# )

      2.930     1.130     1.130
 assi 
   (( resid 37   and name  HB1 ))
   (  resid 129  and name  HG# )

      3.180     1.380     1.380
 assi 
   (  resid 37   and name  HD# )
   (( resid 38   and name  HN  ))

      3.035     1.235     1.235
 assi 
   (  resid 37   and name  HD# )
   (  resid 53   and name  HG2#)

      3.470     1.670     1.670
 assi 
   (  resid 37   and name  HD# )
   (  resid 54   and name  HG# )

      2.770     0.970     0.970
 assi 
   (  resid 37   and name  HD# )
   (( resid 91   and name  HE3 ))

      3.220     1.420     1.420
 assi 
   (  resid 37   and name  HD# )
   (( resid 91   and name  HZ3 ))

      3.175     1.375     1.375
 assi 
   (  resid 37   and name  HD# )
   (( resid 91   and name  HZ2 ))

      3.420     1.620     1.620
 assi 
   (  resid 37   and name  HD# )
   (( resid 91   and name  HH2 ))

      3.235     1.435     1.435
 assi 
   (  resid 37   and name  HD# )
   (( resid 129  and name  HA  ))

      2.880     1.080     1.080
 assi 
   (  resid 37   and name  HD# )
   (  resid 129  and name  HG# )

      2.715     0.915     0.915
 assi 
   (  resid 37   and name  HD2#)
   (( resid 129  and name  HG1 ))

      3.910     2.110     2.110
 assi 
   (  resid 37   and name  HD# )
   (  resid 132  and name  HB# )

      2.625     0.825     0.825
 assi 
   (  resid 37   and name  HD# )
   (( resid 133  and name  HN  ))

      2.860     1.060     1.060
 assi 
   (  resid 37   and name  HD# )
   (( resid 133  and name  HA2 ))

      2.800     1.000     1.000
 assi 
   (  resid 37   and name  HD# )
   (( resid 133  and name  HA1 ))

      3.010     1.210     1.210
 assi 
   (( resid 38   and name  HN  ))
   (  resid 54   and name  HG# )

      3.620     1.820     1.820
 assi 
   (( resid 38   and name  HA  ))
   (  resid 54   and name  HG# )

      3.440     1.640     1.640
 assi 
   (  resid 38   and name  HB# )
   (( resid 39   and name  HN  ))

      2.835     1.035     1.035
 assi 
   (  resid 38   and name  HB# )
   (  resid 39   and name  HG2#)

      3.570     1.770     1.770
 assi 
   (  resid 38   and name  HB# )
   (( resid 53   and name  HA  ))

      3.190     1.390     1.390
 assi 
   (  resid 38   and name  HB# )
   (  resid 53   and name  HG2#)

      2.815     1.015     1.015
 assi 
   (  resid 38   and name  HB# )
   (( resid 77   and name  HA  ))

      3.520     1.720     1.720
 assi 
   (  resid 38   and name  HB# )
   (( resid 77   and name  HB2 ))

      3.570     1.770     1.770
 assi 
   (  resid 38   and name  HB# )
   (( resid 77   and name  HG  ))

      3.045     1.245     1.245
 assi 
   (  resid 38   and name  HB# )
   (  resid 77   and name  HD1#)

      2.620     0.820     0.820
 assi 
   (  resid 38   and name  HB# )
   (  resid 77   and name  HD2#)

      2.585     0.785     0.785
 assi 
   (  resid 38   and name  HB# )
   (  resid 78   and name  HG# )

      3.050     1.250     1.250
 assi 
   (  resid 38   and name  HB# )
   (( resid 78   and name  HD1 ))

      3.570     1.770     1.770
 assi 
   (( resid 39   and name  HN  ))
   (  resid 54   and name  HG# )

      3.565     1.765     1.765
 assi 
   (( resid 39   and name  HB  ))
   (  resid 69   and name  HD# )

      2.885     1.085     1.085
 assi 
   (  resid 39   and name  HG1#)
   (  resid 54   and name  HG# )

      2.915     1.115     1.115
 assi 
   (  resid 39   and name  HG2#)
   (  resid 54   and name  HG# )

      2.775     0.975     0.975
 assi 
   (  resid 39   and name  HG2#)
   (  resid 69   and name  HD# )

      2.470     0.670     0.670
 assi 
   (  resid 39   and name  HG2#)
   (  resid 147  and name  HG1#)

      3.485     1.685     1.685
 assi 
   (( resid 41   and name  HN  ))
   (  resid 50   and name  HD# )

      2.975     1.175     1.175
 assi 
   (( resid 41   and name  HA  ))
   (  resid 42   and name  HB# )

      3.170     1.370     1.370
 assi 
   (( resid 41   and name  HA  ))
   (  resid 69   and name  HD# )

      2.855     1.055     1.055
 assi 
   (  resid 41   and name  HB# )
   (  resid 60   and name  HD# )

      3.365     1.565     1.565
 assi 
   (  resid 41   and name  HB# )
   (  resid 69   and name  HD# )

      2.515     0.715     0.715
 assi 
   (( resid 42   and name  HA  ))
   (  resid 42   and name  HG# )

      2.555     0.755     0.755
 assi 
   (( resid 42   and name  HA  ))
   (  resid 49   and name  HG1#)

      3.355     1.555     1.555
 assi 
   (( resid 42   and name  HA  ))
   (  resid 50   and name  HD# )

      3.095     1.295     1.295
 assi 
   (  resid 42   and name  HB# )
   (( resid 42   and name  HE21))

      2.900     1.100     1.100
 assi 
   (  resid 42   and name  HB# )
   (( resid 42   and name  HE22))

      2.970     1.170     1.170
 assi 
   (  resid 42   and name  HB# )
   (( resid 43   and name  HN  ))

      3.030     1.230     1.230
 assi 
   (  resid 42   and name  HB# )
   (( resid 49   and name  HA  ))

      3.180     1.380     1.380
 assi 
   (  resid 42   and name  HB# )
   (  resid 49   and name  HG2#)

      3.300     1.500     1.500
 assi 
   (  resid 42   and name  HB# )
   (  resid 49   and name  HD1#)

      2.755     0.955     0.955
 assi 
   (  resid 42   and name  HB# )
   (( resid 68   and name  HN  ))

      3.000     1.200     1.200
 assi 
   (  resid 42   and name  HB# )
   (( resid 70   and name  HB  ))

      3.570     1.770     1.770
 assi 
   (  resid 42   and name  HB# )
   (  resid 70   and name  HG2#)

      2.375     0.575     0.575
 assi 
   (  resid 42   and name  HG# )
   (( resid 42   and name  HE21))

      2.435     0.635     0.635
 assi 
   (  resid 42   and name  HG# )
   (( resid 42   and name  HE22))

      2.570     0.770     0.770
 assi 
   (  resid 42   and name  HG# )
   (( resid 43   and name  HN  ))

      2.645     0.845     0.845
 assi 
   (  resid 42   and name  HG# )
   (( resid 43   and name  HA  ))

      3.160     1.360     1.360
 assi 
   (  resid 42   and name  HG# )
   (( resid 47   and name  HA  ))

      2.655     0.855     0.855
 assi 
   (  resid 42   and name  HG# )
   (( resid 48   and name  HN  ))

      2.725     0.925     0.925
 assi 
   (  resid 42   and name  HG# )
   (  resid 49   and name  HD1#)

      2.875     1.075     1.075
 assi 
   (  resid 42   and name  HG# )
   (( resid 68   and name  HB  ))

      3.230     1.430     1.430
 assi 
   (( resid 42   and name  HE21))
   (  resid 47   and name  HB# )

      2.805     1.005     1.005
 assi 
   (( resid 42   and name  HE21))
   (  resid 47   and name  HD# )

      3.185     1.385     1.385
 assi 
   (( resid 42   and name  HE22))
   (  resid 47   and name  HB# )

      3.215     1.415     1.415
 assi 
   (( resid 42   and name  HE22))
   (  resid 47   and name  HD# )

      3.370     1.570     1.570
 assi 
   (( resid 43   and name  HN  ))
   (  resid 48   and name  HG# )

      2.895     1.095     1.095
 assi 
   (( resid 43   and name  HN  ))
   (  resid 50   and name  HD# )

      2.950     1.150     1.150
 assi 
   (( resid 43   and name  HA  ))
   (  resid 44   and name  HG# )

      3.110     1.310     1.310
 assi 
   (( resid 43   and name  HA  ))
   (  resid 50   and name  HD# )

      3.040     1.240     1.240
 assi 
   (  resid 43   and name  HB# )
   (( resid 44   and name  HN  ))

      2.890     1.090     1.090
 assi 
   (  resid 43   and name  HB# )
   (( resid 45   and name  HN  ))

      3.125     1.325     1.325
 assi 
   (  resid 43   and name  HB# )
   (  resid 46   and name  HB# )

      3.220     1.420     1.420
 assi 
   (  resid 43   and name  HB# )
   (( resid 47   and name  HN  ))

      2.945     1.145     1.145
 assi 
   (  resid 43   and name  HB# )
   (( resid 47   and name  HA  ))

      3.100     1.300     1.300
 assi 
   (  resid 43   and name  HB# )
   (( resid 48   and name  HB1 ))

      3.515     1.715     1.715
 assi 
   (  resid 43   and name  HB# )
   (  resid 48   and name  HG# )

      2.980     1.180     1.180
 assi 
   (  resid 43   and name  HB# )
   (  resid 50   and name  HD# )

      2.725     0.925     0.925
 assi 
   (  resid 43   and name  HB# )
   (  resid 67   and name  HE# )

      2.790     0.990     0.990
 assi 
   (( resid 44   and name  HN  ))
   (  resid 44   and name  HG# )

      2.745     0.945     0.945
 assi 
   (( resid 44   and name  HA  ))
   (  resid 44   and name  HG# )

      2.540     0.740     0.740
 assi 
   (( resid 44   and name  HA  ))
   (  resid 47   and name  HE# )

      3.125     1.325     1.325
 assi 
   (  resid 44   and name  HG# )
   (( resid 45   and name  HN  ))

      3.310     1.510     1.510
 assi 
   (  resid 44   and name  HG# )
   (( resid 66   and name  HB2 ))

      2.700     0.900     0.900
 assi 
   (  resid 44   and name  HG# )
   (( resid 66   and name  HB1 ))

      3.115     1.315     1.315
 assi 
   (  resid 44   and name  HG# )
   (( resid 67   and name  HA  ))

      2.990     1.190     1.190
 assi 
   (  resid 44   and name  HG# )
   (( resid 68   and name  HN  ))

      3.040     1.240     1.240
 assi 
   (  resid 44   and name  HG# )
   (( resid 68   and name  HB  ))

      3.205     1.405     1.405
 assi 
   (  resid 44   and name  HG# )
   (  resid 68   and name  HG2#)

      3.505     1.705     1.705
 assi 
   (( resid 45   and name  HN  ))
   (  resid 45   and name  HB# )

      2.325     0.525     0.525
 assi 
   (( resid 45   and name  HN  ))
   (  resid 45   and name  HG# )

      3.255     1.455     1.455
 assi 
   (( resid 45   and name  HN  ))
   (  resid 45   and name  HD# )

      3.130     1.330     1.330
 assi 
   (( resid 45   and name  HA  ))
   (  resid 45   and name  HG# )

      2.585     0.785     0.785
 assi 
   (( resid 45   and name  HA  ))
   (  resid 45   and name  HD# )

      2.545     0.745     0.745
 assi 
   (  resid 45   and name  HB# )
   (( resid 46   and name  HN  ))

      2.800     1.000     1.000
 assi 
   (  resid 45   and name  HB# )
   (( resid 46   and name  HA  ))

      3.335     1.535     1.535
 assi 
   (  resid 45   and name  HG# )
   (( resid 46   and name  HN  ))

      3.400     1.600     1.600
 assi 
   (( resid 46   and name  HN  ))
   (  resid 46   and name  HB# )

      2.555     0.755     0.755
 assi 
   (( resid 46   and name  HN  ))
   (  resid 48   and name  HG# )

      3.535     1.735     1.735
 assi 
   (( resid 46   and name  HA  ))
   (  resid 47   and name  HB# )

      3.570     1.770     1.770
 assi 
   (  resid 46   and name  HB# )
   (( resid 47   and name  HN  ))

      3.055     1.255     1.255
 assi 
   (  resid 46   and name  HB# )
   (( resid 48   and name  HN  ))

      2.935     1.135     1.135
 assi 
   (  resid 46   and name  HB# )
   (  resid 48   and name  HG# )

      2.645     0.845     0.845
 assi 
   (  resid 46   and name  HB# )
   (  resid 48   and name  HD# )

      2.875     1.075     1.075
 assi 
   (( resid 47   and name  HN  ))
   (  resid 47   and name  HB# )

      2.670     0.870     0.870
 assi 
   (( resid 47   and name  HN  ))
   (  resid 47   and name  HD# )

      2.630     0.830     0.830
 assi 
   (( resid 47   and name  HA  ))
   (  resid 47   and name  HD# )

      2.480     0.680     0.680
 assi 
   (( resid 47   and name  HA  ))
   (  resid 47   and name  HE# )

      2.900     1.100     1.100
 assi 
   (  resid 47   and name  HB# )
   (  resid 47   and name  HD# )

      2.485     0.685     0.685
 assi 
   (  resid 47   and name  HB# )
   (  resid 47   and name  HE# )

      2.800     1.000     1.000
 assi 
   (  resid 47   and name  HG# )
   (  resid 47   and name  HE# )

      2.685     0.885     0.885
 assi 
   (( resid 48   and name  HN  ))
   (  resid 48   and name  HD# )

      3.285     1.485     1.485
 assi 
   (( resid 48   and name  HN  ))
   (  resid 50   and name  HD# )

      3.620     1.820     1.820
 assi 
   (( resid 48   and name  HA  ))
   (  resid 48   and name  HG# )

      2.645     0.845     0.845
 assi 
   (( resid 48   and name  HA  ))
   (  resid 48   and name  HD# )

      3.135     1.335     1.335
 assi 
   (( resid 48   and name  HB1 ))
   (  resid 48   and name  HD# )

      2.595     0.795     0.795
 assi 
   (  resid 48   and name  HD# )
   (  resid 50   and name  HD# )

      2.735     0.935     0.935
 assi 
   (( resid 49   and name  HN  ))
   (  resid 49   and name  HG1#)

      2.910     1.110     1.110
 assi 
   (( resid 49   and name  HN  ))
   (  resid 74   and name  HB# )

      3.535     1.735     1.735
 assi 
   (( resid 49   and name  HA  ))
   (  resid 49   and name  HG1#)

      2.740     0.940     0.940
 assi 
   (( resid 49   and name  HA  ))
   (  resid 50   and name  HD# )

      3.200     1.400     1.400
 assi 
   (  resid 49   and name  HG2#)
   (  resid 49   and name  HG1#)

      2.520     0.720     0.720
 assi 
   (  resid 49   and name  HG2#)
   (  resid 74   and name  HB# )

      2.530     0.730     0.730
 assi 
   (( resid 50   and name  HN  ))
   (  resid 50   and name  HD# )

      2.575     0.775     0.775
 assi 
   (( resid 50   and name  HA  ))
   (  resid 50   and name  HD# )

      2.620     0.820     0.820
 assi 
   (( resid 50   and name  HB2 ))
   (  resid 50   and name  HD# )

      2.445     0.645     0.645
 assi 
   (  resid 50   and name  HD# )
   (( resid 51   and name  HG2 ))

      3.620     1.820     1.820
 assi 
   (  resid 50   and name  HD# )
   (( resid 51   and name  HD2 ))

      2.780     0.980     0.980
 assi 
   (  resid 50   and name  HD# )
   (( resid 52   and name  HN  ))

      3.425     1.625     1.625
 assi 
   (  resid 50   and name  HD# )
   (( resid 52   and name  HA  ))

      3.530     1.730     1.730
 assi 
   (  resid 50   and name  HD# )
   (  resid 52   and name  HD1#)

      2.465     0.665     0.665
 assi 
   (  resid 50   and name  HD# )
   (  resid 52   and name  HD2#)

      2.755     0.955     0.955
 assi 
   (  resid 50   and name  HD# )
   (( resid 67   and name  HB1 ))

      3.620     1.820     1.820
 assi 
   (  resid 50   and name  HD# )
   (  resid 67   and name  HD# )

      2.860     1.060     1.060
 assi 
   (  resid 50   and name  HD# )
   (  resid 67   and name  HE# )

      2.515     0.715     0.715
 assi 
   (( resid 52   and name  HA  ))
   (  resid 56   and name  HB# )

      3.135     1.335     1.335
 assi 
   (( resid 52   and name  HA  ))
   (  resid 56   and name  HD# )

      3.570     1.770     1.770
 assi 
   (( resid 52   and name  HA  ))
   (  resid 60   and name  HD# )

      3.620     1.820     1.820
 assi 
   (( resid 52   and name  HB1 ))
   (  resid 56   and name  HB# )

      2.845     1.045     1.045
 assi 
   (  resid 52   and name  HD2#)
   (  resid 56   and name  HB# )

      3.035     1.235     1.235
 assi 
   (  resid 52   and name  HD2#)
   (  resid 56   and name  HE# )

      3.280     1.480     1.480
 assi 
   (  resid 52   and name  HD2#)
   (  resid 60   and name  HD# )

      2.605     0.805     0.805
 assi 
   (( resid 53   and name  HN  ))
   (  resid 56   and name  HB# )

      2.600     0.800     0.800
 assi 
   (( resid 53   and name  HA  ))
   (  resid 54   and name  HG# )

      3.115     1.315     1.315
 assi 
   (( resid 53   and name  HA  ))
   (  resid 56   and name  HB# )

      3.330     1.530     1.530
 assi 
   (( resid 53   and name  HB  ))
   (  resid 56   and name  HB# )

      2.965     1.165     1.165
 assi 
   (  resid 53   and name  HG2#)
   (  resid 55   and name  HB# )

      3.230     1.430     1.430
 assi 
   (( resid 54   and name  HN  ))
   (  resid 54   and name  HG# )

      2.570     0.770     0.770
 assi 
   (( resid 54   and name  HB  ))
   (  resid 114  and name  HB# )

      3.570     1.770     1.770
 assi 
   (  resid 54   and name  HG# )
   (( resid 55   and name  HA  ))

      2.985     1.185     1.185
 assi 
   (  resid 54   and name  HG# )
   (( resid 56   and name  HN  ))

      3.620     1.820     1.820
 assi 
   (  resid 54   and name  HG# )
   (( resid 57   and name  HG2 ))

      3.620     1.820     1.820
 assi 
   (  resid 54   and name  HG# )
   (( resid 58   and name  HN  ))

      3.285     1.485     1.485
 assi 
   (  resid 54   and name  HG# )
   (( resid 58   and name  HA  ))

      3.620     1.820     1.820
 assi 
   (  resid 54   and name  HG# )
   (( resid 58   and name  HD2 ))

      2.665     0.865     0.865
 assi 
   (  resid 54   and name  HG# )
   (  resid 114  and name  HB# )

      2.510     0.710     0.710
 assi 
   (  resid 54   and name  HG# )
   (  resid 114  and name  HD# )

      3.005     1.205     1.205
 assi 
   (  resid 54   and name  HG# )
   (  resid 114  and name  HE# )

      3.160     1.360     1.360
 assi 
   (  resid 54   and name  HG# )
   (  resid 116  and name  HG2#)

      2.635     0.835     0.835
 assi 
   (  resid 54   and name  HG# )
   (  resid 129  and name  HG# )

      3.105     1.305     1.305
 assi 
   (  resid 54   and name  HG# )
   (( resid 147  and name  HA  ))

      2.705     0.905     0.905
 assi 
   (  resid 54   and name  HG# )
   (( resid 147  and name  HB  ))

      2.510     0.710     0.710
 assi 
   (  resid 54   and name  HG# )
   (  resid 147  and name  HG2#)

      2.590     0.790     0.790
 assi 
   (  resid 54   and name  HG# )
   (  resid 147  and name  HD1#)

      2.900     1.100     1.100
 assi 
   (  resid 55   and name  HB# )
   (( resid 56   and name  HN  ))

      2.760     0.960     0.960
 assi 
   (  resid 55   and name  HB# )
   (( resid 56   and name  HA  ))

      3.175     1.375     1.375
 assi 
   (  resid 55   and name  HB# )
   (  resid 114  and name  HD# )

      2.860     1.060     1.060
 assi 
   (  resid 55   and name  HB# )
   (  resid 114  and name  HE# )

      3.165     1.365     1.365
 assi 
   (( resid 56   and name  HN  ))
   (  resid 56   and name  HB# )

      2.590     0.790     0.790
 assi 
   (( resid 56   and name  HN  ))
   (  resid 56   and name  HD# )

      3.170     1.370     1.370
 assi 
   (( resid 56   and name  HA  ))
   (  resid 60   and name  HB# )

      3.570     1.770     1.770
 assi 
   (  resid 56   and name  HB# )
   (( resid 57   and name  HN  ))

      2.620     0.820     0.820
 assi 
   (( resid 57   and name  HN  ))
   (  resid 60   and name  HD# )

      3.430     1.630     1.630
 assi 
   (( resid 57   and name  HA  ))
   (  resid 60   and name  HB# )

      2.940     1.140     1.140
 assi 
   (( resid 57   and name  HB2 ))
   (  resid 60   and name  HD# )

      2.595     0.795     0.795
 assi 
   (( resid 57   and name  HB2 ))
   (  resid 69   and name  HD# )

      3.215     1.415     1.415
 assi 
   (( resid 57   and name  HG2 ))
   (  resid 69   and name  HD# )

      2.610     0.810     0.810
 assi 
   (  resid 57   and name  HE# )
   (  resid 69   and name  HD# )

      2.395     0.595     0.595
 assi 
   (( resid 58   and name  HN  ))
   (  resid 147  and name  HG1#)

      3.570     1.770     1.770
 assi 
   (( resid 58   and name  HA  ))
   (  resid 61   and name  HB# )

      2.650     0.850     0.850
 assi 
   (( resid 59   and name  HA  ))
   (  resid 62   and name  HB# )

      2.955     1.155     1.155
 assi 
   (( resid 59   and name  HA  ))
   (  resid 63   and name  HG# )

      3.570     1.770     1.770
 assi 
   (( resid 59   and name  HB  ))
   (  resid 60   and name  HB# )

      3.315     1.515     1.515
 assi 
   (  resid 59   and name  HG1#)
   (  resid 63   and name  HB# )

      3.320     1.520     1.520
 assi 
   (  resid 59   and name  HG1#)
   (  resid 63   and name  HG# )

      2.755     0.955     0.955
 assi 
   (  resid 59   and name  HG2#)
   (  resid 63   and name  HG# )

      3.360     1.560     1.560
 assi 
   (( resid 60   and name  HN  ))
   (  resid 60   and name  HB# )

      2.535     0.735     0.735
 assi 
   (( resid 60   and name  HN  ))
   (  resid 60   and name  HD# )

      2.735     0.935     0.935
 assi 
   (( resid 60   and name  HA  ))
   (  resid 60   and name  HD# )

      2.985     1.185     1.185
 assi 
   (( resid 60   and name  HA  ))
   (  resid 63   and name  HB# )

      2.760     0.960     0.960
 assi 
   (( resid 60   and name  HA  ))
   (  resid 65   and name  HG# )

      2.945     1.145     1.145
 assi 
   (  resid 60   and name  HB# )
   (  resid 60   and name  HD# )

      2.205     0.405     0.405
 assi 
   (  resid 60   and name  HB# )
   (( resid 61   and name  HN  ))

      2.735     0.935     0.935
 assi 
   (  resid 60   and name  HB# )
   (  resid 63   and name  HB# )

      3.490     1.690     1.690
 assi 
   (  resid 60   and name  HD# )
   (( resid 61   and name  HN  ))

      2.905     1.105     1.105
 assi 
   (  resid 60   and name  HD# )
   (( resid 61   and name  HA  ))

      3.220     1.420     1.420
 assi 
   (  resid 60   and name  HD# )
   (  resid 61   and name  HB# )

      2.680     0.880     0.880
 assi 
   (  resid 60   and name  HD# )
   (( resid 62   and name  HN  ))

      3.620     1.820     1.820
 assi 
   (  resid 60   and name  HD# )
   (( resid 65   and name  HA  ))

      3.235     1.435     1.435
 assi 
   (  resid 60   and name  HD# )
   (( resid 65   and name  HB2 ))

      2.665     0.865     0.865
 assi 
   (  resid 60   and name  HD# )
   (  resid 65   and name  HD# )

      2.990     1.190     1.190
 assi 
   (  resid 60   and name  HD# )
   (( resid 66   and name  HA  ))

      3.150     1.350     1.350
 assi 
   (  resid 60   and name  HD# )
   (( resid 67   and name  HA  ))

      3.455     1.655     1.655
 assi 
   (  resid 60   and name  HD# )
   (( resid 67   and name  HB2 ))

      3.235     1.435     1.435
 assi 
   (  resid 60   and name  HD# )
   (( resid 67   and name  HB1 ))

      3.440     1.640     1.640
 assi 
   (  resid 60   and name  HD# )
   (  resid 67   and name  HD# )

      2.705     0.905     0.905
 assi 
   (  resid 61   and name  HB# )
   (( resid 62   and name  HN  ))

      2.830     1.030     1.030
 assi 
   (  resid 61   and name  HB# )
   (( resid 67   and name  HN  ))

      3.570     1.770     1.770
 assi 
   (( resid 62   and name  HN  ))
   (  resid 62   and name  HB# )

      2.600     0.800     0.800
 assi 
   (  resid 62   and name  HB# )
   (( resid 63   and name  HN  ))

      2.810     1.010     1.010
 assi 
   (  resid 62   and name  HB# )
   (  resid 63   and name  HG# )

      3.390     1.590     1.590
 assi 
   (( resid 63   and name  HN  ))
   (  resid 63   and name  HB# )

      2.655     0.855     0.855
 assi 
   (( resid 63   and name  HN  ))
   (  resid 65   and name  HG# )

      3.180     1.380     1.380
 assi 
   (( resid 63   and name  HA  ))
   (  resid 63   and name  HG# )

      2.600     0.800     0.800
 assi 
   (  resid 63   and name  HB# )
   (( resid 64   and name  HN  ))

      2.850     1.050     1.050
 assi 
   (  resid 63   and name  HB# )
   (( resid 65   and name  HN  ))

      3.115     1.315     1.315
 assi 
   (  resid 63   and name  HB# )
   (  resid 65   and name  HG# )

      2.645     0.845     0.845
 assi 
   (  resid 63   and name  HG# )
   (( resid 63   and name  HE22))

      2.655     0.855     0.855
 assi 
   (  resid 63   and name  HG# )
   (( resid 64   and name  HN  ))

      3.500     1.700     1.700
 assi 
   (  resid 63   and name  HG# )
   (( resid 65   and name  HN  ))

      3.570     1.770     1.770
 assi 
   (( resid 64   and name  HN  ))
   (  resid 65   and name  HG# )

      3.080     1.280     1.280
 assi 
   (( resid 65   and name  HN  ))
   (  resid 65   and name  HG# )

      2.310     0.510     0.510
 assi 
   (( resid 65   and name  HN  ))
   (  resid 65   and name  HD# )

      3.085     1.285     1.285
 assi 
   (( resid 65   and name  HA  ))
   (  resid 65   and name  HG# )

      2.540     0.740     0.740
 assi 
   (( resid 65   and name  HA  ))
   (  resid 65   and name  HD# )

      2.545     0.745     0.745
 assi 
   (  resid 65   and name  HG# )
   (  resid 67   and name  HD# )

      3.445     1.645     1.645
 assi 
   (  resid 65   and name  HG# )
   (  resid 67   and name  HE# )

      3.060     1.260     1.260
 assi 
   (  resid 65   and name  HD# )
   (( resid 66   and name  HN  ))

      2.955     1.155     1.155
 assi 
   (( resid 67   and name  HB1 ))
   (  resid 69   and name  HD# )

      3.620     1.820     1.820
 assi 
   (( resid 68   and name  HA  ))
   (  resid 69   and name  HD# )

      2.540     0.740     0.740
 assi 
   (( resid 68   and name  HB  ))
   (  resid 69   and name  HD# )

      3.570     1.770     1.770
 assi 
   (  resid 68   and name  HG2#)
   (  resid 69   and name  HD# )

      2.930     1.130     1.130
 assi 
   (( resid 69   and name  HN  ))
   (  resid 69   and name  HD# )

      2.620     0.820     0.820
 assi 
   (( resid 69   and name  HA  ))
   (  resid 69   and name  HD# )

      2.440     0.640     0.640
 assi 
   (( resid 69   and name  HB2 ))
   (  resid 69   and name  HD# )

      2.375     0.575     0.575
 assi 
   (( resid 69   and name  HB1 ))
   (  resid 69   and name  HD# )

      2.465     0.665     0.665
 assi 
   (  resid 69   and name  HD# )
   (( resid 70   and name  HN  ))

      2.680     0.880     0.880
 assi 
   (  resid 69   and name  HD# )
   (( resid 147  and name  HN  ))

      3.055     1.255     1.255
 assi 
   (  resid 69   and name  HD# )
   (  resid 147  and name  HG1#)

      3.130     1.330     1.330
 assi 
   (( resid 70   and name  HB  ))
   (  resid 74   and name  HB# )

      2.890     1.090     1.090
 assi 
   (  resid 71   and name  HA# )
   (( resid 72   and name  HB1 ))

      3.570     1.770     1.770
 assi 
   (  resid 71   and name  HA# )
   (( resid 73   and name  HN  ))

      3.005     1.205     1.205
 assi 
   (( resid 72   and name  HN  ))
   (  resid 72   and name  HG# )

      3.000     1.200     0.945
 assi 
   (( resid 72   and name  HN  ))
   (  resid 72   and name  HD# )

      3.095     1.295     1.295
 assi 
   (( resid 72   and name  HA  ))
   (  resid 72   and name  HG# )

      2.645     0.845     0.845
 assi 
   (( resid 72   and name  HA  ))
   (  resid 72   and name  HD# )

      2.795     0.995     0.995
 assi 
   (( resid 72   and name  HA  ))
   (  resid 73   and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 72   and name  HB2 ))
   (  resid 72   and name  HG# )

      2.195     0.395     0.395
 assi 
   (( resid 72   and name  HB2 ))
   (  resid 72   and name  HD# )

      2.580     0.780     0.780
 assi 
   (  resid 72   and name  HG# )
   (( resid 72   and name  HE  ))

      2.730     0.930     0.930
 assi 
   (  resid 72   and name  HG# )
   (( resid 73   and name  HN  ))

      2.745     0.945     0.945
 assi 
   (  resid 72   and name  HG# )
   (  resid 73   and name  HB# )

      2.975     1.175     1.175
 assi 
   (  resid 72   and name  HG# )
   (( resid 74   and name  HN  ))

      3.370     1.570     1.570
 assi 
   (  resid 72   and name  HD# )
   (( resid 73   and name  HN  ))

      3.105     1.305     1.305
 assi 
   (  resid 72   and name  HD# )
   (( resid 73   and name  HA  ))

      2.760     0.960     0.960
 assi 
   (( resid 72   and name  HE  ))
   (  resid 73   and name  HB# )

      3.260     1.460     1.460
 assi 
   (( resid 73   and name  HN  ))
   (  resid 73   and name  HB# )

      2.570     0.770     0.770
 assi 
   (  resid 73   and name  HB# )
   (( resid 74   and name  HN  ))

      3.135     1.335     1.335
 assi 
   (( resid 80   and name  HN  ))
   (  resid 80   and name  HB# )

      2.625     0.825     0.825
 assi 
   (( resid 80   and name  HA  ))
   (  resid 80   and name  HB# )

      2.200     0.400     0.400
 assi 
   (  resid 80   and name  HB# )
   (( resid 81   and name  HN  ))

      2.790     0.990     0.990
 assi 
   (  resid 80   and name  HB# )
   (  resid 81   and name  HB# )

      2.970     1.170     1.170
 assi 
   (( resid 81   and name  HA  ))
   (  resid 82   and name  HB# )

      3.395     1.595     1.595
 assi 
   (  resid 81   and name  HB# )
   (  resid 82   and name  HB# )

      3.095     1.295     1.295
 assi 
   (  resid 81   and name  HB# )
   (  resid 82   and name  HG# )

      2.690     0.890     0.890
 assi 
   (  resid 81   and name  HB# )
   (  resid 83   and name  HE# )

      3.170     1.370     1.370
 assi 
   (( resid 82   and name  HN  ))
   (  resid 82   and name  HB# )

      2.550     0.750     0.750
 assi 
   (( resid 82   and name  HN  ))
   (  resid 82   and name  HG# )

      2.665     0.865     0.865
 assi 
   (( resid 82   and name  HA  ))
   (  resid 82   and name  HB# )

      2.215     0.415     0.415
 assi 
   (( resid 82   and name  HA  ))
   (  resid 83   and name  HG# )

      3.315     1.515     1.515
 assi 
   (( resid 82   and name  HA  ))
   (  resid 83   and name  HE# )

      3.095     1.295     1.295
 assi 
   (  resid 82   and name  HB# )
   (( resid 83   and name  HN  ))

      3.085     1.285     1.285
 assi 
   (  resid 82   and name  HG# )
   (  resid 83   and name  HE# )

      3.190     1.390     1.390
 assi 
   (( resid 83   and name  HN  ))
   (  resid 83   and name  HG# )

      2.650     0.850     0.850
 assi 
   (( resid 83   and name  HN  ))
   (  resid 83   and name  HE# )

      3.200     1.400     1.400
 assi 
   (( resid 83   and name  HA  ))
   (  resid 83   and name  HG# )

      2.545     0.745     0.745
 assi 
   (( resid 83   and name  HA  ))
   (  resid 83   and name  HD# )

      2.505     0.705     0.705
 assi 
   (( resid 83   and name  HA  ))
   (  resid 83   and name  HE# )

      2.760     0.960     0.960
 assi 
   (( resid 83   and name  HB2 ))
   (  resid 88   and name  HB# )

      3.500     1.705     1.705
 assi 
   (  resid 83   and name  HG# )
   (  resid 83   and name  HE# )

      2.300     0.500     0.500
 assi 
   (  resid 83   and name  HD# )
   (( resid 84   and name  HN  ))

      3.100     1.300     1.300
 assi 
   (( resid 84   and name  HA  ))
   (  resid 100  and name  HB# )

      3.200     1.400     1.400
 assi 
   (  resid 84   and name  HB# )
   (  resid 85   and name  HB# )

      3.300     1.500     1.500
 assi 
   (  resid 84   and name  HB# )
   (  resid 101  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 85   and name  HN  ))
   (  resid 85   and name  HB# )

      2.580     0.780     0.780
 assi 
   (( resid 85   and name  HN  ))
   (  resid 100  and name  HB# )

      3.400     1.600     1.600
 assi 
   (  resid 86   and name  HA# )
   (  resid 87   and name  HB# )

      3.045     1.245     1.245
 assi 
   (( resid 88   and name  HN  ))
   (  resid 88   and name  HB# )

      2.710     0.910     0.910
 assi 
   (( resid 90   and name  HA  ))
   (  resid 90   and name  HD# )

      2.610     0.810     0.810
 assi 
   (  resid 90   and name  HB# )
   (( resid 91   and name  HN  ))

      3.015     1.215     1.215
 assi 
   (  resid 90   and name  HB# )
   (( resid 91   and name  HZ3 ))

      3.570     1.770     1.770
 assi 
   (  resid 90   and name  HB# )
   (( resid 92   and name  HN  ))

      3.315     1.515     1.515
 assi 
   (  resid 90   and name  HB# )
   (  resid 111  and name  HB# )

      3.080     1.280     1.280
 assi 
   (  resid 90   and name  HB# )
   (  resid 111  and name  HG# )

      3.360     1.560     1.560
 assi 
   (  resid 90   and name  HD# )
   (( resid 91   and name  HN  ))

      2.880     1.080     1.080
 assi 
   (  resid 90   and name  HD# )
   (( resid 91   and name  HE3 ))

      2.880     1.080     1.080
 assi 
   (  resid 90   and name  HD# )
   (( resid 91   and name  HZ3 ))

      3.070     1.270     1.270
 assi 
   (  resid 90   and name  HD# )
   (( resid 111  and name  HN  ))

      3.620     1.820     1.820
 assi 
   (  resid 90   and name  HD# )
   (  resid 111  and name  HB# )

      3.165     1.365     1.365
 assi 
   (  resid 90   and name  HD# )
   (  resid 111  and name  HG# )

      2.500     0.700     0.700
 assi 
   (  resid 90   and name  HD# )
   (( resid 113  and name  HN  ))

      3.155     1.355     1.355
 assi 
   (  resid 90   and name  HD# )
   (  resid 113  and name  HA# )

      2.775     0.975     0.975
 assi 
   (  resid 90   and name  HD# )
   (( resid 114  and name  HN  ))

      3.620     1.820     1.820
 assi 
   (  resid 90   and name  HD# )
   (( resid 129  and name  HB2 ))

      3.490     1.690     1.690
 assi 
   (  resid 90   and name  HD# )
   (( resid 129  and name  HB1 ))

      2.640     0.840     0.840
 assi 
   (  resid 90   and name  HD# )
   (  resid 129  and name  HG# )

      2.680     0.880     0.880
 assi 
   (  resid 90   and name  HD# )
   (( resid 130  and name  HN  ))

      2.830     1.030     1.030
 assi 
   (  resid 90   and name  HD# )
   (( resid 130  and name  HA  ))

      2.620     0.820     0.820
 assi 
   (  resid 90   and name  HD# )
   (  resid 130  and name  HB# )

      2.705     0.905     0.905
 assi 
   (  resid 90   and name  HD# )
   (( resid 131  and name  HN  ))

      3.620     1.820     1.820
 assi 
   (( resid 91   and name  HD1 ))
   (  resid 103  and name  HB# )

      3.155     1.355     1.355
 assi 
   (( resid 92   and name  HN  ))
   (  resid 93   and name  HB# )

      3.570     1.770     1.770
 assi 
   (  resid 92   and name  HA# )
   (( resid 103  and name  HA  ))

      3.005     1.205     1.205
 assi 
   (  resid 92   and name  HA# )
   (( resid 104  and name  HN  ))

      2.950     1.150     1.150
 assi 
   (( resid 93   and name  HN  ))
   (  resid 93   and name  HB# )

      2.735     0.935     0.935
 assi 
   (( resid 93   and name  HN  ))
   (  resid 101  and name  HB# )

      3.490     1.690     1.690
 assi 
   (( resid 93   and name  HN  ))
   (  resid 102  and name  HG# )

      2.945     1.145     1.145
 assi 
   (( resid 93   and name  HA  ))
   (  resid 93   and name  HG# )

      2.645     0.845     0.845
 assi 
   (( resid 93   and name  HA  ))
   (  resid 93   and name  HE# )

      2.845     1.045     1.045
 assi 
   (  resid 93   and name  HB# )
   (  resid 93   and name  HE# )

      3.015     1.215     1.215
 assi 
   (  resid 93   and name  HB# )
   (( resid 94   and name  HN  ))

      2.765     0.965     0.965
 assi 
   (  resid 93   and name  HB# )
   (( resid 102  and name  HN  ))

      3.560     1.760     1.760
 assi 
   (  resid 93   and name  HB# )
   (  resid 102  and name  HG# )

      3.600     1.800     1.800
 assi 
   (  resid 93   and name  HG# )
   (  resid 93   and name  HE# )

      2.545     0.745     0.745
 assi 
   (  resid 93   and name  HG# )
   (( resid 94   and name  HN  ))

      2.995     1.195     1.195
 assi 
   (( resid 94   and name  HN  ))
   (  resid 94   and name  HB# )

      2.485     0.685     0.685
 assi 
   (  resid 94   and name  HB# )
   (( resid 101  and name  HA  ))

      3.600     1.800     1.800
 assi 
   (  resid 94   and name  HB# )
   (( resid 102  and name  HN  ))

      3.345     1.545     1.545
 assi 
   (( resid 100  and name  HA  ))
   (  resid 100  and name  HG# )

      2.610     0.810     0.810
 assi 
   (( resid 100  and name  HA  ))
   (  resid 100  and name  HD# )

      3.100     1.300     1.300
 assi 
   (  resid 100  and name  HB# )
   (  resid 100  and name  HG# )

      2.065     0.265     0.265
 assi 
   (  resid 100  and name  HB# )
   (  resid 100  and name  HD# )

      2.425     0.625     0.625
 assi 
   (  resid 100  and name  HG# )
   (( resid 101  and name  HN  ))

      3.045     1.245     1.245
 assi 
   (  resid 100  and name  HG# )
   (  resid 101  and name  HB# )

      3.490     1.690     1.690
 assi 
   (  resid 100  and name  HD# )
   (( resid 101  and name  HN  ))

      3.360     1.560     1.560
 assi 
   (  resid 100  and name  HD# )
   (( resid 102  and name  HA  ))

      3.800     2.000     2.000
 assi 
   (  resid 100  and name  HE# )
   (( resid 102  and name  HA  ))

      3.300     1.500     1.500
 assi 
   (  resid 100  and name  HE# )
   (( resid 102  and name  HB  ))

      3.300     1.500     1.500
 assi 
   (  resid 100  and name  HE# )
   (  resid 102  and name  HG# )

      2.900     1.100     1.100
 assi 
   (( resid 101  and name  HN  ))
   (  resid 101  and name  HB# )

      2.705     0.905     0.905
 assi 
   (( resid 101  and name  HA  ))
   (  resid 102  and name  HG# )

      3.035     1.235     1.235
 assi 
   (( resid 102  and name  HN  ))
   (  resid 102  and name  HG# )

      2.550     0.750     0.750
 assi 
   (( resid 102  and name  HA  ))
   (  resid 102  and name  HG# )

      2.365     0.565     0.565
 assi 
   (  resid 102  and name  HG# )
   (( resid 103  and name  HN  ))

      2.525     0.725     0.725
 assi 
   (  resid 102  and name  HG# )
   (( resid 103  and name  HA  ))

      2.970     1.170     1.170
 assi 
   (  resid 102  and name  HG# )
   (( resid 104  and name  HA  ))

      3.115     1.315     1.315
 assi 
   (  resid 102  and name  HG# )
   (  resid 104  and name  HG# )

      3.000     1.200     1.200
 assi 
   (( resid 103  and name  HN  ))
   (  resid 103  and name  HB# )

      2.580     0.780     0.780
 assi 
   (  resid 103  and name  HB# )
   (( resid 104  and name  HN  ))

      2.895     1.095     1.095
 assi 
   (  resid 103  and name  HB# )
   (( resid 134  and name  HA  ))

      3.050     1.250     1.250
 assi 
   (  resid 103  and name  HB# )
   (  resid 134  and name  HB# )

      2.775     0.975     0.975
 assi 
   (  resid 103  and name  HB# )
   (( resid 137  and name  HB2 ))

      3.015     1.215     1.215
 assi 
   (  resid 103  and name  HB# )
   (( resid 137  and name  HB1 ))

      3.305     1.505     1.505
 assi 
   (  resid 103  and name  HB# )
   (  resid 138  and name  HB# )

      3.020     1.220     1.220
 assi 
   (  resid 103  and name  HB# )
   (  resid 138  and name  HG# )

      3.370     1.570     1.570
 assi 
   (( resid 104  and name  HN  ))
   (  resid 104  and name  HG# )

      3.040     1.240     1.240
 assi 
   (( resid 104  and name  HA  ))
   (  resid 104  and name  HG# )

      2.720     0.920     0.920
 assi 
   (( resid 104  and name  HA  ))
   (  resid 105  and name  HG# )

      3.100     1.300     1.300
 assi 
   (( resid 105  and name  HN  ))
   (  resid 105  and name  HB# )

      2.495     0.695     0.695
 assi 
   (( resid 105  and name  HN  ))
   (  resid 105  and name  HG# )

      2.605     0.805     0.805
 assi 
   (( resid 105  and name  HA  ))
   (  resid 105  and name  HG# )

      2.580     0.780     0.780
 assi 
   (  resid 105  and name  HB# )
   (( resid 106  and name  HN  ))

      2.500     0.700     0.700
 assi 
   (  resid 105  and name  HB# )
   (( resid 106  and name  HA  ))

      3.185     1.385     1.385
 assi 
   (  resid 105  and name  HB# )
   (( resid 107  and name  HN  ))

      2.545     0.745     0.745
 assi 
   (  resid 105  and name  HB# )
   (  resid 107  and name  HB# )

      3.350     1.550     1.550
 assi 
   (  resid 105  and name  HB# )
   (( resid 108  and name  HN  ))

      3.425     1.625     1.625
 assi 
   (  resid 105  and name  HG# )
   (( resid 106  and name  HN  ))

      3.015     1.215     1.215
 assi 
   (  resid 105  and name  HG# )
   (  resid 134  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 106  and name  HA  ))
   (  resid 109  and name  HB# )

      3.415     1.615     1.615
 assi 
   (( resid 106  and name  HA  ))
   (  resid 131  and name  HG# )

      3.070     1.270     1.270
 assi 
   (  resid 106  and name  HB# )
   (  resid 107  and name  HB# )

      3.270     1.470     1.470
 assi 
   (  resid 106  and name  HB# )
   (  resid 131  and name  HG# )

      2.555     0.755     0.755
 assi 
   (  resid 106  and name  HB# )
   (  resid 135  and name  HD# )

      2.875     1.075     1.075
 assi 
   (( resid 107  and name  HN  ))
   (  resid 107  and name  HB# )

      2.560     0.760     0.760
 assi 
   (  resid 107  and name  HB# )
   (  resid 108  and name  HB# )

      3.490     1.690     1.690
 assi 
   (( resid 108  and name  HN  ))
   (  resid 108  and name  HB# )

      2.460     0.660     0.660
 assi 
   (( resid 108  and name  HN  ))
   (  resid 108  and name  HG# )

      3.240     1.440     1.440
 assi 
   (( resid 108  and name  HN  ))
   (  resid 109  and name  HB# )

      3.445     1.645     1.645
 assi 
   (( resid 108  and name  HA  ))
   (  resid 108  and name  HG# )

      2.750     0.950     0.950
 assi 
   (( resid 109  and name  HN  ))
   (  resid 109  and name  HB# )

      2.455     0.655     0.655
 assi 
   (( resid 109  and name  HA  ))
   (  resid 110  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 109  and name  HA  ))
   (  resid 130  and name  HB# )

      3.175     1.375     1.375
 assi 
   (  resid 109  and name  HB# )
   (( resid 110  and name  HN  ))

      2.825     1.025     1.025
 assi 
   (  resid 109  and name  HB# )
   (( resid 110  and name  HA  ))

      3.570     1.770     1.770
 assi 
   (  resid 109  and name  HB# )
   (( resid 130  and name  HA  ))

      3.570     1.770     1.770
 assi 
   (  resid 109  and name  HB# )
   (  resid 130  and name  HB# )

      3.015     1.215     1.215
 assi 
   (  resid 109  and name  HB# )
   (  resid 134  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 110  and name  HA  ))
   (  resid 110  and name  HG# )

      2.700     0.900     0.900
 assi 
   (  resid 110  and name  HB# )
   (( resid 111  and name  HN  ))

      2.895     1.095     1.095
 assi 
   (( resid 111  and name  HN  ))
   (  resid 111  and name  HB# )

      2.425     0.625     0.625
 assi 
   (( resid 111  and name  HA  ))
   (  resid 111  and name  HG# )

      2.610     0.810     0.810
 assi 
   (  resid 111  and name  HB# )
   (( resid 112  and name  HN  ))

      2.770     0.970     0.970
 assi 
   (  resid 111  and name  HG# )
   (( resid 112  and name  HN  ))

      2.765     0.965     0.965
 assi 
   (  resid 111  and name  HG# )
   (( resid 113  and name  HN  ))

      2.825     1.025     1.025
 assi 
   (  resid 111  and name  HG# )
   (  resid 113  and name  HA# )

      3.490     1.690     1.690
 assi 
   (( resid 112  and name  HN  ))
   (  resid 112  and name  HB# )

      2.700     0.900     0.900
 assi 
   (( resid 112  and name  HN  ))
   (  resid 112  and name  HG# )

      2.585     0.785     0.785
 assi 
   (  resid 112  and name  HB# )
   (( resid 113  and name  HN  ))

      2.975     1.175     1.175
 assi 
   (  resid 112  and name  HB# )
   (  resid 113  and name  HA# )

      3.080     1.280     1.280
 assi 
   (  resid 112  and name  HG# )
   (( resid 113  and name  HN  ))

      3.130     1.330     1.330
 assi 
   (( resid 113  and name  HN  ))
   (  resid 129  and name  HG# )

      3.570     1.770     1.770
 assi 
   (  resid 113  and name  HA# )
   (( resid 129  and name  HN  ))

      3.350     1.550     1.550
 assi 
   (  resid 113  and name  HA# )
   (( resid 129  and name  HA  ))

      3.415     1.615     1.615
 assi 
   (  resid 113  and name  HA# )
   (( resid 129  and name  HB2 ))

      2.840     1.040     1.040
 assi 
   (  resid 113  and name  HA# )
   (( resid 129  and name  HB1 ))

      2.815     1.015     1.015
 assi 
   (  resid 113  and name  HA# )
   (  resid 129  and name  HG# )

      3.420     1.620     1.620
 assi 
   (( resid 114  and name  HN  ))
   (  resid 129  and name  HG# )

      3.390     1.590     1.590
 assi 
   (  resid 114  and name  HB# )
   (( resid 115  and name  HN  ))

      2.640     0.840     0.840
 assi 
   (  resid 114  and name  HB# )
   (  resid 116  and name  HG2#)

      2.670     0.870     0.870
 assi 
   (( resid 115  and name  HA  ))
   (  resid 128  and name  HB# )

      3.570     1.770     1.770
 assi 
   (  resid 115  and name  HB# )
   (( resid 116  and name  HN  ))

      2.910     1.110     1.110
 assi 
   (  resid 115  and name  HB# )
   (  resid 116  and name  HG2#)

      3.245     1.445     1.445
 assi 
   (  resid 115  and name  HB# )
   (  resid 126  and name  HG2#)

      2.805     1.005     1.005
 assi 
   (  resid 115  and name  HB# )
   (( resid 127  and name  HN  ))

      3.570     1.770     1.770
 assi 
   (  resid 115  and name  HB# )
   (( resid 128  and name  HN  ))

      3.570     1.770     1.770
 assi 
   (  resid 115  and name  HB# )
   (( resid 128  and name  HA  ))

      3.060     1.260     1.260
 assi 
   (  resid 115  and name  HB# )
   (( resid 149  and name  HB1 ))

      3.085     1.285     1.285
 assi 
   (( resid 116  and name  HB  ))
   (  resid 144  and name  HG# )

      2.675     0.875     0.875
 assi 
   (  resid 116  and name  HG2#)
   (  resid 129  and name  HG# )

      2.975     1.175     1.175
 assi 
   (( resid 116  and name  HG11))
   (  resid 129  and name  HG# )

      3.570     1.770     1.770
 assi 
   (  resid 116  and name  HD1#)
   (  resid 127  and name  HB# )

      2.910     1.110     1.110
 assi 
   (  resid 116  and name  HD1#)
   (  resid 129  and name  HG# )

      2.925     1.125     1.125
 assi 
   (( resid 117  and name  HN  ))
   (  resid 118  and name  HG# )

      3.620     1.820     1.820
 assi 
   (( resid 117  and name  HN  ))
   (  resid 144  and name  HG# )

      3.215     1.415     1.415
 assi 
   (( resid 117  and name  HA  ))
   (  resid 118  and name  HG# )

      2.820     1.020     1.020
 assi 
   (( resid 117  and name  HB2 ))
   (  resid 150  and name  HB# )

      3.220     1.420     1.420
 assi 
   (( resid 117  and name  HB1 ))
   (  resid 146  and name  HB# )

      2.765     0.965     0.965
 assi 
   (( resid 118  and name  HN  ))
   (  resid 118  and name  HG# )

      2.580     0.780     0.780
 assi 
   (  resid 118  and name  HG# )
   (( resid 119  and name  HN  ))

      2.620     0.820     0.820
 assi 
   (  resid 118  and name  HG# )
   (( resid 119  and name  HA  ))

      3.095     1.295     1.295
 assi 
   (  resid 118  and name  HG# )
   (( resid 125  and name  HN  ))

      3.165     1.365     1.365
 assi 
   (  resid 118  and name  HG# )
   (( resid 126  and name  HA  ))

      3.205     1.405     1.405
 assi 
   (  resid 118  and name  HG# )
   (( resid 127  and name  HN  ))

      2.935     1.135     1.135
 assi 
   (  resid 118  and name  HG# )
   (  resid 127  and name  HB# )

      3.025     1.225     1.225
 assi 
   (  resid 118  and name  HG# )
   (( resid 127  and name  HG2 ))

      2.790     0.990     0.990
 assi 
   (  resid 118  and name  HG# )
   (( resid 127  and name  HG1 ))

      2.710     0.910     0.910
 assi 
   (  resid 118  and name  HG# )
   (  resid 127  and name  HE# )

      2.285     0.485     0.485
 assi 
   (  resid 118  and name  HG# )
   (  resid 132  and name  HB# )

      2.375     0.575     0.575
 assi 
   (  resid 118  and name  HG# )
   (( resid 142  and name  HB  ))

      2.365     0.565     0.565
 assi 
   (  resid 118  and name  HG# )
   (( resid 143  and name  HN  ))

      2.650     0.850     0.850
 assi 
   (  resid 118  and name  HG# )
   (( resid 143  and name  HA  ))

      2.850     1.050     1.050
 assi 
   (  resid 118  and name  HG# )
   (( resid 143  and name  HB2 ))

      3.120     1.320     1.320
 assi 
   (  resid 118  and name  HG# )
   (( resid 143  and name  HB1 ))

      3.125     1.325     1.325
 assi 
   (  resid 118  and name  HG# )
   (( resid 144  and name  HN  ))

      2.985     1.185     1.185
 assi 
   (  resid 118  and name  HG# )
   (( resid 144  and name  HA  ))

      2.520     0.720     0.720
 assi 
   (( resid 119  and name  HN  ))
   (  resid 124  and name  HG# )

      3.570     1.770     1.770
 assi 
   (( resid 119  and name  HA  ))
   (  resid 120  and name  HG# )

      3.205     1.405     1.405
 assi 
   (( resid 119  and name  HA  ))
   (  resid 124  and name  HG# )

      3.245     1.445     1.445
 assi 
   (( resid 120  and name  HN  ))
   (  resid 120  and name  HG# )

      2.505     0.705     0.705
 assi 
   (( resid 120  and name  HN  ))
   (  resid 124  and name  HG# )

      3.560     1.760     1.760
 assi 
   (( resid 120  and name  HA  ))
   (  resid 120  and name  HG# )

      2.395     0.595     0.595
 assi 
   (  resid 120  and name  HG# )
   (( resid 121  and name  HN  ))

      2.535     0.735     0.735
 assi 
   (  resid 120  and name  HG# )
   (( resid 121  and name  HA  ))

      2.870     1.070     1.070
 assi 
   (  resid 120  and name  HG# )
   (( resid 121  and name  HB2 ))

      2.765     0.965     0.965
 assi 
   (  resid 120  and name  HG# )
   (( resid 121  and name  HB1 ))

      3.025     1.225     1.225
 assi 
   (  resid 120  and name  HG# )
   (( resid 121  and name  HD21))

      2.775     0.975     0.975
 assi 
   (  resid 120  and name  HG# )
   (( resid 121  and name  HD22))

      2.795     0.995     0.995
 assi 
   (  resid 120  and name  HG# )
   (( resid 125  and name  HN  ))

      3.115     1.315     1.315
 assi 
   (  resid 120  and name  HG# )
   (( resid 125  and name  HB1 ))

      2.695     0.895     0.895
 assi 
   (  resid 120  and name  HG# )
   (  resid 125  and name  HE2#)

      2.750     0.950     0.950
 assi 
   (  resid 120  and name  HG# )
   (  resid 127  and name  HE# )

      2.275     0.475     0.475
 assi 
   (  resid 120  and name  HG# )
   (( resid 140  and name  HG2 ))

      3.015     1.215     1.215
 assi 
   (  resid 120  and name  HG# )
   (( resid 140  and name  HG1 ))

      3.140     1.340     1.340
 assi 
   (  resid 120  and name  HG# )
   (  resid 140  and name  HE2#)

      3.535     1.735     1.735
 assi 
   (  resid 120  and name  HG# )
   (( resid 142  and name  HA  ))

      2.895     1.095     1.095
 assi 
   (( resid 121  and name  HB2 ))
   (  resid 123  and name  HB# )

      3.495     1.695     1.695
 assi 
   (( resid 121  and name  HB2 ))
   (  resid 123  and name  HG# )

      3.570     1.770     1.770
 assi 
   (( resid 121  and name  HB2 ))
   (  resid 123  and name  HD# )

      3.145     1.345     1.345
 assi 
   (( resid 121  and name  HB1 ))
   (  resid 123  and name  HD# )

      3.015     1.215     1.215
 assi 
   (( resid 122  and name  HA2 ))
   (  resid 123  and name  HG# )

      3.800     2.000     2.000
 assi 
   (( resid 122  and name  HA1 ))
   (  resid 123  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 122  and name  HA1 ))
   (  resid 123  and name  HD# )

      3.570     1.770     1.770
 assi 
   (( resid 123  and name  HN  ))
   (  resid 123  and name  HB# )

      2.605     0.805     0.805
 assi 
   (( resid 123  and name  HN  ))
   (  resid 123  and name  HG# )

      2.685     0.885     0.885
 assi 
   (( resid 123  and name  HN  ))
   (  resid 123  and name  HD# )

      3.085     1.285     1.285
 assi 
   (( resid 123  and name  HA  ))
   (  resid 124  and name  HG# )

      3.010     1.210     1.210
 assi 
   (  resid 123  and name  HB# )
   (  resid 123  and name  HE# )

      2.765     0.965     0.965
 assi 
   (  resid 123  and name  HB# )
   (( resid 124  and name  HN  ))

      2.560     0.760     0.760
 assi 
   (  resid 123  and name  HB# )
   (  resid 124  and name  HG# )

      3.315     1.515     1.515
 assi 
   (  resid 123  and name  HG# )
   (  resid 123  and name  HD# )

      2.075     0.275     0.275
 assi 
   (  resid 123  and name  HG# )
   (( resid 124  and name  HN  ))

      2.915     1.115     1.115
 assi 
   (  resid 123  and name  HE# )
   (( resid 124  and name  HN  ))

      3.040     1.240     1.240
 assi 
   (( resid 124  and name  HN  ))
   (  resid 124  and name  HG# )

      2.650     0.850     0.850
 assi 
   (  resid 124  and name  HG# )
   (( resid 125  and name  HN  ))

      3.305     1.505     1.505
 assi 
   (  resid 124  and name  HG# )
   (( resid 145  and name  HB  ))

      3.325     1.525     1.525
 assi 
   (( resid 125  and name  HB2 ))
   (  resid 125  and name  HE2#)

      3.160     1.360     1.360
 assi 
   (  resid 125  and name  HE2#)
   (  resid 127  and name  HE# )

      2.700     0.900     0.900
 assi 
   (( resid 126  and name  HN  ))
   (  resid 150  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 126  and name  HA  ))
   (  resid 127  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 127  and name  HA  ))
   (  resid 128  and name  HB# )

      3.570     1.770     1.770
 assi 
   (  resid 127  and name  HB# )
   (( resid 128  and name  HA  ))

      3.500     1.700     1.700
 assi 
   (  resid 127  and name  HB# )
   (( resid 131  and name  HN  ))

      3.515     1.715     1.715
 assi 
   (  resid 127  and name  HB# )
   (  resid 131  and name  HG# )

      2.705     0.905     0.905
 assi 
   (  resid 127  and name  HB# )
   (( resid 132  and name  HN  ))

      2.850     1.050     1.050
 assi 
   (  resid 127  and name  HB# )
   (  resid 132  and name  HB# )

      2.865     1.065     1.065
 assi 
   (  resid 127  and name  HB# )
   (  resid 135  and name  HD# )

      3.210     1.410     1.410
 assi 
   (( resid 128  and name  HN  ))
   (  resid 131  and name  HG# )

      2.985     1.185     1.185
 assi 
   (  resid 128  and name  HB# )
   (( resid 129  and name  HB2 ))

      3.150     1.350     1.350
 assi 
   (  resid 128  and name  HB# )
   (( resid 130  and name  HN  ))

      2.985     1.185     1.185
 assi 
   (  resid 128  and name  HB# )
   (( resid 131  and name  HN  ))

      3.050     1.250     1.250
 assi 
   (  resid 128  and name  HB# )
   (( resid 131  and name  HB2 ))

      3.320     1.520     1.520
 assi 
   (  resid 128  and name  HB# )
   (( resid 131  and name  HB1 ))

      2.705     0.905     0.905
 assi 
   (  resid 128  and name  HB# )
   (  resid 131  and name  HG# )

      3.280     1.480     1.480
 assi 
   (( resid 129  and name  HN  ))
   (  resid 129  and name  HG# )

      3.260     1.460     1.460
 assi 
   (( resid 129  and name  HA  ))
   (  resid 129  and name  HG# )

      2.630     0.830     0.830
 assi 
   (  resid 129  and name  HG# )
   (  resid 132  and name  HB# )

      3.345     1.545     1.545
 assi 
   (  resid 130  and name  HB# )
   (( resid 131  and name  HN  ))

      2.890     1.090     1.090
 assi 
   (  resid 130  and name  HB# )
   (  resid 134  and name  HB# )

      3.100     1.300     1.300
 assi 
   (( resid 131  and name  HN  ))
   (  resid 131  and name  HG# )

      3.100     1.300     1.300
 assi 
   (( resid 131  and name  HN  ))
   (  resid 135  and name  HD# )

      3.620     1.820     1.820
 assi 
   (( resid 131  and name  HA  ))
   (  resid 131  and name  HG# )

      2.620     0.820     0.820
 assi 
   (( resid 131  and name  HB2 ))
   (  resid 135  and name  HD# )

      3.205     1.405     1.405
 assi 
   (( resid 131  and name  HB1 ))
   (  resid 135  and name  HD# )

      2.975     1.175     1.175
 assi 
   (  resid 131  and name  HG# )
   (( resid 132  and name  HN  ))

      3.005     1.205     1.205
 assi 
   (  resid 131  and name  HG# )
   (( resid 132  and name  HA  ))

      3.700     1.900     1.900
 assi 
   (  resid 131  and name  HG# )
   (  resid 134  and name  HB# )

      3.195     1.395     1.395
 assi 
   (  resid 131  and name  HG# )
   (  resid 135  and name  HD# )

      2.890     1.090     1.090
 assi 
   (( resid 132  and name  HN  ))
   (  resid 135  and name  HD# )

      3.015     1.215     1.215
 assi 
   (( resid 132  and name  HA  ))
   (  resid 135  and name  HD# )

      2.690     0.890     0.890
 assi 
   (( resid 133  and name  HA2 ))
   (  resid 136  and name  HB# )

      3.415     1.615     1.615
 assi 
   (( resid 133  and name  HA1 ))
   (  resid 136  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 134  and name  HN  ))
   (  resid 135  and name  HD# )

      3.360     1.560     1.560
 assi 
   (  resid 134  and name  HB# )
   (  resid 135  and name  HD# )

      2.730     0.930     0.930
 assi 
   (  resid 134  and name  HB# )
   (  resid 138  and name  HB# )

      3.490     1.690     1.690
 assi 
   (  resid 134  and name  HB# )
   (  resid 138  and name  HD# )

      3.570     1.770     1.770
 assi 
   (( resid 135  and name  HN  ))
   (  resid 135  and name  HD# )

      2.590     0.790     0.790
 assi 
   (( resid 135  and name  HA  ))
   (  resid 135  and name  HD# )

      2.410     0.610     0.610
 assi 
   (( resid 135  and name  HA  ))
   (  resid 138  and name  HB# )

      2.860     1.060     1.060
 assi 
   (( resid 135  and name  HA  ))
   (  resid 138  and name  HD# )

      2.990     1.190     1.190
 assi 
   (( resid 135  and name  HA  ))
   (  resid 140  and name  HB# )

      2.610     0.810     0.810
 assi 
   (( resid 135  and name  HB2 ))
   (  resid 136  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 135  and name  HB2 ))
   (  resid 140  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 135  and name  HB1 ))
   (  resid 140  and name  HB# )

      2.715     0.915     0.915
 assi 
   (  resid 135  and name  HD# )
   (( resid 136  and name  HN  ))

      3.305     1.505     1.505
 assi 
   (  resid 135  and name  HD# )
   (( resid 138  and name  HN  ))

      3.620     1.820     1.820
 assi 
   (  resid 135  and name  HD# )
   (  resid 138  and name  HD# )

      2.950     1.150     1.150
 assi 
   (  resid 135  and name  HD# )
   (( resid 138  and name  HE  ))

      3.205     1.405     1.405
 assi 
   (  resid 135  and name  HD# )
   (( resid 140  and name  HN  ))

      3.390     1.590     1.590
 assi 
   (  resid 135  and name  HD# )
   (( resid 140  and name  HA  ))

      3.145     1.345     1.345
 assi 
   (  resid 135  and name  HD# )
   (  resid 140  and name  HB# )

      2.425     0.625     0.625
 assi 
   (  resid 135  and name  HD# )
   (( resid 140  and name  HG2 ))

      2.345     0.545     0.545
 assi 
   (  resid 135  and name  HD# )
   (  resid 140  and name  HE2#)

      2.615     0.815     0.815
 assi 
   (( resid 136  and name  HN  ))
   (  resid 136  and name  HB# )

      2.520     0.720     0.720
 assi 
   (( resid 136  and name  HA  ))
   (  resid 136  and name  HD# )

      3.230     1.430     1.430
 assi 
   (  resid 136  and name  HB# )
   (( resid 136  and name  HE  ))

      2.810     1.010     1.010
 assi 
   (  resid 136  and name  HB# )
   (( resid 137  and name  HN  ))

      3.095     1.295     1.295
 assi 
   (  resid 136  and name  HB# )
   (( resid 137  and name  HA  ))

      3.570     1.770     1.770
 assi 
   (  resid 136  and name  HB# )
   (( resid 137  and name  HB2 ))

      3.275     1.475     1.475
 assi 
   (  resid 136  and name  HB# )
   (  resid 142  and name  HD1#)

      2.475     0.675     0.675
 assi 
   (  resid 136  and name  HD# )
   (( resid 142  and name  HG11))

      3.105     1.305     1.305
 assi 
   (  resid 136  and name  HD# )
   (  resid 142  and name  HD1#)

      2.940     1.140     1.140
 assi 
   (( resid 137  and name  HN  ))
   (  resid 138  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 137  and name  HN  ))
   (  resid 138  and name  HG# )

      3.570     1.770     1.770
 assi 
   (( resid 138  and name  HN  ))
   (  resid 138  and name  HB# )

      2.480     0.680     0.680
 assi 
   (( resid 138  and name  HN  ))
   (  resid 138  and name  HG# )

      2.725     0.925     0.925
 assi 
   (( resid 138  and name  HA  ))
   (  resid 138  and name  HG# )

      2.740     0.940     0.940
 assi 
   (( resid 138  and name  HA  ))
   (  resid 138  and name  HD# )

      3.305     1.505     1.505
 assi 
   (  resid 138  and name  HB# )
   (  resid 138  and name  HD# )

      2.375     0.575     0.575
 assi 
   (  resid 138  and name  HB# )
   (( resid 138  and name  HE  ))

      3.040     1.240     1.240
 assi 
   (  resid 138  and name  HB# )
   (( resid 139  and name  HN  ))

      2.860     1.060     1.060
 assi 
   (  resid 138  and name  HB# )
   (( resid 140  and name  HN  ))

      2.800     1.000     1.000
 assi 
   (  resid 138  and name  HG# )
   (( resid 138  and name  HE  ))

      2.735     0.935     0.935
 assi 
   (  resid 138  and name  HG# )
   (( resid 139  and name  HN  ))

      3.050     1.250     1.250
 assi 
   (( resid 138  and name  HE  ))
   (  resid 139  and name  HA# )

      3.395     1.595     1.595
 assi 
   (( resid 138  and name  HE  ))
   (  resid 140  and name  HE2#)

      3.275     1.475     1.475
 assi 
   (( resid 139  and name  HN  ))
   (  resid 140  and name  HB# )

      3.025     1.225     1.225
 assi 
   (( resid 140  and name  HN  ))
   (  resid 140  and name  HB# )

      2.440     0.640     0.640
 assi 
   (( resid 140  and name  HN  ))
   (  resid 140  and name  HE2#)

      3.410     1.610     1.610
 assi 
   (( resid 140  and name  HA  ))
   (  resid 140  and name  HE2#)

      3.255     1.455     1.455
 assi 
   (( resid 140  and name  HA  ))
   (  resid 141  and name  HB# )

      3.570     1.770     1.770
 assi 
   (  resid 140  and name  HB# )
   (  resid 140  and name  HE2#)

      3.095     1.295     1.295
 assi 
   (  resid 140  and name  HB# )
   (( resid 141  and name  HN  ))

      2.805     1.005     1.005
 assi 
   (( resid 140  and name  HG2 ))
   (  resid 140  and name  HE2#)

      2.680     0.880     0.880
 assi 
   (( resid 141  and name  HN  ))
   (  resid 141  and name  HB# )

      2.355     0.555     0.555
 assi 
   (  resid 141  and name  HB# )
   (( resid 142  and name  HN  ))

      2.815     1.015     1.015
 assi 
   (  resid 141  and name  HB# )
   (( resid 142  and name  HA  ))

      3.270     1.470     1.470
 assi 
   (( resid 143  and name  HA  ))
   (  resid 144  and name  HG# )

      2.875     1.075     1.075
 assi 
   (( resid 143  and name  HB1 ))
   (  resid 144  and name  HG# )

      3.600     1.800     1.800
 assi 
   (( resid 144  and name  HN  ))
   (  resid 144  and name  HG# )

      2.470     0.670     0.670
 assi 
   (  resid 144  and name  HG# )
   (( resid 145  and name  HN  ))

      2.570     0.770     0.770
 assi 
   (  resid 144  and name  HG# )
   (( resid 145  and name  HA  ))

      3.580     1.780     1.780
 assi 
   (  resid 144  and name  HG# )
   (( resid 145  and name  HB  ))

      3.545     1.745     1.745
 assi 
   (  resid 144  and name  HG# )
   (( resid 146  and name  HN  ))

      2.480     0.680     0.680
 assi 
   (  resid 144  and name  HG# )
   (  resid 146  and name  HB# )

      3.170     1.370     1.370
 assi 
   (  resid 146  and name  HB# )
   (( resid 147  and name  HN  ))

      2.885     1.085     1.085
 assi 
   (  resid 146  and name  HB# )
   (  resid 147  and name  HD1#)

      3.570     1.770     1.770
 assi 
   (  resid 146  and name  HB# )
   (  resid 148  and name  HB# )

      3.260     1.460     1.460
 assi 
   (  resid 146  and name  HB# )
   (  resid 148  and name  HG# )

      2.935     1.135     1.135
 assi 
   (( resid 147  and name  HN  ))
   (  resid 147  and name  HG1#)

      2.790     0.990     0.990
 assi 
   (  resid 147  and name  HG1#)
   (( resid 148  and name  HN  ))

      3.250     1.450     1.450
 assi 
   (  resid 147  and name  HG1#)
   (( resid 148  and name  HA  ))

      3.550     1.750     1.750
 assi 
   (  resid 147  and name  HD1#)
   (  resid 148  and name  HG# )

      2.840     1.040     1.040
 assi 
   (  resid 147  and name  HD1#)
   (  resid 148  and name  HD# )

      3.360     1.560     1.560
 assi 
   (( resid 148  and name  HN  ))
   (  resid 148  and name  HG# )

      2.700     0.900     0.900
 assi 
   (( resid 148  and name  HN  ))
   (  resid 148  and name  HD# )

      3.225     1.425     1.425
 assi 
   (( resid 148  and name  HA  ))
   (  resid 148  and name  HG# )

      2.650     0.850     0.850
 assi 
   (( resid 148  and name  HA  ))
   (  resid 148  and name  HD# )

      2.885     1.085     1.085
 assi 
   (  resid 148  and name  HB# )
   (  resid 148  and name  HD# )

      2.555     0.755     0.755
 assi 
   (  resid 150  and name  HB# )
   (( resid 151  and name  HN  ))

      2.535     0.735     0.735
 assi 
   (  resid 150  and name  HB# )
   (( resid 151  and name  HA  ))

      3.230     1.430     1.430
 assi 
   (  resid 150  and name  HB# )
   (( resid 152  and name  HN  ))

      2.800     1.000     1.000
 assi 
   (  resid 150  and name  HB# )
   (( resid 152  and name  HA  ))

      3.430     1.630     1.630
 assi 
   (  resid 150  and name  HB# )
   (  resid 152  and name  HB# )

      2.635     0.835     0.835
 assi 
   (( resid 151  and name  HA  ))
   (  resid 153  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 151  and name  HA  ))
   (  resid 153  and name  HG# )

      3.260     1.460     1.460
 assi 
   (( resid 152  and name  HN  ))
   (  resid 153  and name  HG# )

      3.335     1.535     1.535
 assi 
   (( resid 152  and name  HA  ))
   (  resid 153  and name  HB# )

      3.570     1.770     1.770
 assi 
   (( resid 152  and name  HA  ))
   (  resid 153  and name  HG# )

      3.570     1.770     1.770
 assi 
   (( resid 153  and name  HN  ))
   (  resid 153  and name  HB# )

      2.650     0.850     0.850
 assi 
   (( resid 153  and name  HN  ))
   (  resid 153  and name  HG# )

      2.690     0.890     0.890
 assi 
   (( resid 153  and name  HA  ))
   (  resid 153  and name  HG# )

      2.700     0.900     0.900
 assi 
   (  resid 153  and name  HB# )
   (( resid 154  and name  HN  ))

      2.825     1.025     1.025
 assi 
   (( resid 155  and name  HN  ))
   (  resid 155  and name  HB# )

      2.570     0.770     0.770
 assi 
   (( resid 155  and name  HN  ))
   (  resid 155  and name  HG# )

      3.105     1.305     1.305

! hbond table originally based on exchange into 95% D2O + confirmation by 2 NOE's + initial structures (without Hbonds)
assign (resid 18 and name HN) (resid 15 and name O) 1.95 0.25 0.25
assign (resid 19 and name HN) (resid 26 and name O) 1.95 0.25 0.25 
assign (resid 26 and name HN) (resid 19 and name O) 1.95 0.25 0.25 
assign (resid 32 and name HN) (resid 29 and name O) 1.95 0.25 0.25 
assign (resid 39 and name HN) (resid 52 and name O) 1.95 0.25 0.25 
assign (resid 41 and name HN) (resid 50 and name O) 1.95 0.25 0.25 
assign (resid 42 and name HN) (resid 68 and name O) 1.95 0.25 0.25 
assign (resid 43 and name HN) (resid 48 and name O) 1.95 0.25 0.25 
assign (resid 50 and name HN) (resid 41 and name O) 1.95 0.25 0.25 
assign (resid 52 and name HN) (resid 39 and name O) 1.95 0.25 0.25 
assign (resid 58 and name HN) (resid 54 and name O) 1.95 0.25 0.25 
assign (resid 59 and name HN) (resid 55 and name O) 1.95 0.25 0.25 
assign (resid 60 and name HN) (resid 56 and name O) 1.95 0.25 0.25 
assign (resid 62 and name HN) (resid 58 and name O) 1.95 0.25 0.25 
assign (resid 63 and name HN) (resid 59 and name O) 1.95 0.25 0.25 
assign (resid 93 and name HN) (resid 102 and name O) 1.95 0.25 0.25 
assign (resid 102 and name HN) (resid 93 and name O) 1.95 0.25 0.25 
assign (resid 116 and name HN) (resid 127 and name O) 1.95 0.25 0.25 
assign (resid 127 and name HN) (resid 116 and name O) 1.95 0.25 0.25
assign (resid 118 and name HN) (resid 125 and name O) 1.95 0.25 0.25 
assign (resid 125 and name HN) (resid 118 and name O) 1.95 0.25 0.25 
assign (resid 120 and name HN) (resid 123 and name O) 1.95 0.25 0.25 
assign (resid 143 and name HN) (resid 119 and name O) 1.95 0.25 0.25 
assign (resid 119 and name HN) (resid 143 and name O) 1.95 0.25 0.25 
assign (resid 132 and name HN) (resid 128 and name O) 1.95 0.25 0.25 
assign (resid 134 and name HN) (resid 130 and name O) 1.95 0.25 0.25 
assign (resid 135 and name HN) (resid 131 and name O) 1.95 0.25 0.25 
assign (resid 138 and name HN) (resid 134 and name O) 1.95 0.25 0.25 

!dihedral constraints generated using TALOS
! M 4   Phi Psi
assign (resid  3 and name C ) (resid  4 and name N)
       (resid  4 and name CA) (resid  4 and name C) 1.0   -68.00    30.00  2
assign (resid  4 and name N) (resid  4 and name CA)
       (resid  4 and name C) (resid  5 and name  N) 1.0   -35.00    30.00  2
! N 5   Phi Psi
assign (resid  4 and name C ) (resid  5 and name N)
       (resid  5 and name CA) (resid  5 and name C) 1.0  -144.00    66.00  2
assign (resid  5 and name N) (resid  5 and name CA)
       (resid  5 and name C) (resid  6 and name  N) 1.0   154.00    30.00  2
! L 7   Phi Psi
assign (resid  6 and name C ) (resid  7 and name N)
       (resid  7 and name CA) (resid  7 and name C) 1.0   -91.00    52.00  2
assign (resid  7 and name N) (resid  7 and name CA)
       (resid  7 and name C) (resid  8 and name  N) 1.0   129.00    48.00  2
! V 11  Phi Psi
assign (resid  10 and name C ) (resid  11 and name N)
       (resid  11 and name CA) (resid  11 and name C) 1.0  -104.00    54.00  2
assign (resid  11 and name N) (resid  11 and name CA)
       (resid  11 and name C) (resid  12 and name  N) 1.0   137.00    30.00  2
! C 14  Phi Psi
assign (resid  13 and name C ) (resid  14 and name N)
       (resid  14 and name CA) (resid  14 and name C) 1.0  -135.00    30.00  2
assign (resid  14 and name N) (resid  14 and name CA)
       (resid  14 and name C) (resid  15 and name  N) 1.0   160.00    30.00  2
! W 17  Phi Psi
assign (resid  16 and name C ) (resid  17 and name N)
       (resid  17 and name CA) (resid  17 and name C) 1.0   -89.00    30.00  2
assign (resid  17 and name N) (resid  17 and name CA)
       (resid  17 and name C) (resid  18 and name  N) 1.0     6.00    30.00  2
! K 19  Phi Psi
assign (resid  18 and name C ) (resid  19 and name N)
       (resid  19 and name CA) (resid  19 and name C) 1.0  -137.00    30.00  2
assign (resid  19 and name N) (resid  19 and name CA)
       (resid  19 and name C) (resid  20 and name  N) 1.0   146.00    30.00  2
! L 20  Phi Psi
assign (resid  19 and name C ) (resid  20 and name N)
       (resid  20 and name CA) (resid  20 and name C) 1.0   -98.00    42.00  2
assign (resid  20 and name N) (resid  20 and name CA)
       (resid  20 and name C) (resid  21 and name  N) 1.0   122.00    30.00  2
! Q 21  Phi Psi
assign (resid  20 and name C ) (resid  21 and name N)
       (resid  21 and name CA) (resid  21 and name C) 1.0  -100.00    48.00  2
assign (resid  21 and name N) (resid  21 and name CA)
       (resid  21 and name C) (resid  22 and name  N) 1.0   122.00    38.00  2
! C 25  Phi Psi
assign (resid  24 and name C ) (resid  25 and name N)
       (resid  25 and name CA) (resid  25 and name C) 1.0  -130.00    30.00  2
assign (resid  25 and name N) (resid  25 and name CA)
       (resid  25 and name C) (resid  26 and name  N) 1.0   147.00    30.00  2
! V 26  Phi Psi
assign (resid  25 and name C ) (resid  26 and name N)
       (resid  26 and name CA) (resid  26 and name C) 1.0  -132.00    30.00  2
assign (resid  26 and name N) (resid  26 and name CA)
       (resid  26 and name C) (resid  27 and name  N) 1.0   146.00    30.00  2
! C 27  Phi Psi
assign (resid  26 and name C ) (resid  27 and name N)
       (resid  27 and name CA) (resid  27 and name C) 1.0  -130.00    40.00  2
assign (resid  27 and name N) (resid  27 and name CA)
       (resid  27 and name C) (resid  28 and name  N) 1.0   157.00    30.00  2
! Y 31  Phi Psi
assign (resid  30 and name C ) (resid  31 and name N)
       (resid  31 and name CA) (resid  31 and name C) 1.0   -88.00    30.00  2
assign (resid  31 and name N) (resid  31 and name CA)
       (resid  31 and name C) (resid  32 and name  N) 1.0    -5.00    34.00  2
! S 36  Phi Psi
assign (resid  35 and name C ) (resid  36 and name N)
       (resid  36 and name CA) (resid  36 and name C) 1.0  -109.00    62.00  2
assign (resid  36 and name N) (resid  36 and name CA)
       (resid  36 and name C) (resid  37 and name  N) 1.0   137.00    46.00  2
! V 39  Phi Psi
assign (resid  38 and name C ) (resid  39 and name N)
       (resid  39 and name CA) (resid  39 and name C) 1.0  -130.00    30.00  2
assign (resid  39 and name N) (resid  39 and name CA)
       (resid  39 and name C) (resid  40 and name  N) 1.0   146.00    30.00  2
! C 40  Phi Psi
assign (resid  39 and name C ) (resid  40 and name N)
       (resid  40 and name CA) (resid  40 and name C) 1.0  -129.00    30.00  2
assign (resid  40 and name N) (resid  40 and name CA)
       (resid  40 and name C) (resid  41 and name  N) 1.0   145.00    30.00  2
! A 41  Phi Psi
assign (resid  40 and name C ) (resid  41 and name N)
       (resid  41 and name CA) (resid  41 and name C) 1.0  -136.00    30.00  2
assign (resid  41 and name N) (resid  41 and name CA)
       (resid  41 and name C) (resid  42 and name  N) 1.0   143.00    30.00  2
! Q 42  Phi Psi
assign (resid  41 and name C ) (resid  42 and name N)
       (resid  42 and name CA) (resid  42 and name C) 1.0  -124.00    38.00  2
assign (resid  42 and name N) (resid  42 and name CA)
       (resid  42 and name C) (resid  43 and name  N) 1.0   130.00    30.00  2
! D 43  Phi Psi
assign (resid  42 and name C ) (resid  43 and name N)
       (resid  43 and name CA) (resid  43 and name C) 1.0  -121.00    54.00  2
assign (resid  43 and name N) (resid  43 and name CA)
       (resid  43 and name C) (resid  44 and name  N) 1.0   121.00    30.00  2
! S 46  Phi Psi
assign (resid  45 and name C ) (resid  46 and name N)
       (resid  46 and name CA) (resid  46 and name C) 1.0   -78.00    46.00  2
assign (resid  46 and name N) (resid  46 and name CA)
       (resid  46 and name C) (resid  47 and name  N) 1.0   -13.00    44.00  2
! I 49  Phi Psi
assign (resid  48 and name C ) (resid  49 and name N)
       (resid  49 and name CA) (resid  49 and name C) 1.0  -100.00    46.00  2
assign (resid  49 and name N) (resid  49 and name CA)
       (resid  49 and name C) (resid  50 and name  N) 1.0   135.00    36.00  2
! L 50  Phi Psi
assign (resid  49 and name C ) (resid  50 and name N)
       (resid  50 and name CA) (resid  50 and name C) 1.0  -102.00    30.00  2
assign (resid  50 and name N) (resid  50 and name CA)
       (resid  50 and name C) (resid  51 and name  N) 1.0   123.00    32.00  2
! P 51  Phi Psi
assign (resid  50 and name C ) (resid  51 and name N)
       (resid  51 and name CA) (resid  51 and name C) 1.0  -110.00    50.00  2
assign (resid  51 and name N) (resid  51 and name CA)
       (resid  51 and name C) (resid  52 and name  N) 1.0   121.00    30.00  2
! L 52  Phi Psi
assign (resid  51 and name C ) (resid  52 and name N)
       (resid  52 and name CA) (resid  52 and name C) 1.0  -119.00    38.00  2
assign (resid  52 and name N) (resid  52 and name CA)
       (resid  52 and name C) (resid  53 and name  N) 1.0   160.00    30.00  2
! T 53  Phi Psi
assign (resid  52 and name C ) (resid  53 and name N)
       (resid  53 and name CA) (resid  53 and name C) 1.0  -116.00    40.00  2
assign (resid  53 and name N) (resid  53 and name CA)
       (resid  53 and name C) (resid  54 and name  N) 1.0   156.00    30.00  2
! V 54  Phi Psi
assign (resid  53 and name C ) (resid  54 and name N)
       (resid  54 and name CA) (resid  54 and name C) 1.0   -69.00    30.00  2
assign (resid  54 and name N) (resid  54 and name CA)
       (resid  54 and name C) (resid  55 and name  N) 1.0   -46.00    30.00  2
! C 55  Phi Psi
assign (resid  54 and name C ) (resid  55 and name N)
       (resid  55 and name CA) (resid  55 and name C) 1.0   -66.00    34.00  2
assign (resid  55 and name N) (resid  55 and name CA)
       (resid  55 and name C) (resid  56 and name  N) 1.0   -40.00    30.00  2
! K 56  Phi Psi
assign (resid  55 and name C ) (resid  56 and name N)
       (resid  56 and name CA) (resid  56 and name C) 1.0   -63.00    30.00  2
assign (resid  56 and name N) (resid  56 and name CA)
       (resid  56 and name C) (resid  57 and name  N) 1.0   -43.00    30.00  2
! M 57  Phi Psi
assign (resid  56 and name C ) (resid  57 and name N)
       (resid  57 and name CA) (resid  57 and name C) 1.0   -64.00    30.00  2
assign (resid  57 and name N) (resid  57 and name CA)
       (resid  57 and name C) (resid  58 and name  N) 1.0   -40.00    30.00  2
! H 58  Phi Psi
assign (resid  57 and name C ) (resid  58 and name N)
       (resid  58 and name CA) (resid  58 and name C) 1.0   -65.00    30.00  2
assign (resid  58 and name N) (resid  58 and name CA)
       (resid  58 and name C) (resid  59 and name  N) 1.0   -44.00    30.00  2
! V 59  Phi Psi
assign (resid  58 and name C ) (resid  59 and name N)
       (resid  59 and name CA) (resid  59 and name C) 1.0   -62.00    30.00  2
assign (resid  59 and name N) (resid  59 and name CA)
       (resid  59 and name C) (resid  60 and name  N) 1.0   -43.00    30.00  2
! L 60  Phi Psi
assign (resid  59 and name C ) (resid  60 and name N)
       (resid  60 and name CA) (resid  60 and name C) 1.0   -58.00    30.00  2
assign (resid  60 and name N) (resid  60 and name CA)
       (resid  60 and name C) (resid  61 and name  N) 1.0   -40.00    30.00  2
! G 64  Phi Psi
assign (resid  63 and name C ) (resid  64 and name N)
       (resid  64 and name CA) (resid  64 and name C) 1.0    94.00    34.00  2
assign (resid  64 and name N) (resid  64 and name CA)
       (resid  64 and name C) (resid  65 and name  N) 1.0     1.00    36.00  2
! Y 67  Phi Psi
assign (resid  66 and name C ) (resid  67 and name N)
       (resid  67 and name CA) (resid  67 and name C) 1.0  -111.00    36.00  2
assign (resid  67 and name N) (resid  67 and name CA)
       (resid  67 and name C) (resid  68 and name  N) 1.0   148.00    30.00  2
! T 68  Phi Psi
assign (resid  67 and name C ) (resid  68 and name N)
       (resid  68 and name CA) (resid  68 and name C) 1.0  -118.00    48.00  2
assign (resid  68 and name N) (resid  68 and name CA)
       (resid  68 and name C) (resid  69 and name  N) 1.0   146.00    36.00  2
! R 72  Phi Psi
assign (resid  71 and name C ) (resid  72 and name N)
       (resid  72 and name CA) (resid  72 and name C) 1.0   -60.00    36.00  2
assign (resid  72 and name N) (resid  72 and name CA)
       (resid  72 and name C) (resid  73 and name  N) 1.0   -35.00    30.00  2
! T 76  Phi Psi
assign (resid  75 and name C ) (resid  76 and name N)
       (resid  76 and name CA) (resid  76 and name C) 1.0   -90.00    30.00  2
assign (resid  76 and name N) (resid  76 and name CA)
       (resid  76 and name C) (resid  77 and name  N) 1.0   127.00    38.00  2
! L 77  Phi Psi
assign (resid  76 and name C ) (resid  77 and name N)
       (resid  77 and name CA) (resid  77 and name C) 1.0   -88.00    38.00  2
assign (resid  77 and name N) (resid  77 and name CA)
       (resid  77 and name C) (resid  78 and name  N) 1.0   141.00    40.00  2
! K 83  Phi Psi
assign (resid  82 and name C ) (resid  83 and name N)
       (resid  83 and name CA) (resid  83 and name C) 1.0  -117.00    68.00  2
assign (resid  83 and name N) (resid  83 and name CA)
       (resid  83 and name C) (resid  84 and name  N) 1.0   145.00    40.00  2
! A 84  Phi Psi
assign (resid  83 and name C ) (resid  84 and name N)
       (resid  84 and name CA) (resid  84 and name C) 1.0  -112.00    60.00  2
assign (resid  84 and name N) (resid  84 and name CA)
       (resid  84 and name C) (resid  85 and name  N) 1.0   152.00    48.00  2
! G 86  Phi Psi
assign (resid  85 and name C ) (resid  86 and name N)
       (resid  86 and name CA) (resid  86 and name C) 1.0   100.00    30.00  2
assign (resid  86 and name N) (resid  86 and name CA)
       (resid  86 and name C) (resid  87 and name  N) 1.0     7.00    30.00  2
! A 87  Phi Psi
assign (resid  86 and name C ) (resid  87 and name N)
       (resid  87 and name CA) (resid  87 and name C) 1.0   -97.00    62.00  2
assign (resid  87 and name N) (resid  87 and name CA)
       (resid  87 and name C) (resid  88 and name  N) 1.0   153.00    50.00  2
! L 90  Phi Psi
assign (resid  89 and name C ) (resid  90 and name N)
       (resid  90 and name CA) (resid  90 and name C) 1.0   -64.00    30.00  2
assign (resid  90 and name N) (resid  90 and name CA)
       (resid  90 and name C) (resid  91 and name  N) 1.0   -32.00    36.00  2
! W 91  Phi Psi
assign (resid  90 and name C ) (resid  91 and name N)
       (resid  91 and name CA) (resid  91 and name C) 1.0   -89.00    48.00  2
assign (resid  91 and name N) (resid  91 and name CA)
       (resid  91 and name C) (resid  92 and name  N) 1.0    -3.00    32.00  2
! K 93  Phi Psi
assign (resid  92 and name C ) (resid  93 and name N)
       (resid  93 and name CA) (resid  93 and name C) 1.0  -131.00    30.00  2
assign (resid  93 and name N) (resid  93 and name CA)
       (resid  93 and name C) (resid  94 and name  N) 1.0   151.00    30.00  2
! C 94  Phi Psi
assign (resid  93 and name C ) (resid  94 and name N)
       (resid  94 and name CA) (resid  94 and name C) 1.0  -107.00    38.00  2
assign (resid  94 and name N) (resid  94 and name CA)
       (resid  94 and name C) (resid  95 and name  N) 1.0   145.00    60.00  2
! K 100 Phi Psi
assign (resid  99 and name C ) (resid  100 and name N)
       (resid  100 and name CA) (resid  100 and name C) 1.0  -113.00    30.00  2
assign (resid  100 and name N) (resid  100 and name CA)
       (resid  100 and name C) (resid  101 and name  N) 1.0   140.00    32.00  2
! C 101 Phi Psi
assign (resid  100 and name C ) (resid  101 and name N)
       (resid  101 and name CA) (resid  101 and name C) 1.0  -132.00    30.00  2
assign (resid  101 and name N) (resid  101 and name CA)
       (resid  101 and name C) (resid  102 and name  N) 1.0   154.00    30.00  2
! V 102 Phi Psi
assign (resid  101 and name C ) (resid  102 and name N)
       (resid  102 and name CA) (resid  102 and name C) 1.0  -134.00    30.00  2
assign (resid  102 and name N) (resid  102 and name CA)
       (resid  102 and name C) (resid  103 and name  N) 1.0   146.00    30.00  2
! C 103 Phi Psi
assign (resid  102 and name C ) (resid  103 and name N)
       (resid  103 and name CA) (resid  103 and name C) 1.0  -129.00    30.00  2
assign (resid  103 and name N) (resid  103 and name CA)
       (resid  103 and name C) (resid  104 and name  N) 1.0   148.00    30.00  2
! R 104 Phi Psi
assign (resid  103 and name C ) (resid  104 and name N)
       (resid  104 and name CA) (resid  104 and name C) 1.0  -119.00    58.00  2
assign (resid  104 and name N) (resid  104 and name CA)
       (resid  104 and name C) (resid  105 and name  N) 1.0   146.00    32.00  2
! A 106 Phi Psi
assign (resid  105 and name C ) (resid  106 and name N)
       (resid  106 and name CA) (resid  106 and name C) 1.0   -59.00    30.00  2
assign (resid  106 and name N) (resid  106 and name CA)
       (resid  106 and name C) (resid  107 and name  N) 1.0   -33.00    30.00  2
! I 116 Phi Psi
assign (resid  115 and name C ) (resid  116 and name N)
       (resid  116 and name CA) (resid  116 and name C) 1.0  -126.00    34.00  2
assign (resid  116 and name N) (resid  116 and name CA)
       (resid  116 and name C) (resid  117 and name  N) 1.0   151.00    30.00  2
! C 117 Phi Psi
assign (resid  116 and name C ) (resid  117 and name N)
       (resid  117 and name CA) (resid  117 and name C) 1.0  -123.00    30.00  2
assign (resid  117 and name N) (resid  117 and name CA)
       (resid  117 and name C) (resid  118 and name  N) 1.0   130.00    30.00  2
! V 118 Phi Psi
assign (resid  117 and name C ) (resid  118 and name N)
       (resid  118 and name CA) (resid  118 and name C) 1.0  -118.00    30.00  2
assign (resid  118 and name N) (resid  118 and name CA)
       (resid  118 and name C) (resid  119 and name  N) 1.0   129.00    30.00  2
! E 119 Phi Psi
assign (resid  118 and name C ) (resid  119 and name N)
       (resid  119 and name CA) (resid  119 and name C) 1.0  -112.00    30.00  2
assign (resid  119 and name N) (resid  119 and name CA)
       (resid  119 and name C) (resid  120 and name  N) 1.0   118.00    30.00  2
! V 120 Phi Psi
assign (resid  119 and name C ) (resid  120 and name N)
       (resid  120 and name CA) (resid  120 and name C) 1.0  -109.00    44.00  2
assign (resid  120 and name N) (resid  120 and name CA)
       (resid  120 and name C) (resid  121 and name  N) 1.0   116.00    30.00  2
! K 123 Phi Psi
assign (resid  122 and name C ) (resid  123 and name N)
       (resid  123 and name CA) (resid  123 and name C) 1.0  -104.00    36.00  2
assign (resid  123 and name N) (resid  123 and name CA)
       (resid  123 and name C) (resid  124 and name  N) 1.0   150.00    30.00  2
! E 124 Phi Psi
assign (resid  123 and name C ) (resid  124 and name N)
       (resid  124 and name CA) (resid  124 and name C) 1.0  -102.00    38.00  2
assign (resid  124 and name N) (resid  124 and name CA)
       (resid  124 and name C) (resid  125 and name  N) 1.0   128.00    30.00  2
! Q 125 Phi Psi
assign (resid  124 and name C ) (resid  125 and name N)
       (resid  125 and name CA) (resid  125 and name C) 1.0  -123.00    30.00  2
assign (resid  125 and name N) (resid  125 and name CA)
       (resid  125 and name C) (resid  126 and name  N) 1.0   124.00    30.00  2
! T 126 Phi Psi
assign (resid  125 and name C ) (resid  126 and name N)
       (resid  126 and name CA) (resid  126 and name C) 1.0   -84.00    52.00  2
assign (resid  126 and name N) (resid  126 and name CA)
       (resid  126 and name C) (resid  127 and name  N) 1.0   124.00    30.00  2
! M 127 Phi Psi
assign (resid  126 and name C ) (resid  127 and name N)
       (resid  127 and name CA) (resid  127 and name C) 1.0   -98.00    32.00  2
assign (resid  127 and name N) (resid  127 and name CA)
       (resid  127 and name C) (resid  128 and name  N) 1.0   148.00    36.00  2
! S 128 Phi Psi
assign (resid  127 and name C ) (resid  128 and name N)
       (resid  128 and name CA) (resid  128 and name C) 1.0   -95.00    54.00  2
assign (resid  128 and name N) (resid  128 and name CA)
       (resid  128 and name C) (resid  129 and name  N) 1.0   153.00    36.00  2
! E 129 Phi Psi
assign (resid  128 and name C ) (resid  129 and name N)
       (resid  129 and name CA) (resid  129 and name C) 1.0   -68.00    50.00  2
assign (resid  129 and name N) (resid  129 and name CA)
       (resid  129 and name C) (resid  130 and name  N) 1.0   -37.00    30.00  2
! E 131 Phi Psi
assign (resid  130 and name C ) (resid  131 and name N)
       (resid  131 and name CA) (resid  131 and name C) 1.0   -64.00    30.00  2
assign (resid  131 and name N) (resid  131 and name CA)
       (resid  131 and name C) (resid  132 and name  N) 1.0   -42.00    30.00  2
! A 132 Phi Psi
assign (resid  131 and name C ) (resid  132 and name N)
       (resid  132 and name CA) (resid  132 and name C) 1.0   -65.00    30.00  2
assign (resid  132 and name N) (resid  132 and name CA)
       (resid  132 and name C) (resid  133 and name  N) 1.0   -39.00    30.00  2
! A 134 Phi Psi
assign (resid  133 and name C ) (resid  134 and name N)
       (resid  134 and name CA) (resid  134 and name C) 1.0   -63.00    30.00  2
assign (resid  134 and name N) (resid  134 and name CA)
       (resid  134 and name C) (resid  135 and name  N) 1.0   -42.00    30.00  2
! L 135 Phi Psi
assign (resid  134 and name C ) (resid  135 and name N)
       (resid  135 and name CA) (resid  135 and name C) 1.0   -63.00    30.00  2
assign (resid  135 and name N) (resid  135 and name CA)
       (resid  135 and name C) (resid  136 and name  N) 1.0   -39.00    30.00  2
! R 136 Phi Psi
assign (resid  135 and name C ) (resid  136 and name N)
       (resid  136 and name CA) (resid  136 and name C) 1.0   -69.00    30.00  2
assign (resid  136 and name N) (resid  136 and name CA)
       (resid  136 and name C) (resid  137 and name  N) 1.0   -34.00    34.00  2
! G 139 Phi Psi
assign (resid  138 and name C ) (resid  139 and name N)
       (resid  139 and name CA) (resid  139 and name C) 1.0   101.00    30.00  2
assign (resid  139 and name N) (resid  139 and name CA)
       (resid  139 and name C) (resid  140 and name  N) 1.0    -3.00    32.00  2
! Q 140 Phi Psi
assign (resid  139 and name C ) (resid  140 and name N)
       (resid  140 and name CA) (resid  140 and name C) 1.0   -78.00    30.00  2
assign (resid  140 and name N) (resid  140 and name CA)
       (resid  140 and name C) (resid  141 and name  N) 1.0   128.00    36.00  2
! S 141 Phi Psi
assign (resid  140 and name C ) (resid  141 and name N)
       (resid  141 and name CA) (resid  141 and name C) 1.0   -88.00    66.00  2
assign (resid  141 and name N) (resid  141 and name CA)
       (resid  141 and name C) (resid  142 and name  N) 1.0   139.00    30.00  2
! I 142 Phi Psi
assign (resid  141 and name C ) (resid  142 and name N)
       (resid  142 and name CA) (resid  142 and name C) 1.0  -119.00    32.00  2
assign (resid  142 and name N) (resid  142 and name CA)
       (resid  142 and name C) (resid  143 and name  N) 1.0   158.00    30.00  2
! S 143 Phi Psi
assign (resid  142 and name C ) (resid  143 and name N)
       (resid  143 and name CA) (resid  143 and name C) 1.0   -92.00    42.00  2
assign (resid  143 and name N) (resid  143 and name CA)
       (resid  143 and name C) (resid  144 and name  N) 1.0   127.00    34.00  2
! V 144 Phi Psi
assign (resid  143 and name C ) (resid  144 and name N)
       (resid  144 and name CA) (resid  144 and name C) 1.0   -90.00    34.00  2
assign (resid  144 and name N) (resid  144 and name CA)
       (resid  144 and name C) (resid  145 and name  N) 1.0   131.00    48.00  2
! P 149 Phi Psi
assign (resid  148 and name C ) (resid  149 and name N)
       (resid  149 and name CA) (resid  149 and name C) 1.0   -59.00    30.00  2
assign (resid  149 and name N) (resid  149 and name CA)
       (resid  149 and name C) (resid  150 and name  N) 1.0   145.00    30.00  2
! C 150 Phi Psi
assign (resid  149 and name C ) (resid  150 and name N)
       (resid  150 and name CA) (resid  150 and name C) 1.0  -125.00    30.00  2
assign (resid  150 and name N) (resid  150 and name CA)
       (resid  150 and name C) (resid  151 and name  N) 1.0   157.00    30.00  2

!explicit set of disulfide restraints incorporated in final round of structure calculations for ensemble structures 1-25
assign (residue 14 and name sg) (not residue 14 and name sg) 2.02 0.1 0.1
assign (residue 25 and name sg) (not residue 25 and name sg) 2.02 0.1 0.1
assign (residue 27 and name sg) (not residue 27 and name sg) 2.02 0.1 0.1
assign (residue 33 and name sg) (not residue 33 and name sg) 2.02 0.1 0.1
assign (residue 40 and name sg) (not residue 40 and name sg) 2.02 0.1 0.1
assign (residue 55 and name sg) (not residue 55 and name sg) 2.02 0.1 0.1
assign (residue 62 and name sg) (not residue 62 and name sg) 2.02 0.1 0.1
assign (residue 75 and name sg) (not residue 75 and name sg) 2.02 0.1 0.1
assign (residue 85 and name sg) (not residue 85 and name sg) 2.02 0.1 0.1
assign (residue 88 and name sg) (not residue 88 and name sg) 2.02 0.1 0.1
assign (residue 94 and name sg) (not residue 94 and name sg) 2.02 0.1 0.1
assign (residue 101 and name sg) (not residue 101 and name sg) 2.02 0.1 0.1
assign (residue 103 and name sg) (not residue 103 and name sg) 2.02 0.1 0.1
assign (residue 109 and name sg) (not residue 109 and name sg) 2.02 0.1 0.1
assign (residue 117 and name sg) (not residue 117 and name sg) 2.02 0.1 0.1
assign (residue 130 and name sg) (not residue 130 and name sg) 2.02 0.1 0.1
assign (residue 137 and name sg) (not residue 137 and name sg) 2.02 0.1 0.1
assign (residue 150 and name sg) (not residue 150 and name sg) 2.02 0.1 0.1

!ambiguous set of disulfide restraints incorporated in final round of structure calculations for ensemble structures 26-48
assign (residue 14 and name sg) (residue 25 and name sg) 2.02 0.1 0.1
assign (residue 27 and name sg) (residue 62 and name sg) 2.02 0.1 0.1
assign (residue 33 and name sg) (residue 55 and name sg) 2.02 0.1 0.1
assign (residue 40 and name sg) (residue 75 and name sg) 2.02 0.1 0.1
assign (residue 103 and name sg) (residue 137 and name sg) 2.02 0.1 0.1
assign (residue 109 and name sg) (residue 130 and name sg) 2.02 0.1 0.1
assign (residue 150 and name sg) (residue 117 and name sg) 2.02 0.1 0.1
assign (residue 85 and name sg) (residue 88 and name sg) 
2.02 0.1 0.1
OR 
(residue 85 and name sg) (residue 94 and name sg)  
OR 
(residue 85 and name sg) (residue 101 and name sg) 
assign (residue 88 and name sg) (residue 85 and name sg) 
2.02 0.1 0.1
OR 
(residue 88 and name sg) (residue 94 and name sg) 
OR
(residue 88 and name sg) (residue 101 and name sg) 
assign (residue 94 and name sg) (residue 85 and name sg) 
2.02 0.1 0.1
OR 
(residue 94 and name sg) (residue 88 and name sg) 
OR 
(residue 94 and name sg) (residue 101 and name sg)
assign (residue 101 and name sg) (residue 85 and name sg) 
2.02 0.1 0.1
OR 
(residue 88 and name sg) (residue 85 and name sg)
OR 
(residue 94 and name sg) (residue 85 and name sg)
  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H1   GLY 689           H3       GLY 689  80.620   1.972 -23.411
    2    H2   GLY 689           H2       GLY 689  81.980   2.954 -23.613
    3    H3   GLY 689           H1       GLY 689  81.839   1.946 -22.255
    4    HA2  GLY 689           HA2      GLY 689  80.078   4.212 -22.908
    5    HA3  GLY 689           HA3      GLY 689  81.311   4.211 -21.645

  No H/Q in entry =           5
  In of MODEL    1
    1    H    SER 690           H        SER 690  78.979   4.816 -20.741
    2    HA   SER 690           HA       SER 690  78.268   2.576 -19.078
    3    HB2  SER 690           HB2      SER 690  77.144   5.379 -19.230
    4    HB3  SER 690           HB3      SER 690  76.885   4.221 -17.923
    5    HG   SER 690           HG       SER 690  79.538   4.720 -18.523

  No H/Q in entry =           5
  In of MODEL    1
    1    H    HIS 691           H        HIS 691  75.959   1.940 -18.830
    2    HA   HIS 691           HA       HIS 691  74.645   1.601 -21.358
    3    HB2  HIS 691           HB2      HIS 691  73.777   0.935 -18.533
    4    HB3  HIS 691           HB3      HIS 691  72.800   0.591 -19.950
    5    HD1  HIS 691           HD1      HIS 691  75.395  -0.826 -17.839
    6    HD2  HIS 691           HD2      HIS 691  74.098  -1.307 -21.746
    7    HE1  HIS 691           HE1      HIS 691  76.313  -3.033 -18.581
    8    HE2  HIS 691           HE2      HIS 691  75.795  -3.087 -21.044

  No H/Q in entry =           8
  In of MODEL    1
    1    H    MET 692           H        MET 692  72.939   2.712 -22.144
    2    HA   MET 692           HA       MET 692  72.459   5.333 -21.050
    3    HB2  MET 692           HB2      MET 692  70.963   3.963 -23.301
    4    HB3  MET 692           HB3      MET 692  70.988   5.676 -22.955
    5    HG2  MET 692           HG2      MET 692  72.350   5.371 -24.845
    6    HG3  MET 692           HG3      MET 692  73.460   5.613 -23.498
    7    HE1  MET 692           HE1      MET 692  75.382   4.690 -25.105
    8    HE3  MET 692           HE2      MET 692  74.225   4.347 -26.394
    9    HE2  MET 692           HE3      MET 692  75.352   3.099 -25.867

  No H/Q in entry =           9
  In of MODEL    1
    1    H    ASN 693           H        ASN 693  70.970   2.254 -21.082
    2    HA   ASN 693           HA       ASN 693  68.702   3.283 -19.546
    3    HB2  ASN 693           HB2      ASN 693  68.766   1.020 -21.569
    4    HB3  ASN 693           HB3      ASN 693  67.412   1.353 -20.499
    5   HD21  ASN 693          HD21      ASN 693  66.080   3.051 -20.933
    6   HD22  ASN 693          HD22      ASN 693  66.141   3.980 -22.380

  No H/Q in entry =           6
  In of MODEL    1
    1    HA   PRO 694           HA       PRO 694  70.223   0.463 -16.410
    2    HB2  PRO 694           HB2      PRO 694  67.334   0.144 -15.774
    3    HB3  PRO 694           HB3      PRO 694  68.667   0.591 -14.702
    4    HG2  PRO 694           HG2      PRO 694  66.912   2.416 -15.502
    5    HG3  PRO 694           HG3      PRO 694  68.634   2.811 -15.385
    6    HD2  PRO 694           HD2      PRO 694  66.989   2.213 -17.805
    7    HD3  PRO 694           HD3      PRO 694  68.280   3.415 -17.573

  No H/Q in entry =           7
  In of MODEL    1
    1    H    LEU 695           H        LEU 695  69.919  -1.841 -15.801
    2    HA   LEU 695           HA       LEU 695  69.654  -3.274 -18.250
    3    HB2  LEU 695           HB2      LEU 695  70.446  -4.278 -15.537
    4    HB3  LEU 695           HB3      LEU 695  70.463  -5.243 -17.001
    5    HG   LEU 695           HG       LEU 695  72.182  -2.837 -16.406
    6   HD12  LEU 695          HD11      LEU 695  72.835  -5.735 -16.792
    7   HD11  LEU 695          HD12      LEU 695  72.832  -4.866 -15.259
    8   HD13  LEU 695          HD13      LEU 695  74.004  -4.445 -16.512
    9   HD22  LEU 695          HD21      LEU 695  71.585  -2.852 -18.783
   10   HD21  LEU 695          HD22      LEU 695  72.075  -4.540 -18.902
   11   HD23  LEU 695          HD23      LEU 695  73.274  -3.300 -18.556

  No H/Q in entry =          11
  In of MODEL    1
    1    H    THR 696           H        THR 696  67.664  -3.053 -18.668
    2    HA   THR 696           HA       THR 696  66.015  -5.301 -18.364
    3    HB   THR 696           HB       THR 696  64.758  -2.711 -17.300
    4    HG1  THR 696           HG1      THR 696  66.248  -4.396 -15.946
    5   HG21  THR 696          HG21      THR 696  63.204  -4.207 -18.458
    6   HG23  THR 696          HG22      THR 696  62.844  -4.130 -16.735
    7   HG22  THR 696          HG23      THR 696  63.680  -5.535 -17.397

  No H/Q in entry =           7
  In of MODEL    1
    1    H    GLN 697           H        GLN 697  66.613  -1.939 -19.204
    2    HA   GLN 697           HA       GLN 697  66.516  -0.769 -21.005
    3    HB2  GLN 697           HB2      GLN 697  65.912  -3.326 -22.355
    4    HB3  GLN 697           HB3      GLN 697  66.092  -1.794 -23.216
    5    HG2  GLN 697           HG2      GLN 697  68.283  -1.502 -22.086
    6    HG3  GLN 697           HG3      GLN 697  68.117  -3.150 -21.474
    7   HE21  GLN 697          HE21      GLN 697  68.034  -4.809 -22.916
    8   HE22  GLN 697          HE22      GLN 697  68.684  -4.539 -24.495

  No H/Q in entry =           8
  In of MODEL    1
    1    H    ALA 698           H        ALA 698  64.050  -1.708 -19.461
    2    HA   ALA 698           HA       ALA 698  62.193   0.107 -20.586
    3    HB3  ALA 698           HB1      ALA 698  60.372  -1.574 -20.837
    4    HB1  ALA 698           HB2      ALA 698  61.545  -2.864 -20.568
    5    HB2  ALA 698           HB3      ALA 698  61.668  -1.846 -22.003

  No H/Q in entry =           5
  In of MODEL    1
    1    H    VAL 699           H        VAL 699  60.045  -0.482 -19.062
    2    HA   VAL 699           HA       VAL 699  61.116  -0.232 -16.406
    3    HB   VAL 699           HB       VAL 699  58.214  -0.352 -17.314
    4   HG12  VAL 699          HG11      VAL 699  57.706   0.708 -15.166
    5   HG11  VAL 699          HG12      VAL 699  59.405   0.599 -14.709
    6   HG13  VAL 699          HG13      VAL 699  58.461  -0.871 -14.946
    7   HG23  VAL 699          HG21      VAL 699  58.248   2.086 -17.111
    8   HG22  VAL 699          HG22      VAL 699  59.386   1.523 -18.335
    9   HG21  VAL 699          HG23      VAL 699  59.974   2.034 -16.751

  No H/Q in entry =           9
  In of MODEL    1
    1    HA   PRO 700           HA       PRO 700  61.019  -4.673 -15.735
    2    HB2  PRO 700           HB2      PRO 700  60.983  -3.998 -12.883
    3    HB3  PRO 700           HB3      PRO 700  62.161  -4.941 -13.793
    4    HG2  PRO 700           HG2      PRO 700  62.685  -2.449 -12.877
    5    HG3  PRO 700           HG3      PRO 700  63.415  -3.105 -14.355
    6    HD2  PRO 700           HD2      PRO 700  61.240  -1.106 -14.030
    7    HD3  PRO 700           HD3      PRO 700  62.457  -1.274 -15.310

  No H/Q in entry =           7
  In of MODEL    1
    1    H    LYS 701           H        LYS 701  59.364  -5.936 -15.696
    2    HA   LYS 701           HA       LYS 701  56.848  -5.018 -14.584
    3    HB2  LYS 701           HB2      LYS 701  57.547  -7.299 -16.415
    4    HB3  LYS 701           HB3      LYS 701  55.930  -7.022 -15.785
    5    HG2  LYS 701           HG2      LYS 701  55.846  -4.859 -16.890
    6    HG3  LYS 701           HG3      LYS 701  57.494  -5.087 -17.475
    7    HD2  LYS 701           HD2      LYS 701  56.850  -6.949 -18.770
    8    HD3  LYS 701           HD3      LYS 701  55.222  -6.950 -18.083
    9    HE2  LYS 701           HE2      LYS 701  56.398  -4.729 -19.771
   10    HE3  LYS 701           HE3      LYS 701  55.288  -5.958 -20.367
   11    HZ1  LYS 701           HZ1      LYS 701  53.670  -5.135 -18.670
   12    HZ3  LYS 701           HZ2      LYS 701  54.025  -4.052 -19.884
   13    HZ2  LYS 701           HZ3      LYS 701  54.709  -3.831 -18.363

  No H/Q in entry =          13
  In of MODEL    1
    1    H    CYS 702           H        CYS 702  56.212  -5.713 -12.670
    2    HA   CYS 702           HA       CYS 702  57.540  -8.060 -11.537
    3    HB2  CYS 702           HB2      CYS 702  56.027  -5.834 -10.149
    4    HB3  CYS 702           HB3      CYS 702  56.940  -7.121  -9.366

  No H/Q in entry =           4
  In of MODEL    1
    1    H    GLN 703           H        GLN 703  56.090  -9.472 -10.154
    2    HA   GLN 703           HA       GLN 703  53.767 -10.049 -11.697
    3    HB2  GLN 703           HB2      GLN 703  54.892 -11.330  -9.213
    4    HB3  GLN 703           HB3      GLN 703  53.483 -11.930 -10.080
    5    HG2  GLN 703           HG2      GLN 703  56.249 -11.642 -11.215
    6    HG3  GLN 703           HG3      GLN 703  55.521 -13.151 -10.666
    7   HE21  GLN 703          HE21      GLN 703  56.485 -12.339 -13.310
    8   HE22  GLN 703          HE22      GLN 703  55.160 -12.564 -14.394

  No H/Q in entry =           8
  In of MODEL    1
    1    H    ARG 704           H        ARG 704  51.805 -10.740 -10.373
    2    HA   ARG 704           HA       ARG 704  50.465  -8.420  -9.662
    3    HB2  ARG 704           HB2      ARG 704  49.750 -11.269  -9.078
    4    HB3  ARG 704           HB3      ARG 704  48.665  -9.915  -8.840
    5    HG2  ARG 704           HG2      ARG 704  49.885 -10.712 -11.471
    6    HG3  ARG 704           HG3      ARG 704  48.281 -11.158 -10.924
    7    HD2  ARG 704           HD2      ARG 704  48.030  -9.289 -12.399
    8    HD3  ARG 704           HD3      ARG 704  47.725  -8.737 -10.749
    9    HE   ARG 704           HE       ARG 704  50.236  -8.258 -12.233
   10   HH11  ARG 704          HH11      ARG 704  47.801  -7.173  -9.894
   11   HH12  ARG 704          HH12      ARG 704  48.462  -5.624  -9.677
   12   HH21  ARG 704          HH21      ARG 704  51.116  -6.109 -11.994
   13   HH22  ARG 704          HH22      ARG 704  50.376  -4.975 -10.965

  No H/Q in entry =          13
  In of MODEL    1
    1    H    TRP 705           H        TRP 705  52.205 -10.594  -7.613
    2    HA   TRP 705           HA       TRP 705  51.155  -9.388  -5.148
    3    HB2  TRP 705           HB2      TRP 705  52.390 -11.301  -4.065
    4    HB3  TRP 705           HB3      TRP 705  51.065 -11.767  -5.123
    5    HD1  TRP 705           HD1      TRP 705  54.837 -12.164  -4.681
    6    HE1  TRP 705           HE1      TRP 705  55.730 -13.766  -6.468
    7    HE3  TRP 705           HE3      TRP 705  50.645 -12.611  -7.600
    8    HZ2  TRP 705           HZ2      TRP 705  54.806 -15.083  -8.768
    9    HZ3  TRP 705           HZ3      TRP 705  50.743 -14.076  -9.571
   10    HH2  TRP 705           HH2      TRP 705  52.781 -15.286 -10.138

  No H/Q in entry =          10
  In of MODEL    1
    1    H    GLU 706           H        GLU 706  53.317  -8.485  -7.260
    2    HA   GLU 706           HA       GLU 706  55.383  -7.875  -5.293
    3    HB2  GLU 706           HB2      GLU 706  55.700  -8.510  -8.215
    4    HB3  GLU 706           HB3      GLU 706  56.989  -7.939  -7.151
    5    HG2  GLU 706           HG2      GLU 706  56.765  -9.985  -5.853
    6    HG3  GLU 706           HG3      GLU 706  55.476 -10.525  -6.933

  No H/Q in entry =           6
  In of MODEL    1
    1    H    LYS 707           H        LYS 707  56.546  -5.969  -5.741
    2    HA   LYS 707           HA       LYS 707  55.343  -4.035  -7.552
    3    HB2  LYS 707           HB2      LYS 707  55.857  -3.499  -4.608
    4    HB3  LYS 707           HB3      LYS 707  55.475  -2.259  -5.795
    5    HG2  LYS 707           HG2      LYS 707  53.326  -3.332  -6.213
    6    HG3  LYS 707           HG3      LYS 707  53.692  -4.554  -5.008
    7    HD2  LYS 707           HD2      LYS 707  52.224  -2.897  -4.029
    8    HD3  LYS 707           HD3      LYS 707  53.812  -2.759  -3.290
    9    HE2  LYS 707           HE2      LYS 707  52.872  -0.560  -3.771
   10    HE3  LYS 707           HE3      LYS 707  54.318  -0.838  -4.732
   11    HZ1  LYS 707           HZ1      LYS 707  51.507  -1.088  -5.723
   12    HZ3  LYS 707           HZ2      LYS 707  52.892  -1.346  -6.639
   13    HZ2  LYS 707           HZ3      LYS 707  52.575   0.172  -6.013

  No H/Q in entry =          13
  In of MODEL    1
    1    H    LEU 708           H        LEU 708  56.785  -2.556  -8.329
    2    HA   LEU 708           HA       LEU 708  59.550  -3.339  -8.169
    3    HB2  LEU 708           HB2      LEU 708  58.628  -2.833 -10.333
    4    HB3  LEU 708           HB3      LEU 708  58.103  -1.252  -9.796
    5    HG   LEU 708           HG       LEU 708  60.514  -0.634  -9.535
    6   HD12  LEU 708          HD11      LEU 708  62.186  -1.996 -10.676
    7   HD11  LEU 708          HD12      LEU 708  60.976  -3.260 -10.915
    8   HD13  LEU 708          HD13      LEU 708  61.479  -2.817  -9.286
    9   HD23  LEU 708          HD21      LEU 708  59.628  -1.496 -12.283
   10   HD22  LEU 708          HD22      LEU 708  60.906  -0.329 -11.925
   11   HD21  LEU 708          HD23      LEU 708  59.236   0.030 -11.491

  No H/Q in entry =          11
  In of MODEL    1
    1    H    GLN 709           H        GLN 709  60.813  -2.578  -6.607
    2    HA   GLN 709           HA       GLN 709  60.994   0.292  -6.205
    3    HB2  GLN 709           HB2      GLN 709  60.803   0.287  -3.827
    4    HB3  GLN 709           HB3      GLN 709  59.461  -0.732  -4.327
    5    HG2  GLN 709           HG2      GLN 709  60.719  -2.696  -3.728
    6    HG3  GLN 709           HG3      GLN 709  62.144  -1.720  -3.418
    7   HE21  GLN 709          HE21      GLN 709  60.837  -3.443  -1.644
    8   HE22  GLN 709          HE22      GLN 709  60.308  -2.547  -0.269

  No H/Q in entry =           8
  In of MODEL    1
    1    H    ASN 710           H        ASN 710  63.052   0.876  -5.685
    2    HA   ASN 710           HA       ASN 710  65.341   0.721  -5.407
    3    HB2  ASN 710           HB2      ASN 710  64.554  -0.639  -3.342
    4    HB3  ASN 710           HB3      ASN 710  64.793  -2.060  -4.326
    5   HD21  ASN 710          HD21      ASN 710  66.221  -2.791  -2.785
    6   HD22  ASN 710          HD22      ASN 710  67.819  -2.160  -2.703

  No H/Q in entry =           6
  In of MODEL    1
    1    H    SER 711           H        SER 711  63.971  -0.224  -7.831
    2    HA   SER 711           HA       SER 711  64.440  -1.018  -9.862
    3    HB2  SER 711           HB2      SER 711  67.193  -1.427  -8.719
    4    HB3  SER 711           HB3      SER 711  66.793  -1.607 -10.439
    5    HG   SER 711           HG       SER 711  65.817   0.678  -9.755

  No H/Q in entry =           5
  In of MODEL    1
    1    H    ARG 712           H        ARG 712  63.703  -2.877  -7.489
    2    HA   ARG 712           HA       ARG 712  64.055  -5.307  -9.054
    3    HB2  ARG 712           HB2      ARG 712  64.442  -6.616  -7.025
    4    HB3  ARG 712           HB3      ARG 712  65.720  -5.433  -7.268
    5    HG2  ARG 712           HG2      ARG 712  64.787  -4.018  -5.559
    6    HG3  ARG 712           HG3      ARG 712  63.389  -5.074  -5.395
    7    HD2  ARG 712           HD2      ARG 712  64.936  -5.520  -3.594
    8    HD3  ARG 712           HD3      ARG 712  64.911  -6.899  -4.682
    9    HE   ARG 712           HE       ARG 712  66.992  -5.460  -5.606
   10   HH11  ARG 712          HH11      ARG 712  66.155  -6.640  -2.376
   11   HH12  ARG 712          HH12      ARG 712  67.765  -6.762  -1.848
   12   HH21  ARG 712          HH21      ARG 712  69.224  -5.644  -4.875
   13   HH22  ARG 712          HH22      ARG 712  69.543  -6.136  -3.284

  No H/Q in entry =          13
  In of MODEL    1
    1    H    CYS 713           H        CYS 713  62.504  -7.004  -8.326
    2    HA   CYS 713           HA       CYS 713  59.987  -5.719  -7.653
    3    HB2  CYS 713           HB2      CYS 713  60.583  -8.442  -8.841
    4    HB3  CYS 713           HB3      CYS 713  58.966  -7.840  -8.492

  No H/Q in entry =           4
  In of MODEL    1
    1    H    VAL 714           H        VAL 714  59.388  -5.810  -5.681
    2    HA   VAL 714           HA       VAL 714  60.309  -7.988  -3.931
    3    HB   VAL 714           HB       VAL 714  59.952  -6.442  -2.055
    4   HG11  VAL 714          HG11      VAL 714  62.143  -6.436  -3.118
    5   HG13  VAL 714          HG12      VAL 714  61.740  -4.843  -2.474
    6   HG12  VAL 714          HG13      VAL 714  61.608  -5.154  -4.210
    7   HG21  VAL 714          HG21      VAL 714  58.089  -5.170  -3.020
    8   HG23  VAL 714          HG22      VAL 714  59.206  -4.386  -4.141
    9   HG22  VAL 714          HG23      VAL 714  59.342  -4.094  -2.408

  No H/Q in entry =           9
  In of MODEL    1
    1    H    CYS 715           H        CYS 715  58.537  -8.214  -2.092
    2    HA   CYS 715           HA       CYS 715  56.069  -8.606  -3.570
    3    HB2  CYS 715           HB2      CYS 715  56.877  -9.461  -0.790
    4    HB3  CYS 715           HB3      CYS 715  55.331  -9.837  -1.548

  No H/Q in entry =           4
  In of MODEL    1
    1    H    LYS 716           H        LYS 716  54.092  -7.769  -2.863
    2    HA   LYS 716           HA       LYS 716  54.327  -5.228  -1.511
    3    HB2  LYS 716           HB2      LYS 716  51.922  -4.960  -1.999
    4    HB3  LYS 716           HB3      LYS 716  52.780  -5.453  -3.444
    5    HG2  LYS 716           HG2      LYS 716  52.009  -7.780  -3.024
    6    HG3  LYS 716           HG3      LYS 716  51.043  -7.165  -1.687
    7    HD2  LYS 716           HD2      LYS 716  50.777  -6.373  -4.592
    8    HD3  LYS 716           HD3      LYS 716  49.697  -7.454  -3.719
    9    HE2  LYS 716           HE2      LYS 716  49.119  -5.568  -2.198
   10    HE3  LYS 716           HE3      LYS 716  50.132  -4.510  -3.175
   11    HZ1  LYS 716           HZ1      LYS 716  48.650  -4.943  -5.087
   12    HZ3  LYS 716           HZ2      LYS 716  47.789  -4.325  -3.782
   13    HZ2  LYS 716           HZ3      LYS 716  47.717  -5.962  -4.125

  No H/Q in entry =          13
  In of MODEL    1
    1    H    MET 717           H        MET 717  52.083  -5.097   0.080
    2    HA   MET 717           HA       MET 717  52.796  -7.112   2.069
    3    HB2  MET 717           HB2      MET 717  51.326  -4.501   2.454
    4    HB3  MET 717           HB3      MET 717  51.823  -5.590   3.740
    5    HG2  MET 717           HG2      MET 717  53.614  -3.994   1.911
    6    HG3  MET 717           HG3      MET 717  53.356  -3.738   3.631
    7    HE2  MET 717           HE1      MET 717  53.457  -6.769   4.762
    8    HE1  MET 717           HE2      MET 717  54.230  -5.376   5.503
    9    HE3  MET 717           HE3      MET 717  55.165  -6.843   5.207

  No H/Q in entry =           9
  In of MODEL    1
    1    HA   PRO 718           HA       PRO 718  49.042  -9.267   1.357
    2    HB2  PRO 718           HB2      PRO 718  48.509 -10.318   3.821
    3    HB3  PRO 718           HB3      PRO 718  49.769 -10.942   2.749
    4    HG2  PRO 718           HG2      PRO 718  50.009  -9.090   5.086
    5    HG3  PRO 718           HG3      PRO 718  51.042 -10.454   4.623
    6    HD2  PRO 718           HD2      PRO 718  51.731  -7.895   4.132
    7    HD3  PRO 718           HD3      PRO 718  52.176  -9.216   3.032

  No H/Q in entry =           7
  In of MODEL    1
    1    H    TYR 719           H        TYR 719  49.146  -6.886   3.786
    2    HA   TYR 719           HA       TYR 719  46.269  -6.834   4.152
    3    HB2  TYR 719           HB2      TYR 719  46.790  -4.956   5.777
    4    HB3  TYR 719           HB3      TYR 719  47.434  -6.533   6.193
    5    HD1  TYR 719           HD1      TYR 719  48.274  -3.164   4.998
    6    HD2  TYR 719           HD2      TYR 719  49.815  -6.904   6.302
    7    HE1  TYR 719           HE1      TYR 719  50.488  -2.146   5.272
    8    HE2  TYR 719           HE2      TYR 719  52.029  -5.901   6.593
    9    HH   TYR 719           HH       TYR 719  52.509  -2.498   6.424

  No H/Q in entry =           9
  In of MODEL    1
    1    H    GLU 720           H        GLU 720  48.237  -5.808   1.899
    2    HA   GLU 720           HA       GLU 720  46.948  -3.252   1.370
    3    HB2  GLU 720           HB2      GLU 720  49.250  -4.752   0.184
    4    HB3  GLU 720           HB3      GLU 720  48.611  -3.284  -0.564
    5    HG2  GLU 720           HG2      GLU 720  49.603  -3.446   2.258
    6    HG3  GLU 720           HG3      GLU 720  50.633  -2.997   0.893

  No H/Q in entry =           6
  In of MODEL    1
    1    H    CYS 721           H        CYS 721  46.104  -6.268   1.123
    2    HA   CYS 721           HA       CYS 721  44.869  -5.915  -1.466
    3    HB2  CYS 721           HB2      CYS 721  46.226  -8.314  -0.367
    4    HB3  CYS 721           HB3      CYS 721  44.902  -8.532  -1.499

  No H/Q in entry =           4
  In of MODEL    1
    1    H    GLY 722           H        GLY 722  42.969  -7.092  -1.786
    2    HA3  GLY 722           HA2      GLY 722  41.413  -8.109   0.350
    3    HA2  GLY 722           HA3      GLY 722  40.919  -6.487  -0.155

  No H/Q in entry =           3
  In of MODEL    1
    1    HA   PRO 723           HA       PRO 723  39.011  -7.900  -3.911
    2    HB2  PRO 723           HB2      PRO 723  40.469  -6.564  -5.862
    3    HB3  PRO 723           HB3      PRO 723  39.088  -5.887  -4.994
    4    HG2  PRO 723           HG2      PRO 723  42.008  -5.540  -4.475
    5    HG3  PRO 723           HG3      PRO 723  40.707  -4.338  -4.386
    6    HD2  PRO 723           HD2      PRO 723  41.702  -5.412  -2.172
    7    HD3  PRO 723           HD3      PRO 723  39.958  -5.127  -2.331

  No H/Q in entry =           7
  In of MODEL    1
    1    H    SER 724           H        SER 724  39.582 -10.059  -3.970
    2    HA   SER 724           HA       SER 724  41.170 -11.032  -6.016
    3    HB2  SER 724           HB2      SER 724  42.703 -12.330  -4.309
    4    HB3  SER 724           HB3      SER 724  43.167 -10.699  -4.793
    5    HG   SER 724           HG       SER 724  41.613 -10.334  -2.816

  No H/Q in entry =           5
  In of MODEL    1
    1    H    LEU 725           H        LEU 725  41.126 -13.410  -5.934
    2    HA   LEU 725           HA       LEU 725  38.455 -14.218  -5.206
    3    HB2  LEU 725           HB2      LEU 725  40.707 -15.490  -6.630
    4    HB3  LEU 725           HB3      LEU 725  39.359 -16.503  -6.119
    5    HG   LEU 725           HG       LEU 725  39.142 -14.097  -7.945
    6   HD13  LEU 725          HD11      LEU 725  38.872 -15.738  -9.732
    7   HD12  LEU 725          HD12      LEU 725  39.166 -17.048  -8.588
    8   HD11  LEU 725          HD13      LEU 725  40.454 -15.909  -8.975
    9   HD23  LEU 725          HD21      LEU 725  36.956 -15.007  -8.448
   10   HD22  LEU 725          HD22      LEU 725  37.092 -14.604  -6.740
   11   HD21  LEU 725          HD23      LEU 725  37.191 -16.292  -7.262

  No H/Q in entry =          11
  In of MODEL    1
    1    H    ASP 726           H        ASP 726  37.786 -15.227  -3.538
    2    HA   ASP 726           HA       ASP 726  39.580 -16.044  -1.417
    3    HB2  ASP 726           HB2      ASP 726  36.575 -16.153  -1.631
    4    HB3  ASP 726           HB3      ASP 726  37.476 -16.692  -0.225

  No H/Q in entry =           4
  In of MODEL    1
    1    H    VAL 727           H        VAL 727  40.304 -17.870  -0.939
    2    HA   VAL 727           HA       VAL 727  39.249 -20.284  -2.224
    3    HB   VAL 727           HB       VAL 727  41.611 -21.030  -2.675
    4   HG13  VAL 727          HG11      VAL 727  40.223 -20.200  -4.504
    5   HG12  VAL 727          HG12      VAL 727  41.900 -19.710  -4.739
    6   HG11  VAL 727          HG13      VAL 727  40.718 -18.546  -4.144
    7   HG22  VAL 727          HG21      VAL 727  43.387 -19.334  -2.803
    8   HG21  VAL 727          HG22      VAL 727  42.775 -19.499  -1.159
    9   HG23  VAL 727          HG23      VAL 727  42.277 -18.129  -2.151

  No H/Q in entry =           9
  In of MODEL    1
    1    H    CYS 728           H        CYS 728  40.298 -22.293  -1.236
    2    HA   CYS 728           HA       CYS 728  40.539 -21.900   1.658
    3    HB2  CYS 728           HB2      CYS 728  39.817 -24.305   0.025
    4    HB3  CYS 728           HB3      CYS 728  39.973 -24.327   1.786

  No H/Q in entry =           4
  In of MODEL    1
    1    H    ALA 729           H        ALA 729  42.481 -22.171   2.552
    2    HA   ALA 729           HA       ALA 729  44.389 -23.881   1.152
    3    HB3  ALA 729           HB1      ALA 729  44.959 -21.535   0.754
    4    HB2  ALA 729           HB2      ALA 729  46.168 -22.332   1.758
    5    HB1  ALA 729           HB3      ALA 729  44.972 -21.261   2.497

  No H/Q in entry =           5
  In of MODEL    1
    1    H    GLN 730           H        GLN 730  45.929 -24.794   2.492
    2    HA   GLN 730           HA       GLN 730  44.982 -25.209   5.237
    3    HB2  GLN 730           HB2      GLN 730  45.097 -27.234   3.776
    4    HB3  GLN 730           HB3      GLN 730  46.802 -26.923   3.564
    5    HG2  GLN 730           HG2      GLN 730  47.254 -27.244   5.867
    6    HG3  GLN 730           HG3      GLN 730  45.553 -27.429   6.247
    7   HE21  GLN 730          HE21      GLN 730  45.766 -29.497   7.057
    8   HE22  GLN 730          HE22      GLN 730  46.237 -30.857   6.109

  No H/Q in entry =           8
  In of MODEL    1
    1    H    ASP 731           H        ASP 731  46.172 -24.500   6.821
    2    HA   ASP 731           HA       ASP 731  48.671 -23.170   6.357
    3    HB2  ASP 731           HB2      ASP 731  47.095 -22.394   8.146
    4    HB3  ASP 731           HB3      ASP 731  47.376 -23.898   8.993

  No H/Q in entry =           4
  In of MODEL    1
    1    H    GLU 732           H        GLU 732  50.709 -23.968   6.655
    2    HA   GLU 732           HA       GLU 732  50.941 -26.786   6.777
    3    HB2  GLU 732           HB2      GLU 732  52.936 -24.591   6.491
    4    HB3  GLU 732           HB3      GLU 732  53.443 -26.264   6.706
    5    HG2  GLU 732           HG2      GLU 732  51.610 -25.283   4.536
    6    HG3  GLU 732           HG3      GLU 732  53.335 -25.611   4.342

  No H/Q in entry =           6
  In of MODEL    1
    1    H    ARG 733           H        ARG 733  51.008 -24.509   9.308
    2    HA   ARG 733           HA       ARG 733  52.557 -26.380  10.935
    3    HB2  ARG 733           HB2      ARG 733  53.394 -24.102  10.958
    4    HB3  ARG 733           HB3      ARG 733  51.814 -23.489  11.411
    5    HG2  ARG 733           HG2      ARG 733  53.437 -23.534  13.281
    6    HG3  ARG 733           HG3      ARG 733  51.991 -24.497  13.587
    7    HD2  ARG 733           HD2      ARG 733  53.191 -26.530  13.055
    8    HD3  ARG 733           HD3      ARG 733  54.621 -25.594  12.611
    9    HE   ARG 733           HE       ARG 733  55.128 -25.317  14.790
   10   HH11  ARG 733          HH11      ARG 733  51.837 -26.674  14.666
   11   HH12  ARG 733          HH12      ARG 733  51.811 -27.075  16.315
   12   HH21  ARG 733          HH21      ARG 733  55.077 -25.940  17.039
   13   HH22  ARG 733          HH22      ARG 733  53.702 -26.711  17.676

  No H/Q in entry =          13
  In of MODEL    1
    1    H    SER 734           H        SER 734  49.492 -24.783  10.698
    2    HA   SER 734           HA       SER 734  48.504 -26.035  13.135
    3    HB2  SER 734           HB2      SER 734  46.997 -24.349  11.166
    4    HB3  SER 734           HB3      SER 734  46.652 -24.574  12.887
    5    HG   SER 734           HG       SER 734  48.780 -23.195  11.659

  No H/Q in entry =           5
  In of MODEL    1
    1    H    LYS 735           H        LYS 735  48.361 -26.481   9.638
    2    HA   LYS 735           HA       LYS 735  47.372 -27.791   8.269
    3    HB2  LYS 735           HB2      LYS 735  47.223 -29.605  10.656
    4    HB3  LYS 735           HB3      LYS 735  46.758 -30.110   9.038
    5    HG2  LYS 735           HG2      LYS 735  49.485 -29.153   9.896
    6    HG3  LYS 735           HG3      LYS 735  49.030 -30.814   9.498
    7    HD2  LYS 735           HD2      LYS 735  48.375 -29.908   7.198
    8    HD3  LYS 735           HD3      LYS 735  49.165 -28.427   7.677
    9    HE2  LYS 735           HE2      LYS 735  51.271 -29.468   7.931
   10    HE3  LYS 735           HE3      LYS 735  50.577 -31.073   7.711
   11    HZ2  LYS 735           HZ1      LYS 735  50.736 -28.953   5.584
   12    HZ1  LYS 735           HZ2      LYS 735  50.021 -30.464   5.446
   13    HZ3  LYS 735           HZ3      LYS 735  51.654 -30.362   5.698

  No H/Q in entry =          13
  In of MODEL    1
    1    H    ARG 736           H        ARG 736  45.734 -25.941   9.803
    2    HA   ARG 736           HA       ARG 736  43.090 -27.112   9.592
    3    HB2  ARG 736           HB2      ARG 736  42.305 -24.954  10.442
    4    HB3  ARG 736           HB3      ARG 736  43.546 -25.641  11.482
    5    HG2  ARG 736           HG2      ARG 736  45.202 -24.182  10.384
    6    HG3  ARG 736           HG3      ARG 736  43.892 -23.457   9.464
    7    HD2  ARG 736           HD2      ARG 736  44.041 -23.506  12.464
    8    HD3  ARG 736           HD3      ARG 736  44.598 -22.207  11.411
    9    HE   ARG 736           HE       ARG 736  41.899 -22.800  10.838
   10   HH11  ARG 736          HH11      ARG 736  43.836 -21.352  13.375
   11   HH12  ARG 736          HH12      ARG 736  42.656 -20.232  13.873
   12   HH21  ARG 736          HH21      ARG 736  40.257 -21.294  11.461
   13   HH22  ARG 736          HH22      ARG 736  40.516 -20.203  12.747

  No H/Q in entry =          13
  In of MODEL    1
    1    H    ILE 737           H        ILE 737  41.545 -26.317   8.065
    2    HA   ILE 737           HA       ILE 737  42.735 -25.132   5.712
    3    HB   ILE 737           HB       ILE 737  39.837 -25.844   6.178
    4   HG12  ILE 737          HG12      ILE 737  41.249 -27.873   6.543
    5   HG13  ILE 737          HG13      ILE 737  40.223 -28.016   5.126
    6   HG22  ILE 737          HG21      ILE 737  41.453 -25.622   3.641
    7   HG21  ILE 737          HG22      ILE 737  40.485 -24.334   4.320
    8   HG23  ILE 737          HG23      ILE 737  39.699 -25.821   3.764
    9   HD11  ILE 737          HD11      ILE 737  42.105 -27.467   3.719
   10   HD13  ILE 737          HD12      ILE 737  42.421 -28.907   4.696
   11   HD12  ILE 737          HD13      ILE 737  43.162 -27.359   5.131

  No H/Q in entry =          11
  In of MODEL    1
    1    H    LEU 738           H        LEU 738  42.702 -23.005   5.546
    2    HA   LEU 738           HA       LEU 738  40.582 -21.609   6.942
    3    HB2  LEU 738           HB2      LEU 738  42.063 -19.727   7.527
    4    HB3  LEU 738           HB3      LEU 738  42.592 -21.209   8.276
    5    HG   LEU 738           HG       LEU 738  43.885 -20.125   5.776
    6   HD11  LEU 738          HD11      LEU 738  44.626 -19.654   8.673
    7   HD13  LEU 738          HD12      LEU 738  44.008 -18.430   7.562
    8   HD12  LEU 738          HD13      LEU 738  45.581 -19.175   7.273
    9   HD23  LEU 738          HD21      LEU 738  44.902 -21.878   7.965
   10   HD22  LEU 738          HD22      LEU 738  45.638 -21.608   6.353
   11   HD21  LEU 738          HD23      LEU 738  44.109 -22.473   6.527

  No H/Q in entry =          11
  In of MODEL    1
    1    HA   PRO 739           HA       PRO 739  39.816 -19.700   3.115
    2    HB2  PRO 739           HB2      PRO 739  38.581 -17.449   3.970
    3    HB3  PRO 739           HB3      PRO 739  37.814 -19.036   4.116
    4    HG2  PRO 739           HG2      PRO 739  39.293 -17.465   6.189
    5    HG3  PRO 739           HG3      PRO 739  37.752 -18.330   6.334
    6    HD2  PRO 739           HD2      PRO 739  40.133 -19.447   7.166
    7    HD3  PRO 739           HD3      PRO 739  38.784 -20.398   6.495

  No H/Q in entry =           7
  In of MODEL    1
    1    H    LEU 740           H        LEU 740  41.390 -18.866   1.986
    2    HA   LEU 740           HA       LEU 740  42.643 -16.389   2.909
    3    HB2  LEU 740           HB2      LEU 740  43.891 -18.647   1.353
    4    HB3  LEU 740           HB3      LEU 740  44.585 -17.048   1.457
    5    HG   LEU 740           HG       LEU 740  44.211 -18.993   3.736
    6   HD12  LEU 740          HD11      LEU 740  46.654 -19.009   3.738
    7   HD11  LEU 740          HD12      LEU 740  46.648 -17.931   2.329
    8   HD13  LEU 740          HD13      LEU 740  45.987 -19.555   2.196
    9   HD22  LEU 740          HD21      LEU 740  43.903 -16.706   4.539
   10   HD21  LEU 740          HD22      LEU 740  45.370 -16.203   3.705
   11   HD23  LEU 740          HD23      LEU 740  45.474 -17.324   5.060

  No H/Q in entry =          11
  In of MODEL    1
    1    H    THR 741           H        THR 741  43.522 -15.280   0.943
    2    HA   THR 741           HA       THR 741  41.629 -15.659  -1.226
    3    HB   THR 741           HB       THR 741  42.640 -12.971  -0.275
    4    HG1  THR 741           HG1      THR 741  40.097 -13.976   0.518
    5   HG22  THR 741          HG21      THR 741  40.560 -12.170  -1.262
    6   HG21  THR 741          HG22      THR 741  40.112 -13.829  -1.657
    7   HG23  THR 741          HG23      THR 741  41.504 -13.081  -2.437

  No H/Q in entry =           7
  In of MODEL    1
    1    H    VAL 742           H        VAL 742  42.573 -14.945  -3.292
    2    HA   VAL 742           HA       VAL 742  44.972 -16.096  -3.853
    3    HB   VAL 742           HB       VAL 742  43.743 -13.847  -5.430
    4   HG13  VAL 742          HG11      VAL 742  46.000 -14.171  -6.112
    5   HG12  VAL 742          HG12      VAL 742  44.872 -14.747  -7.337
    6   HG11  VAL 742          HG13      VAL 742  45.727 -15.912  -6.310
    7   HG22  VAL 742          HG21      VAL 742  42.222 -15.625  -5.107
    8   HG21  VAL 742          HG22      VAL 742  43.447 -16.803  -5.636
    9   HG23  VAL 742          HG23      VAL 742  42.810 -15.601  -6.774

  No H/Q in entry =           9
  In of MODEL    1
    1    H    CYS 743           H        CYS 743  44.638 -12.540  -3.401
    2    HA   CYS 743           HA       CYS 743  47.384 -12.160  -3.890
    3    HB2  CYS 743           HB2      CYS 743  45.851 -10.256  -4.118
    4    HB3  CYS 743           HB3      CYS 743  45.519 -10.299  -2.389

  No H/Q in entry =           4
  In of MODEL    1
    1    H    LYS 744           H        LYS 744  45.515 -12.459  -0.917
    2    HA   LYS 744           HA       LYS 744  47.385 -12.027   1.011
    3    HB2  LYS 744           HB2      LYS 744  45.002 -12.476   1.344
    4    HB3  LYS 744           HB3      LYS 744  45.253 -14.152   0.951
    5    HG2  LYS 744           HG2      LYS 744  45.085 -13.978   3.354
    6    HG3  LYS 744           HG3      LYS 744  46.731 -14.416   2.914
    7    HD2  LYS 744           HD2      LYS 744  46.775 -12.784   4.675
    8    HD3  LYS 744           HD3      LYS 744  47.396 -12.045   3.193
    9    HE2  LYS 744           HE2      LYS 744  45.936 -10.478   4.333
   10    HE3  LYS 744           HE3      LYS 744  45.157 -11.005   2.848
   11    HZ3  LYS 744           HZ1      LYS 744  43.598 -10.980   4.674
   12    HZ2  LYS 744           HZ2      LYS 744  44.546 -12.005   5.592
   13    HZ1  LYS 744           HZ3      LYS 744  43.828 -12.568   4.184

  No H/Q in entry =          13
  In of MODEL    1
    1    H    MET 745           H        MET 745  46.495 -15.136  -0.429
    2    HA   MET 745           HA       MET 745  48.486 -16.749   0.688
    3    HB2  MET 745           HB2      MET 745  46.929 -17.986  -0.168
    4    HB3  MET 745           HB3      MET 745  46.567 -16.963  -1.560
    5    HG2  MET 745           HG2      MET 745  47.455 -18.919  -2.523
    6    HG3  MET 745           HG3      MET 745  48.824 -17.842  -2.463
    7    HE3  MET 745           HE1      MET 745  47.183 -20.101   0.411
    8    HE2  MET 745           HE2      MET 745  48.166 -21.559   0.140
    9    HE1  MET 745           HE3      MET 745  47.128 -20.932  -1.134

  No H/Q in entry =           9
  In of MODEL    1
    1    H    HIS 746           H        HIS 746  48.475 -14.903  -2.329
    2    HA   HIS 746           HA       HIS 746  50.922 -16.087  -3.247
    3    HB2  HIS 746           HB2      HIS 746  49.208 -13.936  -4.217
    4    HB3  HIS 746           HB3      HIS 746  50.908 -13.783  -4.683
    5    HD1  HIS 746           HD1      HIS 746  51.797 -16.152  -5.909
    6    HD2  HIS 746           HD2      HIS 746  47.739 -15.303  -5.929
    7    HE1  HIS 746           HE1      HIS 746  50.859 -17.423  -7.854
    8    HE2  HIS 746           HE2      HIS 746  48.381 -17.013  -7.758

  No H/Q in entry =           8
  In of MODEL    1
    1    H    VAL 747           H        VAL 747  50.234 -12.965  -1.786
    2    HA   VAL 747           HA       VAL 747  52.867 -12.000  -1.812
    3    HB   VAL 747           HB       VAL 747  50.439 -11.319  -0.148
    4   HG12  VAL 747          HG11      VAL 747  53.096  -9.857  -0.199
    5   HG11  VAL 747          HG12      VAL 747  52.473 -10.786   1.165
    6   HG13  VAL 747          HG13      VAL 747  51.635  -9.335   0.641
    7   HG23  VAL 747          HG21      VAL 747  51.899  -9.922  -2.329
    8   HG22  VAL 747          HG22      VAL 747  50.441  -9.328  -1.510
    9   HG21  VAL 747          HG23      VAL 747  50.379 -10.797  -2.498

  No H/Q in entry =           9
  In of MODEL    1
    1    H    LEU 748           H        LEU 748  50.965 -13.495   0.734
    2    HA   LEU 748           HA       LEU 748  53.016 -13.572   2.596
    3    HB2  LEU 748           HB2      LEU 748  51.107 -13.896   3.741
    4    HB3  LEU 748           HB3      LEU 748  50.274 -14.436   2.323
    5    HG   LEU 748           HG       LEU 748  51.853 -16.264   4.157
    6   HD12  LEU 748          HD11      LEU 748  48.903 -15.682   4.008
    7   HD11  LEU 748          HD12      LEU 748  49.978 -15.188   5.321
    8   HD13  LEU 748          HD13      LEU 748  49.660 -16.899   5.029
    9   HD22  LEU 748          HD21      LEU 748  50.601 -18.035   3.058
   10   HD21  LEU 748          HD22      LEU 748  51.478 -17.121   1.837
   11   HD23  LEU 748          HD23      LEU 748  49.748 -16.865   2.065

  No H/Q in entry =          11
  In of MODEL    1
    1    H    HIS 749           H        HIS 749  52.230 -15.747   0.002
    2    HA   HIS 749           HA       HIS 749  53.882 -17.922   0.757
    3    HB2  HIS 749           HB2      HIS 749  52.058 -17.792  -1.085
    4    HB3  HIS 749           HB3      HIS 749  53.342 -17.145  -2.093
    5    HD1  HIS 749           HD1      HIS 749  55.072 -18.854  -3.033
    6    HD2  HIS 749           HD2      HIS 749  52.294 -20.445  -0.388
    7    HE1  HIS 749           HE1      HIS 749  55.339 -21.314  -3.194
    8    HE2  HIS 749           HE2      HIS 749  53.854 -22.256  -1.429

  No H/Q in entry =           8
  In of MODEL    1
    1    H    CYS 750           H        CYS 750  54.468 -14.991  -1.211
    2    HA   CYS 750           HA       CYS 750  57.132 -15.872  -1.752
    3    HB2  CYS 750           HB2      CYS 750  57.438 -13.822  -3.019
    4    HB3  CYS 750           HB3      CYS 750  55.919 -14.574  -3.463

  No H/Q in entry =           4
  In of MODEL    1
    1    H    GLN 751           H        GLN 751  55.575 -14.001   0.685
    2    HA   GLN 751           HA       GLN 751  57.974 -12.860   1.699
    3    HB2  GLN 751           HB2      GLN 751  55.351 -13.376   3.109
    4    HB3  GLN 751           HB3      GLN 751  56.666 -12.397   3.744
    5    HG2  GLN 751           HG2      GLN 751  56.450 -10.917   1.777
    6    HG3  GLN 751           HG3      GLN 751  55.065 -11.865   1.268
    7   HE21  GLN 751          HE21      GLN 751  55.255  -9.103   1.909
    8   HE22  GLN 751          HE22      GLN 751  54.141  -8.802   3.190

  No H/Q in entry =           8
  In of MODEL    1
    1    H    GLY 752           H        GLY 752  56.972 -16.021   1.600
    2    HA3  GLY 752           HA2      GLY 752  58.612 -17.669   2.239
    3    HA2  GLY 752           HA3      GLY 752  58.994 -16.677   3.638

  No H/Q in entry =           3
  In of MODEL    1
    1    H    ARG 753           H        ARG 753  55.654 -17.103   2.919
    2    HA   ARG 753           HA       ARG 753  55.461 -18.894   5.220
    3    HB2  ARG 753           HB2      ARG 753  53.377 -17.334   3.738
    4    HB3  ARG 753           HB3      ARG 753  53.078 -18.281   5.191
    5    HG2  ARG 753           HG2      ARG 753  54.942 -15.906   5.093
    6    HG3  ARG 753           HG3      ARG 753  53.249 -15.771   5.526
    7    HD2  ARG 753           HD2      ARG 753  54.507 -15.873   7.561
    8    HD3  ARG 753           HD3      ARG 753  53.665 -17.404   7.358
    9    HE   ARG 753           HE       ARG 753  56.387 -17.365   6.426
   10   HH11  ARG 753          HH11      ARG 753  54.202 -17.927   9.164
   11   HH12  ARG 753          HH12      ARG 753  55.281 -18.950   9.993
   12   HH21  ARG 753          HH21      ARG 753  57.900 -18.771   7.633
   13   HH22  ARG 753          HH22      ARG 753  57.386 -19.428   9.119

  No H/Q in entry =          13
  In of MODEL    1
    1    H    ASN 754           H        ASN 754  54.441 -20.865   5.021
    2    HA   ASN 754           HA       ASN 754  54.193 -21.781   2.239
    3    HB2  ASN 754           HB2      ASN 754  54.720 -23.545   4.644
    4    HB3  ASN 754           HB3      ASN 754  54.802 -24.008   2.954
    5   HD21  ASN 754          HD21      ASN 754  56.403 -22.613   5.596
    6   HD22  ASN 754          HD22      ASN 754  57.954 -22.409   4.892

  No H/Q in entry =           6
  In of MODEL    1
    1    H    TYR 755           H        TYR 755  52.297 -22.408   1.592
    2    HA   TYR 755           HA       TYR 755  50.351 -23.447   3.459
    3    HB2  TYR 755           HB2      TYR 755  49.936 -21.035   1.726
    4    HB3  TYR 755           HB3      TYR 755  48.595 -22.092   2.148
    5    HD1  TYR 755           HD1      TYR 755  51.174 -19.850   3.513
    6    HD2  TYR 755           HD2      TYR 755  47.610 -21.989   4.286
    7    HE1  TYR 755           HE1      TYR 755  50.928 -18.652   5.620
    8    HE2  TYR 755           HE2      TYR 755  47.358 -20.799   6.420
    9    HH   TYR 755           HH       TYR 755  48.911 -19.772   8.006

  No H/Q in entry =           9
  In of MODEL    1
    1    H    THR 756           H        THR 756  49.016 -24.864   2.581
    2    HA   THR 756           HA       THR 756  49.705 -25.744  -0.114
    3    HB   THR 756           HB       THR 756  48.402 -27.148   2.227
    4    HG1  THR 756           HG1      THR 756  50.390 -27.387   2.868
    5   HG23  THR 756          HG21      THR 756  47.679 -28.056   0.113
    6   HG22  THR 756          HG22      THR 756  48.750 -29.211   0.925
    7   HG21  THR 756          HG23      THR 756  49.351 -28.226  -0.427

  No H/Q in entry =           7
  In of MODEL    1
    1    H    LEU 757           H        LEU 757  47.953 -25.887  -1.635
    2    HA   LEU 757           HA       LEU 757  45.544 -24.728  -0.570
    3    HB2  LEU 757           HB2      LEU 757  46.356 -25.116  -3.416
    4    HB3  LEU 757           HB3      LEU 757  44.748 -24.608  -2.942
    5    HG   LEU 757           HG       LEU 757  46.157 -22.824  -1.592
    6   HD12  LEU 757          HD11      LEU 757  47.995 -21.968  -2.954
    7   HD11  LEU 757          HD12      LEU 757  47.896 -23.414  -3.962
    8   HD13  LEU 757          HD13      LEU 757  48.317 -23.554  -2.257
    9   HD23  LEU 757          HD21      LEU 757  45.699 -21.279  -3.403
   10   HD22  LEU 757          HD22      LEU 757  44.362 -22.369  -3.042
   11   HD21  LEU 757          HD23      LEU 757  45.364 -22.649  -4.479

  No H/Q in entry =          11
  In of MODEL    1
    1    H    THR 758           H        THR 758  43.579 -25.472  -0.793
    2    HA   THR 758           HA       THR 758  43.450 -28.356  -1.139
    3    HB   THR 758           HB       THR 758  41.736 -28.287   0.761
    4    HG1  THR 758           HG1      THR 758  42.313 -25.660   0.568
    5   HG21  THR 758          HG21      THR 758  44.021 -29.171   1.038
    6   HG23  THR 758          HG22      THR 758  43.484 -28.350   2.496
    7   HG22  THR 758          HG23      THR 758  44.605 -27.547   1.392

  No H/Q in entry =           7
  In of MODEL    1
    1    H    GLY 759           H        GLY 759  40.739 -28.683  -0.814
    2    HA3  GLY 759           HA2      GLY 759  39.897 -27.774  -3.388
    3    HA2  GLY 759           HA3      GLY 759  39.019 -28.820  -2.281

  No H/Q in entry =           3
  In of MODEL    1
    1    H    ARG 760           H        ARG 760  37.661 -27.034  -3.613
    2    HA   ARG 760           HA       ARG 760  37.410 -24.520  -2.239
    3    HB2  ARG 760           HB2      ARG 760  35.626 -24.046  -3.868
    4    HB3  ARG 760           HB3      ARG 760  37.032 -24.709  -4.674
    5    HG2  ARG 760           HG2      ARG 760  35.414 -25.920  -5.732
    6    HG3  ARG 760           HG3      ARG 760  35.690 -26.980  -4.353
    7    HD2  ARG 760           HD2      ARG 760  33.828 -25.588  -3.218
    8    HD3  ARG 760           HD3      ARG 760  33.422 -25.088  -4.857
    9    HE   ARG 760           HE       ARG 760  33.467 -27.852  -3.881
   10   HH11  ARG 760          HH11      ARG 760  32.239 -25.564  -6.305
   11   HH12  ARG 760          HH12      ARG 760  30.851 -26.461  -6.641
   12   HH21  ARG 760          HH21      ARG 760  31.553 -29.044  -4.317
   13   HH22  ARG 760          HH22      ARG 760  30.428 -28.504  -5.486

  No H/Q in entry =          13
  In of MODEL    1
    1    H    ASP 761           H        ASP 761  36.414 -27.584  -1.616
    2    HA   ASP 761           HA       ASP 761  33.967 -26.843  -0.160
    3    HB2  ASP 761           HB2      ASP 761  35.168 -29.551  -0.759
    4    HB3  ASP 761           HB3      ASP 761  33.681 -29.294   0.146

  No H/Q in entry =           4
  In of MODEL    1
    1    H    SER 762           H        SER 762  37.244 -27.049   0.394
    2    HA   SER 762           HA       SER 762  37.227 -28.531   2.823
    3    HB2  SER 762           HB2      SER 762  39.356 -26.678   1.746
    4    HB3  SER 762           HB3      SER 762  39.566 -27.870   3.022
    5    HG   SER 762           HG       SER 762  38.501 -29.152   0.998

  No H/Q in entry =           5
  In of MODEL    1
    1    H    CYS 763           H        CYS 763  36.822 -25.129   2.055
    2    HA   CYS 763           HA       CYS 763  36.323 -24.694   4.899
    3    HB2  CYS 763           HB2      CYS 763  37.467 -22.612   4.945
    4    HB3  CYS 763           HB3      CYS 763  38.602 -23.758   4.238

  No H/Q in entry =           4
  In of MODEL    1
    1    H    THR 764           H        THR 764  35.256 -22.412   5.065
    2    HA   THR 764           HA       THR 764  33.249 -22.137   2.942
    3    HB   THR 764           HB       THR 764  33.225 -21.312   5.865
    4    HG1  THR 764           HG1      THR 764  32.206 -23.528   4.464
    5   HG21  THR 764          HG21      THR 764  31.813 -19.897   4.407
    6   HG23  THR 764          HG22      THR 764  30.854 -20.854   5.536
    7   HG22  THR 764          HG23      THR 764  30.969 -21.343   3.843

  No H/Q in entry =           7
  In of MODEL    1
    1    H    LEU 765           H        LEU 765  33.393 -20.346   1.772
    2    HA   LEU 765           HA       LEU 765  35.253 -18.319   2.675
    3    HB2  LEU 765           HB2      LEU 765  34.176 -18.955  -0.011
    4    HB3  LEU 765           HB3      LEU 765  34.927 -17.398   0.260
    5    HG   LEU 765           HG       LEU 765  36.607 -18.567  -0.711
    6   HD11  LEU 765          HD11      LEU 765  37.459 -17.787   1.430
    7   HD13  LEU 765          HD12      LEU 765  38.258 -19.257   0.868
    8   HD12  LEU 765          HD13      LEU 765  37.049 -19.352   2.137
    9   HD21  LEU 765          HD21      LEU 765  35.401 -20.540  -0.950
   10   HD23  LEU 765          HD22      LEU 765  35.713 -20.948   0.767
   11   HD22  LEU 765          HD23      LEU 765  37.068 -20.856  -0.409

  No H/Q in entry =          11
  In of MODEL    1
    1    HA   PRO 766           HA       PRO 766  32.200 -15.148   3.417
    2    HB2  PRO 766           HB2      PRO 766  33.646 -13.131   2.117
    3    HB3  PRO 766           HB3      PRO 766  33.866 -13.599   3.805
    4    HG2  PRO 766           HG2      PRO 766  35.390 -14.566   1.379
    5    HG3  PRO 766           HG3      PRO 766  36.037 -14.053   2.965
    6    HD2  PRO 766           HD2      PRO 766  35.842 -16.540   2.299
    7    HD3  PRO 766           HD3      PRO 766  35.305 -16.090   3.930

  No H/Q in entry =           7
  In of MODEL    1
    1    H    ALA 767           H        ALA 767  33.809 -15.236   0.260
    2    HA   ALA 767           HA       ALA 767  31.201 -14.963  -1.026
    3    HB2  ALA 767           HB1      ALA 767  33.814 -13.824  -1.998
    4    HB1  ALA 767           HB2      ALA 767  32.441 -12.897  -1.365
    5    HB3  ALA 767           HB3      ALA 767  32.281 -13.813  -2.872

  No H/Q in entry =           5
  In of MODEL    1
    1    H    SER 768           H        SER 768  30.938 -17.051  -1.255
    2    HA   SER 768           HA       SER 768  32.859 -18.520  -2.884
    3    HB2  SER 768           HB2      SER 768  31.253 -20.385  -2.083
    4    HB3  SER 768           HB3      SER 768  32.422 -19.702  -0.937
    5    HG   SER 768           HG       SER 768  29.724 -19.683  -0.813

  No H/Q in entry =           5
  In of MODEL    1
    1    H    ALA 769           H        ALA 769  29.907 -16.906  -2.927
    2    HA   ALA 769           HA       ALA 769  29.241 -17.857  -5.568
    3    HB3  ALA 769           HB1      ALA 769  27.301 -17.934  -3.236
    4    HB2  ALA 769           HB2      ALA 769  27.966 -19.338  -4.066
    5    HB1  ALA 769           HB3      ALA 769  26.882 -18.244  -4.923

  No H/Q in entry =           5
  In of MODEL    1
    1    H    GLU 770           H        GLU 770  26.736 -16.505  -5.527
    2    HA   GLU 770           HA       GLU 770  27.600 -13.886  -6.087
    3    HB2  GLU 770           HB2      GLU 770  25.210 -13.468  -6.528
    4    HB3  GLU 770           HB3      GLU 770  25.821 -14.901  -7.343
    5    HG2  GLU 770           HG2      GLU 770  24.824 -16.266  -5.522
    6    HG3  GLU 770           HG3      GLU 770  24.115 -14.788  -4.873

  No H/Q in entry =           6
  In of MODEL    1
    1    H    LYS 771           H        LYS 771  26.700 -11.919  -5.207
    2    HA   LYS 771           HA       LYS 771  26.396 -12.084  -2.306
    3    HB2  LYS 771           HB2      LYS 771  27.873 -10.024  -3.946
    4    HB3  LYS 771           HB3      LYS 771  27.571  -9.881  -2.226
    5    HG2  LYS 771           HG2      LYS 771  29.077 -12.214  -3.372
    6    HG3  LYS 771           HG3      LYS 771  29.876 -10.697  -2.999
    7    HD2  LYS 771           HD2      LYS 771  30.190 -12.252  -1.187
    8    HD3  LYS 771           HD3      LYS 771  29.152 -10.942  -0.626
    9    HE2  LYS 771           HE2      LYS 771  27.251 -12.404  -0.734
   10    HE3  LYS 771           HE3      LYS 771  28.205 -13.701  -1.485
   11    HZ3  LYS 771           HZ1      LYS 771  27.858 -14.096   0.847
   12    HZ2  LYS 771           HZ2      LYS 771  28.393 -12.585   1.269
   13    HZ1  LYS 771           HZ3      LYS 771  29.488 -13.727   0.674

  No H/Q in entry =          13
  In of MODEL    1
    1    H    ALA 772           H        ALA 772  25.663  -9.511  -1.719
    2    HA   ALA 772           HA       ALA 772  23.496  -8.845  -3.553
    3    HB2  ALA 772           HB1      ALA 772  22.491 -10.175  -1.767
    4    HB1  ALA 772           HB2      ALA 772  21.964  -8.494  -1.659
    5    HB3  ALA 772           HB3      ALA 772  23.199  -9.108  -0.558

  No H/Q in entry =           5
  In of MODEL    1
    1    H    CYS 773           H        CYS 773  22.560  -6.601  -2.872
    2    HA   CYS 773           HA       CYS 773  24.746  -4.827  -3.095
    3    HB2  CYS 773           HB2      CYS 773  22.492  -4.398  -4.076
    4    HB3  CYS 773           HB3      CYS 773  21.855  -4.179  -2.457

  No H/Q in entry =           4
  In of MODEL    1
    1    H    GLY 774           H        GLY 774  25.821  -3.761  -1.628
    2    HA3  GLY 774           HA2      GLY 774  25.757  -2.601   0.543
    3    HA2  GLY 774           HA3      GLY 774  25.003  -4.067   1.175

  No H/Q in entry =           3
  In of MODEL    1
    1    H    ALA 775           H        ALA 775  26.711  -5.691  -0.673
    2    HA   ALA 775           HA       ALA 775  29.391  -5.271   0.276
    3    HB2  ALA 775           HB1      ALA 775  27.857  -7.793   0.957
    4    HB3  ALA 775           HB2      ALA 775  28.404  -6.575   2.109
    5    HB1  ALA 775           HB3      ALA 775  29.583  -7.536   1.220

  No H/Q in entry =           5
  In of MODEL    1
    1    H    CYS 776           H        CYS 776  30.254  -5.237  -1.710
    2    HA   CYS 776           HA       CYS 776  29.774  -7.554  -3.387
    3    HB2  CYS 776           HB2      CYS 776  29.662  -4.685  -4.329
    4    HB3  CYS 776           HB3      CYS 776  29.787  -6.059  -5.412

  No H/Q in entry =           4
  In of MODEL    1
    1    HA   PRO 777           HA       PRO 777  34.267  -7.310  -3.742
    2    HB2  PRO 777           HB2      PRO 777  34.080  -9.060  -6.080
    3    HB3  PRO 777           HB3      PRO 777  34.688  -9.448  -4.475
    4    HG2  PRO 777           HG2      PRO 777  32.409 -10.505  -5.412
    5    HG3  PRO 777           HG3      PRO 777  32.617 -10.102  -3.697
    6    HD2  PRO 777           HD2      PRO 777  31.241  -8.544  -5.852
    7    HD3  PRO 777           HD3      PRO 777  30.683  -8.952  -4.210

  No H/Q in entry =           7
  In of MODEL    1
    1    H    LEU 778           H        LEU 778  35.566  -7.750  -6.281
    2    HA   LEU 778           HA       LEU 778  35.055  -5.166  -7.476
    3    HB2  LEU 778           HB2      LEU 778  37.244  -5.354  -8.642
    4    HB3  LEU 778           HB3      LEU 778  37.339  -5.440  -6.904
    5    HG   LEU 778           HG       LEU 778  39.002  -6.845  -7.888
    6   HD13  LEU 778          HD11      LEU 778  38.639  -8.946  -6.861
    7   HD12  LEU 778          HD12      LEU 778  36.914  -8.659  -6.779
    8   HD11  LEU 778          HD13      LEU 778  38.021  -7.651  -5.832
    9   HD23  LEU 778          HD21      LEU 778  36.808  -8.324  -9.294
   10   HD22  LEU 778          HD22      LEU 778  38.508  -8.792  -9.270
   11   HD21  LEU 778          HD23      LEU 778  38.013  -7.287 -10.064

  No H/Q in entry =          11
  In of MODEL    1
    1    H    TRP 779           H        TRP 779  34.345  -8.334  -8.172
    2    HA   TRP 779           HA       TRP 779  33.922  -7.801 -11.031
    3    HB2  TRP 779           HB2      TRP 779  33.400 -10.290 -11.089
    4    HB3  TRP 779           HB3      TRP 779  35.062  -9.862 -10.697
    5    HD1  TRP 779           HD1      TRP 779  31.813 -10.949  -8.849
    6    HE1  TRP 779           HE1      TRP 779  32.513 -12.163  -6.701
    7    HE3  TRP 779           HE3      TRP 779  36.853 -10.381  -9.227
    8    HZ2  TRP 779           HZ2      TRP 779  34.909 -12.781  -5.361
    9    HZ3  TRP 779           HZ3      TRP 779  38.284 -11.299  -7.481
   10    HH2  TRP 779           HH2      TRP 779  37.336 -12.493  -5.581

  No H/Q in entry =          10
  In of MODEL    1
    1    H    GLY 780           H        GLY 780  32.313  -7.264  -8.335
    2    HA3  GLY 780           HA2      GLY 780  29.737  -7.626  -9.615
    3    HA2  GLY 780           HA3      GLY 780  29.970  -8.361  -8.024

  No H/Q in entry =           3
  In of MODEL    1
    1    H    LYS 781           H        LYS 781  28.335  -6.046  -9.036
    2    HA   LYS 781           HA       LYS 781  29.121  -4.185  -6.944
    3    HB2  LYS 781           HB2      LYS 781  28.611  -3.314  -9.802
    4    HB3  LYS 781           HB3      LYS 781  28.737  -2.230  -8.430
    5    HG2  LYS 781           HG2      LYS 781  30.911  -4.007  -9.487
    6    HG3  LYS 781           HG3      LYS 781  30.771  -2.261  -9.734
    7    HD2  LYS 781           HD2      LYS 781  31.032  -1.879  -7.349
    8    HD3  LYS 781           HD3      LYS 781  31.059  -3.616  -7.047
    9    HE2  LYS 781           HE2      LYS 781  33.034  -3.795  -8.461
   10    HE3  LYS 781           HE3      LYS 781  33.058  -2.029  -8.615
   11    HZ1  LYS 781           HZ1      LYS 781  33.267  -1.914  -6.187
   12    HZ3  LYS 781           HZ2      LYS 781  34.567  -2.706  -6.886
   13    HZ2  LYS 781           HZ3      LYS 781  33.346  -3.595  -6.110

  No H/Q in entry =          13
  In of MODEL    1
    1    H    CYS 782           H        CYS 782  27.324  -2.682  -6.545
    2    HA   CYS 782           HA       CYS 782  24.782  -4.024  -6.769
    3    HB2  CYS 782           HB2      CYS 782  25.424  -2.784  -4.722
    4    HB3  CYS 782           HB3      CYS 782  25.505  -1.291  -5.649

  No H/Q in entry =           4
  In of MODEL    1
    1    H    ASP 783           H        ASP 783  23.105  -3.442  -8.189
    2    HA   ASP 783           HA       ASP 783  24.036  -1.878 -10.436
    3    HB2  ASP 783           HB2      ASP 783  22.132  -2.784 -11.701
    4    HB3  ASP 783           HB3      ASP 783  23.030  -4.068 -10.924

  No H/Q in entry =           4
  In of MODEL    1
    1    H    ALA 784           H        ALA 784  21.624  -0.975 -11.515
    2    HA   ALA 784           HA       ALA 784  21.516   1.501 -10.112
    3    HB2  ALA 784           HB1      ALA 784  20.081   2.248 -11.932
    4    HB1  ALA 784           HB2      ALA 784  19.968   0.595 -12.528
    5    HB3  ALA 784           HB3      ALA 784  21.522   1.436 -12.545

  No H/Q in entry =           5
  In of MODEL    1
    1    H    GLU 785           H        GLU 785  20.628   1.114  -8.182
    2    HA   GLU 785           HA       GLU 785  19.099   1.105  -6.587
    3    HB2  GLU 785           HB2      GLU 785  18.075   2.897  -7.946
    4    HB3  GLU 785           HB3      GLU 785  17.082   1.691  -8.751
    5    HG2  GLU 785           HG2      GLU 785  16.041   1.130  -6.616
    6    HG3  GLU 785           HG3      GLU 785  17.033   2.351  -5.821

  No H/Q in entry =           6
  In of MODEL    1
    1    H    SER 786           H        SER 786  19.267  -0.940  -5.889
    2    HA   SER 786           HA       SER 786  16.972  -2.612  -6.178
    3    HB2  SER 786           HB2      SER 786  18.171  -4.539  -7.056
    4    HB3  SER 786           HB3      SER 786  18.357  -3.198  -8.189
    5    HG   SER 786           HG       SER 786  20.398  -3.883  -7.947

  No H/Q in entry =           5
  In of MODEL    1
    1    H    SER 787           H        SER 787  17.811  -4.832  -4.980
    2    HA   SER 787           HA       SER 787  19.403  -4.005  -2.661
    3    HB2  SER 787           HB2      SER 787  17.272  -6.154  -2.853
    4    HB3  SER 787           HB3      SER 787  18.112  -5.644  -1.388
    5    HG   SER 787           HG       SER 787  17.214  -3.453  -2.140

  No H/Q in entry =           5
  In of MODEL    1
    1    H    LYS 788           H        LYS 788  19.745  -5.490  -5.482
    2    HA   LYS 788           HA       LYS 788  21.055  -7.901  -4.452
    3    HB2  LYS 788           HB2      LYS 788  20.753  -8.888  -6.631
    4    HB3  LYS 788           HB3      LYS 788  19.209  -8.251  -6.098
    5    HG2  LYS 788           HG2      LYS 788  19.580  -6.278  -7.536
    6    HG3  LYS 788           HG3      LYS 788  21.082  -7.008  -8.098
    7    HD2  LYS 788           HD2      LYS 788  19.753  -8.977  -8.860
    8    HD3  LYS 788           HD3      LYS 788  18.289  -8.089  -8.445
    9    HE2  LYS 788           HE2      LYS 788  20.360  -7.323 -10.497
   10    HE3  LYS 788           HE3      LYS 788  18.707  -7.851 -10.800
   11    HZ1  LYS 788           HZ1      LYS 788  17.967  -5.784  -9.600
   12    HZ3  LYS 788           HZ2      LYS 788  18.830  -5.492 -11.006
   13    HZ2  LYS 788           HZ3      LYS 788  19.598  -5.311  -9.554

  No H/Q in entry =          13
  In of MODEL    1
    1    H    CYS 789           H        CYS 789  22.959  -8.566  -5.785
    2    HA   CYS 789           HA       CYS 789  24.528  -6.218  -6.563
    3    HB2  CYS 789           HB2      CYS 789  25.318  -7.507  -4.522
    4    HB3  CYS 789           HB3      CYS 789  25.533  -8.899  -5.566

  No H/Q in entry =           4
  In of MODEL    1
    1    H    VAL 790           H        VAL 790  25.272  -6.307  -8.629
    2    HA   VAL 790           HA       VAL 790  24.459  -8.682 -10.103
    3    HB   VAL 790           HB       VAL 790  23.420  -6.523 -10.788
    4   HG13  VAL 790          HG11      VAL 790  25.198  -4.963 -10.367
    5   HG12  VAL 790          HG12      VAL 790  24.736  -4.869 -12.070
    6   HG11  VAL 790          HG13      VAL 790  26.203  -5.723 -11.597
    7   HG21  VAL 790          HG21      VAL 790  23.559  -8.323 -12.393
    8   HG23  VAL 790          HG22      VAL 790  25.169  -7.790 -12.885
    9   HG22  VAL 790          HG23      VAL 790  23.765  -6.770 -13.198

  No H/Q in entry =           9
  In of MODEL    1
    1    H    CYS 791           H        CYS 791  25.915  -9.609 -11.508
    2    HA   CYS 791           HA       CYS 791  28.652  -9.130 -10.654
    3    HB2  CYS 791           HB2      CYS 791  27.608 -11.471 -12.267
    4    HB3  CYS 791           HB3      CYS 791  29.087 -11.342 -11.336

  No H/Q in entry =           4
  In of MODEL    1
    1    H    ARG 792           H        ARG 792  30.062  -8.389 -12.053
    2    HA   ARG 792           HA       ARG 792  28.976  -7.285 -14.498
    3    HB2  ARG 792           HB2      ARG 792  31.813  -7.016 -13.497
    4    HB3  ARG 792           HB3      ARG 792  30.908  -5.899 -14.510
    5    HG2  ARG 792           HG2      ARG 792  30.437  -6.420 -11.570
    6    HG3  ARG 792           HG3      ARG 792  31.216  -5.001 -12.256
    7    HD2  ARG 792           HD2      ARG 792  28.359  -5.806 -12.842
    8    HD3  ARG 792           HD3      ARG 792  28.816  -4.701 -11.551
    9    HE   ARG 792           HE       ARG 792  29.721  -4.043 -14.232
   10   HH11  ARG 792          HH11      ARG 792  27.133  -3.555 -11.860
   11   HH12  ARG 792          HH12      ARG 792  26.761  -1.983 -12.399
   12   HH21  ARG 792          HH21      ARG 792  29.254  -1.921 -14.918
   13   HH22  ARG 792          HH22      ARG 792  28.002  -1.006 -14.169

  No H/Q in entry =          13
  In of MODEL    1
    1    H    GLU 793           H        GLU 793  30.758  -7.434 -16.366
    2    HA   GLU 793           HA       GLU 793  31.470 -10.256 -16.489
    3    HB2  GLU 793           HB2      GLU 793  31.067  -8.315 -18.776
    4    HB3  GLU 793           HB3      GLU 793  31.435 -10.028 -18.914
    5    HG2  GLU 793           HG2      GLU 793  29.305 -10.567 -17.817
    6    HG3  GLU 793           HG3      GLU 793  28.919  -8.849 -17.760

  No H/Q in entry =           6
  In of MODEL    1
    1    H    ALA 794           H        ALA 794  33.389 -10.311 -18.348
    2    HA   ALA 794           HA       ALA 794  35.602  -9.526 -16.785
    3    HB3  ALA 794           HB1      ALA 794  36.963 -10.510 -18.524
    4    HB1  ALA 794           HB2      ALA 794  35.583 -10.518 -19.628
    5    HB2  ALA 794           HB3      ALA 794  35.566 -11.531 -18.181

  No H/Q in entry =           5
  In of MODEL    1
    1    H    SER 795           H        SER 795  33.901  -8.041 -19.354
    2    HA   SER 795           HA       SER 795  35.954  -6.344 -20.269
    3    HB2  SER 795           HB2      SER 795  33.905  -7.005 -21.576
    4    HB3  SER 795           HB3      SER 795  32.972  -5.916 -20.556
    5    HG   SER 795           HG       SER 795  35.005  -4.507 -21.422

  No H/Q in entry =           5
  In of MODEL    1
    1    H    GLU 796           H        GLU 796  34.376  -6.272 -17.294
    2    HA   GLU 796           HA       GLU 796  34.793  -3.372 -17.123
    3    HB2  GLU 796           HB2      GLU 796  32.909  -5.093 -15.543
    4    HB3  GLU 796           HB3      GLU 796  33.302  -3.437 -15.108
    5    HG2  GLU 796           HG2      GLU 796  32.518  -2.740 -17.352
    6    HG3  GLU 796           HG3      GLU 796  31.948  -4.392 -17.607

  No H/Q in entry =           6
  In of MODEL    1
    1    H    CYS 797           H        CYS 797  36.643  -5.655 -16.731
    2    HA   CYS 797           HA       CYS 797  37.405  -5.759 -14.000
    3    HB2  CYS 797           HB2      CYS 797  38.059  -7.440 -15.678
    4    HB3  CYS 797           HB3      CYS 797  39.034  -6.223 -16.496

  No H/Q in entry =           4
  In of MODEL    1
    1    H    GLU 798           H        GLU 798  37.928  -3.967 -12.961
    2    HA   GLU 798           HA       GLU 798  39.586  -1.963 -14.316
    3    HB2  GLU 798           HB2      GLU 798  37.343  -1.153 -13.838
    4    HB3  GLU 798           HB3      GLU 798  37.488  -1.618 -12.160
    5    HG2  GLU 798           HG2      GLU 798  39.251   0.479 -13.399
    6    HG3  GLU 798           HG3      GLU 798  37.662   0.858 -12.751

  No H/Q in entry =           6
  In of MODEL    1
    1    H    GLU 799           H        GLU 799  38.967  -3.514 -11.205
    2    HA   GLU 799           HA       GLU 799  41.270  -2.458  -9.914
    3    HB2  GLU 799           HB2      GLU 799  39.276  -3.298  -8.697
    4    HB3  GLU 799           HB3      GLU 799  39.602  -4.918  -9.280
    5    HG2  GLU 799           HG2      GLU 799  40.278  -4.635  -6.957
    6    HG3  GLU 799           HG3      GLU 799  41.656  -4.993  -7.991

  No H/Q in entry =           6
  In of MODEL    1
    1    H    GLU 800           H        GLU 800  43.113  -3.860  -9.169
    2    HA   GLU 800           HA       GLU 800  44.721  -4.653 -11.203
    3    HB2  GLU 800           HB2      GLU 800  44.779  -5.853  -8.433
    4    HB3  GLU 800           HB3      GLU 800  46.065  -5.992  -9.614
    5    HG2  GLU 800           HG2      GLU 800  46.162  -3.452  -9.574
    6    HG3  GLU 800           HG3      GLU 800  45.150  -3.554  -8.129

  No H/Q in entry =           6
  In of MODEL    1
    1    H    GLY 801           H        GLY 801  43.345  -7.194  -9.100
    2    HA3  GLY 801           HA2      GLY 801  42.493  -9.210  -9.622
    3    HA2  GLY 801           HA3      GLY 801  42.399  -8.703 -11.303

  No H/Q in entry =           3
  In of MODEL    1
    1    H    PHE 802           H        PHE 802  43.761 -10.849  -9.295
    2    HA   PHE 802           HA       PHE 802  46.334 -11.083 -10.494
    3    HB2  PHE 802           HB2      PHE 802  44.752 -12.777  -8.607
    4    HB3  PHE 802           HB3      PHE 802  46.227 -13.400  -9.337
    5    HD1  PHE 802           HD1      PHE 802  45.515  -9.937  -8.178
    6    HD2  PHE 802           HD2      PHE 802  47.680 -13.534  -7.549
    7    HE1  PHE 802           HE1      PHE 802  46.857  -8.830  -6.479
    8    HE2  PHE 802           HE2      PHE 802  49.005 -12.475  -5.865
    9    HZ   PHE 802           HZ       PHE 802  48.630 -10.085  -5.295

  No H/Q in entry =           9
  In of MODEL    1
    1    H    SER 803           H        SER 803  46.928 -13.407 -11.327
    2    HA   SER 803           HA       SER 803  44.980 -14.128 -13.345
    3    HB2  SER 803           HB2      SER 803  47.128 -14.946 -14.517
    4    HB3  SER 803           HB3      SER 803  46.805 -13.212 -14.476
    5    HG   SER 803           HG       SER 803  48.972 -14.275 -13.759

  No H/Q in entry =           5
  In of MODEL    1
    1    H    ILE 804           H        ILE 804  44.162 -16.079 -13.117
    2    HA   ILE 804           HA       ILE 804  45.665 -18.006 -11.524
    3    HB   ILE 804           HB       ILE 804  43.703 -18.836 -10.390
    4   HG12  ILE 804          HG12      ILE 804  41.981 -18.321 -12.145
    5   HG13  ILE 804          HG13      ILE 804  41.474 -17.879 -10.524
    6   HG21  ILE 804          HG21      ILE 804  44.895 -17.100  -9.251
    7   HG23  ILE 804          HG22      ILE 804  43.170 -16.951  -8.910
    8   HG22  ILE 804          HG23      ILE 804  43.936 -15.867 -10.073
    9   HD13  ILE 804          HD11      ILE 804  40.779 -16.211 -12.112
   10   HD12  ILE 804          HD12      ILE 804  42.417 -16.017 -12.698
   11   HD11  ILE 804          HD13      ILE 804  42.011 -15.524 -11.052

  No H/Q in entry =          11
  In of MODEL    1
    1    H    CYS 805           H        CYS 805  44.693 -20.213 -11.709
    2    HA   CYS 805           HA       CYS 805  44.276 -20.760 -14.547
    3    HB2  CYS 805           HB2      CYS 805  46.330 -21.682 -13.401
    4    HB3  CYS 805           HB3      CYS 805  45.274 -22.585 -12.325

  No H/Q in entry =           4
  In of MODEL    1
    1    H    VAL 806           H        VAL 806  42.211 -21.229 -15.012
    2    HA   VAL 806           HA       VAL 806  40.802 -22.819 -13.038
    3    HB   VAL 806           HB       VAL 806  40.114 -20.412 -12.883
    4   HG12  VAL 806          HG11      VAL 806  38.805 -19.437 -14.644
    5   HG11  VAL 806          HG12      VAL 806  39.280 -20.788 -15.687
    6   HG13  VAL 806          HG13      VAL 806  40.500 -19.705 -15.037
    7   HG22  VAL 806          HG21      VAL 806  37.730 -20.770 -12.922
    8   HG21  VAL 806          HG22      VAL 806  38.503 -22.245 -12.313
    9   HG23  VAL 806          HG23      VAL 806  37.920 -22.179 -13.962

  No H/Q in entry =           9
  In of MODEL    1
    1    H    GLU 807           H        GLU 807  39.617 -24.420 -13.852
    2    HA   GLU 807           HA       GLU 807  39.895 -24.983 -16.675
    3    HB2  GLU 807           HB2      GLU 807  40.335 -26.734 -14.987
    4    HB3  GLU 807           HB3      GLU 807  38.669 -26.611 -14.446
    5    HG2  GLU 807           HG2      GLU 807  38.048 -27.145 -16.857
    6    HG3  GLU 807           HG3      GLU 807  39.735 -27.644 -17.028

  No H/Q in entry =           6
  In of MODEL    1
    1    H    VAL 808           H        VAL 808  38.413 -23.844 -17.876
    2    HA   VAL 808           HA       VAL 808  35.657 -24.127 -17.139
    3    HB   VAL 808           HB       VAL 808  35.227 -22.143 -18.174
    4   HG12  VAL 808          HG11      VAL 808  37.608 -21.651 -16.424
    5   HG11  VAL 808          HG12      VAL 808  35.960 -21.910 -15.889
    6   HG13  VAL 808          HG13      VAL 808  36.370 -20.443 -16.795
    7   HG21  VAL 808          HG21      VAL 808  36.698 -22.208 -20.010
    8   HG23  VAL 808          HG22      VAL 808  38.109 -21.844 -18.999
    9   HG22  VAL 808          HG23      VAL 808  36.847 -20.618 -19.257

  No H/Q in entry =           9
  In of MODEL    1
    1    H    ASN 809           H        ASN 809  34.395 -24.712 -18.903
    2    HA   ASN 809           HA       ASN 809  33.831 -25.490 -20.875
    3    HB2  ASN 809           HB2      ASN 809  36.169 -23.865 -21.710
    4    HB3  ASN 809           HB3      ASN 809  35.401 -24.909 -22.892
    5   HD21  ASN 809          HD21      ASN 809  35.138 -22.039 -20.969
    6   HD22  ASN 809          HD22      ASN 809  33.665 -21.466 -21.650

  No H/Q in entry =           6
  In of MODEL    1
    1    H    GLY 810           H        GLY 810  36.021 -26.829 -19.165
    2    HA3  GLY 810           HA2      GLY 810  36.792 -29.028 -19.255
    3    HA2  GLY 810           HA3      GLY 810  36.501 -29.032 -20.994

  No H/Q in entry =           3
  In of MODEL    1
    1    H    LYS 811           H        LYS 811  38.064 -26.215 -20.282
    2    HA   LYS 811           HA       LYS 811  40.727 -27.405 -20.753
    3    HB2  LYS 811           HB2      LYS 811  39.616 -24.806 -21.766
    4    HB3  LYS 811           HB3      LYS 811  41.258 -25.403 -21.960
    5    HG2  LYS 811           HG2      LYS 811  40.544 -27.162 -23.409
    6    HG3  LYS 811           HG3      LYS 811  38.842 -26.844 -23.059
    7    HD2  LYS 811           HD2      LYS 811  39.535 -25.976 -25.269
    8    HD3  LYS 811           HD3      LYS 811  38.987 -24.695 -24.187
    9    HE2  LYS 811           HE2      LYS 811  41.312 -24.130 -23.679
   10    HE3  LYS 811           HE3      LYS 811  41.859 -25.431 -24.736
   11    HZ2  LYS 811           HZ1      LYS 811  41.937 -23.258 -25.821
   12    HZ1  LYS 811           HZ2      LYS 811  40.280 -23.072 -25.611
   13    HZ3  LYS 811           HZ3      LYS 811  40.876 -24.307 -26.590

  No H/Q in entry =          13
  In of MODEL    1
    1    H    GLU 812           H        GLU 812  42.460 -26.306 -19.830
    2    HA   GLU 812           HA       GLU 812  41.725 -24.697 -17.525
    3    HB2  GLU 812           HB2      GLU 812  44.467 -25.666 -18.348
    4    HB3  GLU 812           HB3      GLU 812  44.022 -24.963 -16.804
    5    HG2  GLU 812           HG2      GLU 812  44.096 -27.231 -16.285
    6    HG3  GLU 812           HG3      GLU 812  42.393 -26.927 -16.699

  No H/Q in entry =           6
  In of MODEL    1
    1    H    GLN 813           H        GLN 813  41.517 -22.658 -17.839
    2    HA   GLN 813           HA       GLN 813  43.292 -21.368 -19.766
    3    HB2  GLN 813           HB2      GLN 813  41.114 -21.341 -20.665
    4    HB3  GLN 813           HB3      GLN 813  40.391 -20.755 -19.159
    5    HG2  GLN 813           HG2      GLN 813  41.724 -18.701 -19.429
    6    HG3  GLN 813           HG3      GLN 813  42.261 -19.266 -21.004
    7   HE21  GLN 813          HE21      GLN 813  39.563 -20.420 -21.614
    8   HE22  GLN 813          HE22      GLN 813  38.568 -19.055 -21.936

  No H/Q in entry =           8
  In of MODEL    1
    1    H    THR 814           H        THR 814  44.431 -19.733 -19.060
    2    HA   THR 814           HA       THR 814  44.278 -18.899 -16.288
    3    HB   THR 814           HB       THR 814  45.770 -17.643 -18.518
    4    HG1  THR 814           HG1      THR 814  47.538 -19.032 -17.991
    5   HG21  THR 814          HG21      THR 814  46.334 -17.817 -15.562
    6   HG23  THR 814          HG22      THR 814  45.798 -16.398 -16.458
    7   HG22  THR 814          HG23      THR 814  47.412 -17.057 -16.735

  No H/Q in entry =           7
  In of MODEL    1
    1    H    MET 815           H        MET 815  42.944 -17.387 -15.772
    2    HA   MET 815           HA       MET 815  42.489 -15.267 -17.686
    3    HB2  MET 815           HB2      MET 815  40.112 -15.155 -16.875
    4    HB3  MET 815           HB3      MET 815  40.488 -16.496 -17.937
    5    HG2  MET 815           HG2      MET 815  40.747 -17.896 -16.080
    6    HG3  MET 815           HG3      MET 815  40.286 -16.653 -14.943
    7    HE3  MET 815           HE1      MET 815  38.996 -17.825 -18.518
    8    HE2  MET 815           HE2      MET 815  37.648 -18.854 -18.005
    9    HE1  MET 815           HE3      MET 815  39.298 -19.217 -17.485

  No H/Q in entry =           9
  In of MODEL    1
    1    H    SER 816           H        SER 816  41.336 -13.436 -16.491
    2    HA   SER 816           HA       SER 816  43.100 -12.909 -14.293
    3    HB2  SER 816           HB2      SER 816  41.039 -11.122 -15.602
    4    HB3  SER 816           HB3      SER 816  42.338 -10.617 -14.521
    5    HG   SER 816           HG       SER 816  42.396 -10.904 -17.136

  No H/Q in entry =           5
  In of MODEL    1
    1    H    GLU 817           H        GLU 817  42.389 -12.267 -12.323
    2    HA   GLU 817           HA       GLU 817  40.580 -13.826 -10.990
    3    HB2  GLU 817           HB2      GLU 817  42.532 -12.452 -10.207
    4    HB3  GLU 817           HB3      GLU 817  41.428 -11.084 -10.281
    5    HG2  GLU 817           HG2      GLU 817  40.177 -11.818  -8.533
    6    HG3  GLU 817           HG3      GLU 817  40.844 -13.467  -8.644

  No H/Q in entry =           6
  In of MODEL    1
    1    H    CYS 818           H        CYS 818  40.144 -10.577 -12.260
    2    HA   CYS 818           HA       CYS 818  37.576 -10.091 -11.251
    3    HB2  CYS 818           HB2      CYS 818  37.559  -8.424 -13.211
    4    HB3  CYS 818           HB3      CYS 818  38.804  -8.234 -11.977

  No H/Q in entry =           4
  In of MODEL    1
    1    H    GLU 819           H        GLU 819  38.727 -11.866 -14.006
    2    HA   GLU 819           HA       GLU 819  36.210 -11.977 -15.397
    3    HB2  GLU 819           HB2      GLU 819  38.403 -11.938 -16.542
    4    HB3  GLU 819           HB3      GLU 819  38.790 -13.442 -15.729
    5    HG2  GLU 819           HG2      GLU 819  37.285 -14.666 -16.995
    6    HG3  GLU 819           HG3      GLU 819  36.503 -13.221 -17.638

  No H/Q in entry =           6
  In of MODEL    1
    1    H    ALA 820           H        ALA 820  38.384 -14.336 -13.863
    2    HA   ALA 820           HA       ALA 820  36.674 -16.512 -13.917
    3    HB2  ALA 820           HB1      ALA 820  38.038 -17.454 -12.096
    4    HB3  ALA 820           HB2      ALA 820  38.765 -15.863 -11.856
    5    HB1  ALA 820           HB3      ALA 820  39.020 -16.732 -13.371

  No H/Q in entry =           5
  In of MODEL    1
    1    H    GLY 821           H        GLY 821  37.087 -13.949 -11.531
    2    HA3  GLY 821           HA2      GLY 821  35.315 -14.938  -9.585
    3    HA2  GLY 821           HA3      GLY 821  35.872 -13.271  -9.732

  No H/Q in entry =           3
  In of MODEL    1
    1    H    ALA 822           H        ALA 822  34.859 -12.734 -12.341
    2    HA   ALA 822           HA       ALA 822  32.210 -12.046 -11.763
    3    HB3  ALA 822           HB1      ALA 822  32.045 -11.445 -14.128
    4    HB1  ALA 822           HB2      ALA 822  33.538 -12.323 -14.460
    5    HB2  ALA 822           HB3      ALA 822  33.571 -10.876 -13.451

  No H/Q in entry =           5
  In of MODEL    1
    1    H    LEU 823           H        LEU 823  33.630 -14.659 -13.610
    2    HA   LEU 823           HA       LEU 823  31.288 -15.878 -14.470
    3    HB2  LEU 823           HB2      LEU 823  34.074 -16.861 -14.056
    4    HB3  LEU 823           HB3      LEU 823  32.811 -18.008 -14.277
    5    HG   LEU 823           HG       LEU 823  32.192 -17.144 -16.423
    6   HD13  LEU 823          HD11      LEU 823  32.518 -14.840 -16.164
    7   HD12  LEU 823          HD12      LEU 823  33.412 -15.410 -17.570
    8   HD11  LEU 823          HD13      LEU 823  34.281 -15.017 -16.072
    9   HD22  LEU 823          HD21      LEU 823  34.155 -17.695 -17.685
   10   HD21  LEU 823          HD22      LEU 823  33.912 -18.777 -16.318
   11   HD23  LEU 823          HD23      LEU 823  35.167 -17.518 -16.237

  No H/Q in entry =          11
  In of MODEL    1
    1    H    ARG 824           H        ARG 824  33.125 -16.425 -11.526
    2    HA   ARG 824           HA       ARG 824  31.454 -18.514 -10.576
    3    HB2  ARG 824           HB2      ARG 824  33.821 -18.048  -9.832
    4    HB3  ARG 824           HB3      ARG 824  33.198 -16.700  -8.903
    5    HG2  ARG 824           HG2      ARG 824  31.916 -18.170  -7.506
    6    HG3  ARG 824           HG3      ARG 824  32.332 -19.561  -8.507
    7    HD2  ARG 824           HD2      ARG 824  33.761 -19.693  -6.630
    8    HD3  ARG 824           HD3      ARG 824  34.737 -19.089  -7.942
    9    HE   ARG 824           HE       ARG 824  33.938 -16.802  -6.798
   10   HH11  ARG 824          HH11      ARG 824  35.451 -19.698  -5.389
   11   HH12  ARG 824          HH12      ARG 824  36.247 -18.853  -4.135
   12   HH21  ARG 824          HH21      ARG 824  35.020 -15.656  -5.028
   13   HH22  ARG 824          HH22      ARG 824  35.920 -16.522  -3.901

  No H/Q in entry =          13
  In of MODEL    1
    1    H    CYS 825           H        CYS 825  31.212 -15.102 -10.472
    2    HA   CYS 825           HA       CYS 825  29.215 -15.002  -8.405
    3    HB2  CYS 825           HB2      CYS 825  30.827 -13.116  -8.975
    4    HB3  CYS 825           HB3      CYS 825  29.938 -12.913 -10.465

  No H/Q in entry =           4
  In of MODEL    1
    1    H    ARG 826           H        ARG 826  29.285 -14.705 -11.968
    2    HA   ARG 826           HA       ARG 826  26.505 -14.245 -12.201
    3    HB2  ARG 826           HB2      ARG 826  26.804 -14.575 -14.629
    4    HB3  ARG 826           HB3      ARG 826  27.905 -13.377 -13.934
    5    HG2  ARG 826           HG2      ARG 826  29.652 -15.065 -13.985
    6    HG3  ARG 826           HG3      ARG 826  28.540 -16.206 -14.754
    7    HD2  ARG 826           HD2      ARG 826  29.472 -13.548 -15.876
    8    HD3  ARG 826           HD3      ARG 826  29.940 -15.155 -16.432
    9    HE   ARG 826           HE       ARG 826  27.327 -15.279 -16.644
   10   HH11  ARG 826          HH11      ARG 826  29.676 -12.991 -18.010
   11   HH12  ARG 826          HH12      ARG 826  28.622 -12.326 -19.153
   12   HH21  ARG 826          HH21      ARG 826  25.845 -14.380 -18.262
   13   HH22  ARG 826          HH22      ARG 826  26.383 -13.175 -19.322

  No H/Q in entry =          13
  In of MODEL    1
    1    H    GLY 827           H        GLY 827  28.379 -17.201 -12.314
    2    HA3  GLY 827           HA2      GLY 827  26.933 -19.117 -11.602
    3    HA2  GLY 827           HA3      GLY 827  25.812 -18.545 -12.831

  No H/Q in entry =           3
  In of MODEL    1
    1    H    GLN 828           H        GLN 828  28.839 -18.080 -14.006
    2    HA   GLN 828           HA       GLN 828  28.752 -20.231 -15.881
    3    HB2  GLN 828           HB2      GLN 828  30.015 -18.133 -16.268
    4    HB3  GLN 828           HB3      GLN 828  31.122 -18.610 -14.990
    5    HG2  GLN 828           HG2      GLN 828  32.173 -19.191 -17.041
    6    HG3  GLN 828           HG3      GLN 828  31.628 -20.688 -16.296
    7   HE21  GLN 828          HE21      GLN 828  29.668 -18.363 -18.037
    8   HE22  GLN 828          HE22      GLN 828  29.252 -19.424 -19.332

  No H/Q in entry =           8
  In of MODEL    1
    1    H    SER 829           H        SER 829  29.636 -22.263 -15.750
    2    HA   SER 829           HA       SER 829  30.403 -23.165 -13.130
    3    HB2  SER 829           HB2      SER 829  30.319 -24.648 -15.773
    4    HB3  SER 829           HB3      SER 829  30.444 -25.381 -14.172
    5    HG   SER 829           HG       SER 829  28.322 -23.625 -14.570

  No H/Q in entry =           5
  In of MODEL    1
    1    H    ILE 830           H        ILE 830  32.426 -22.942 -12.418
    2    HA   ILE 830           HA       ILE 830  34.639 -23.212 -14.293
    3    HB   ILE 830           HB       ILE 830  35.869 -21.357 -13.352
    4   HG12  ILE 830          HG12      ILE 830  34.893 -21.448 -11.029
    5   HG13  ILE 830          HG13      ILE 830  35.078 -19.816 -11.605
    6   HG22  ILE 830          HG21      ILE 830  33.131 -20.428 -14.132
    7   HG21  ILE 830          HG22      ILE 830  34.449 -20.811 -15.224
    8   HG23  ILE 830          HG23      ILE 830  34.584 -19.434 -14.126
    9   HD13  ILE 830          HD11      ILE 830  33.011 -20.051 -10.451
   10   HD12  ILE 830          HD12      ILE 830  32.533 -21.408 -11.474
   11   HD11  ILE 830          HD13      ILE 830  32.696 -19.789 -12.166

  No H/Q in entry =          11
  In of MODEL    1
    1    H    SER 831           H        SER 831  36.304 -24.327 -13.541
    2    HA   SER 831           HA       SER 831  36.138 -25.136 -10.751
    3    HB2  SER 831           HB2      SER 831  37.204 -26.548 -13.170
    4    HB3  SER 831           HB3      SER 831  37.375 -27.133 -11.515
    5    HG   SER 831           HG       SER 831  35.044 -27.062 -11.428

  No H/Q in entry =           5
  In of MODEL    1
    1    H    VAL 832           H        VAL 832  37.505 -23.677  -9.797
    2    HA   VAL 832           HA       VAL 832  39.944 -22.849 -10.978
    3    HB   VAL 832           HB       VAL 832  38.859 -21.409  -9.316
    4   HG13  VAL 832          HG11      VAL 832  37.846 -23.044  -7.863
    5   HG12  VAL 832          HG12      VAL 832  38.840 -21.932  -6.921
    6   HG11  VAL 832          HG13      VAL 832  39.434 -23.551  -7.285
    7   HG23  VAL 832          HG21      VAL 832  40.790 -20.858  -7.888
    8   HG22  VAL 832          HG22      VAL 832  41.259 -21.143  -9.564
    9   HG21  VAL 832          HG23      VAL 832  41.544 -22.386  -8.345

  No H/Q in entry =           9
  In of MODEL    1
    1    H    THR 833           H        THR 833  41.743 -23.938 -11.221
    2    HA   THR 833           HA       THR 833  41.969 -26.473  -9.863
    3    HB   THR 833           HB       THR 833  43.884 -26.798 -11.460
    4    HG1  THR 833           HG1      THR 833  43.870 -25.121 -13.205
    5   HG21  THR 833          HG21      THR 833  41.599 -27.540 -12.073
    6   HG23  THR 833          HG22      THR 833  42.485 -26.984 -13.491
    7   HG22  THR 833          HG23      THR 833  41.270 -25.949 -12.754

  No H/Q in entry =           7
  In of MODEL    1
    1    H    SER 834           H        SER 834  43.526 -23.341 -10.109
    2    HA   SER 834           HA       SER 834  44.889 -23.685  -7.635
    3    HB2  SER 834           HB2      SER 834  47.162 -23.292  -8.768
    4    HB3  SER 834           HB3      SER 834  46.482 -24.924  -8.853
    5    HG   SER 834           HG       SER 834  45.532 -24.038 -10.911

  No H/Q in entry =           5
  In of MODEL    1
    1    H    ILE 835           H        ILE 835  46.194 -21.695  -7.130
    2    HA   ILE 835           HA       ILE 835  44.844 -19.440  -8.333
    3    HB   ILE 835           HB       ILE 835  45.723 -18.085  -6.405
    4   HG12  ILE 835          HG12      ILE 835  46.306 -19.490  -4.330
    5   HG13  ILE 835          HG13      ILE 835  46.733 -20.766  -5.456
    6   HG22  ILE 835          HG21      ILE 835  44.196 -19.005  -4.761
    7   HG21  ILE 835          HG22      ILE 835  44.066 -20.475  -5.732
    8   HG23  ILE 835          HG23      ILE 835  43.488 -18.935  -6.383
    9   HD12  ILE 835          HD11      ILE 835  48.659 -19.531  -4.686
   10   HD11  ILE 835          HD12      ILE 835  47.910 -18.038  -5.284
   11   HD13  ILE 835          HD13      ILE 835  48.416 -19.286  -6.427

  No H/Q in entry =          11
  In of MODEL    1
    1    H    ARG 836           H        ARG 836  47.253 -21.046  -9.198
    2    HA   ARG 836           HA       ARG 836  49.119 -18.884  -9.839
    3    HB2  ARG 836           HB2      ARG 836  49.237 -21.855 -10.298
    4    HB3  ARG 836           HB3      ARG 836  50.501 -20.727 -10.760
    5    HG2  ARG 836           HG2      ARG 836  50.714 -20.094  -8.394
    6    HG3  ARG 836           HG3      ARG 836  49.556 -21.366  -8.001
    7    HD2  ARG 836           HD2      ARG 836  52.208 -21.707  -9.360
    8    HD3  ARG 836           HD3      ARG 836  51.761 -22.102  -7.694
    9    HE   ARG 836           HE       ARG 836  50.147 -23.416  -9.670
   10   HH11  ARG 836          HH11      ARG 836  53.214 -23.661  -7.931
   11   HH12  ARG 836          HH12      ARG 836  53.322 -25.353  -8.077
   12   HH21  ARG 836          HH21      ARG 836  50.314 -25.672  -9.948
   13   HH22  ARG 836          HH22      ARG 836  51.621 -26.555  -9.297

  No H/Q in entry =          13
  In of MODEL    1
    1    HA   PRO 837           HA       PRO 837  47.264 -18.895 -13.973
    2    HB2  PRO 837           HB2      PRO 837  49.403 -18.644 -15.650
    3    HB3  PRO 837           HB3      PRO 837  48.782 -17.302 -14.686
    4    HG2  PRO 837           HG2      PRO 837  51.108 -19.106 -14.137
    5    HG3  PRO 837           HG3      PRO 837  50.995 -17.345 -13.966
    6    HD2  PRO 837           HD2      PRO 837  50.785 -18.987 -11.848
    7    HD3  PRO 837           HD3      PRO 837  49.851 -17.483 -11.961

  No H/Q in entry =           7
  In of MODEL    1
    1    H    CYS 838           H        CYS 838  47.095 -20.163 -16.023
    2    HA   CYS 838           HA       CYS 838  47.911 -22.949 -15.679
    3    HB2  CYS 838           HB2      CYS 838  46.228 -21.618 -17.836
    4    HB3  CYS 838           HB3      CYS 838  46.524 -23.331 -17.721

  No H/Q in entry =           4
  In of MODEL    1
    1    H    ALA 839           H        ALA 839  48.725 -23.968 -17.755
    2    HA   ALA 839           HA       ALA 839  50.769 -22.301 -18.988
    3    HB3  ALA 839           HB1      ALA 839  51.328 -24.574 -18.196
    4    HB2  ALA 839           HB2      ALA 839  51.556 -24.426 -19.938
    5    HB1  ALA 839           HB3      ALA 839  50.131 -25.245 -19.300

  No H/Q in entry =           5
  In of MODEL    1
    1    H    ALA 840           H        ALA 840  47.926 -21.904 -19.476
    2    HA   ALA 840           HA       ALA 840  47.235 -22.748 -22.112
    3    HB2  ALA 840           HB1      ALA 840  45.439 -21.075 -21.935
    4    HB3  ALA 840           HB2      ALA 840  46.189 -20.431 -20.477
    5    HB1  ALA 840           HB3      ALA 840  45.529 -22.063 -20.476

  No H/Q in entry =           5
  In of MODEL    1
    1    H    GLU 841           H        GLU 841  48.852 -20.094 -20.690
    2    HA   GLU 841           HA       GLU 841  49.112 -18.754 -23.220
    3    HB2  GLU 841           HB2      GLU 841  50.251 -16.967 -21.822
    4    HB3  GLU 841           HB3      GLU 841  48.546 -17.253 -21.492
    5    HG2  GLU 841           HG2      GLU 841  49.154 -18.504 -19.487
    6    HG3  GLU 841           HG3      GLU 841  50.865 -18.255 -19.845

  No H/Q in entry =           6
  In of MODEL    1
    1    H    THR 842           H        THR 842  50.418 -20.094 -24.325
    2    HA   THR 842           HA       THR 842  53.221 -19.838 -23.742
    3    HB   THR 842           HB       THR 842  52.063 -22.608 -24.144
    4    HG1  THR 842           HG1      THR 842  52.300 -21.147 -21.914
    5   HG21  THR 842          HG21      THR 842  54.320 -22.314 -25.049
    6   HG23  THR 842          HG22      THR 842  54.362 -23.359 -23.628
    7   HG22  THR 842          HG23      THR 842  54.870 -21.678 -23.500

  No H/Q in entry =           7
  In of MODEL    1
    1    H    GLN 843           H        GLN 843  53.915 -19.093 -25.535
    2    HA   GLN 843           HA       GLN 843  53.058 -20.243 -28.077
    3    HB2  GLN 843           HB2      GLN 843  52.363 -17.908 -27.912
    4    HB3  GLN 843           HB3      GLN 843  53.975 -17.441 -27.400
    5    HG2  GLN 843           HG2      GLN 843  53.632 -16.794 -29.682
    6    HG3  GLN 843           HG3      GLN 843  54.843 -18.064 -29.611
    7   HE21  GLN 843          HE21      GLN 843  53.250 -17.173 -31.809
    8   HE22  GLN 843          HE22      GLN 843  52.365 -18.555 -32.375

  No H/Q in entry =           8
  In of MODEL    2
    1    H1   GLY 689           H2       GLY 689  58.869   2.810 -23.792
    2    H2   GLY 689           H1       GLY 689  58.658   2.101 -22.262
    3    H3   GLY 689           H3       GLY 689  59.175   1.179 -23.586
    4    HA2  GLY 689           HA2      GLY 689  56.552   2.440 -23.295
    5    HA3  GLY 689           HA3      GLY 689  56.893   0.713 -23.240

  No H/Q in entry =           5
  In of MODEL    2
    1    H    SER 690           H        SER 690  55.155   1.176 -25.032
    2    HA   SER 690           HA       SER 690  56.612   1.190 -27.549
    3    HB2  SER 690           HB2      SER 690  55.152  -0.751 -27.076
    4    HB3  SER 690           HB3      SER 690  53.770   0.326 -26.915
    5    HG   SER 690           HG       SER 690  54.989  -0.689 -29.129

  No H/Q in entry =           5
  In of MODEL    2
    1    H    HIS 691           H        HIS 691  54.935   3.108 -25.626
    2    HA   HIS 691           HA       HIS 691  53.757   4.764 -27.735
    3    HB2  HIS 691           HB2      HIS 691  53.454   4.898 -24.730
    4    HB3  HIS 691           HB3      HIS 691  52.683   6.015 -25.839
    5    HD1  HIS 691           HD1      HIS 691  51.732   3.384 -23.845
    6    HD2  HIS 691           HD2      HIS 691  51.197   4.140 -27.893
    7    HE1  HIS 691           HE1      HIS 691  49.811   1.948 -24.552
    8    HE2  HIS 691           HE2      HIS 691  49.413   2.523 -26.956

  No H/Q in entry =           8
  In of MODEL    2
    1    H    MET 692           H        MET 692  54.315   6.954 -27.945
    2    HA   MET 692           HA       MET 692  57.037   7.571 -27.239
    3    HB2  MET 692           HB2      MET 692  56.741   9.655 -28.458
    4    HB3  MET 692           HB3      MET 692  56.054   8.335 -29.389
    5    HG2  MET 692           HG2      MET 692  53.810   8.994 -28.710
    6    HG3  MET 692           HG3      MET 692  54.475  10.271 -27.698
    7    HE2  MET 692           HE1      MET 692  54.684  10.233 -32.319
    8    HE1  MET 692           HE2      MET 692  53.889   8.988 -31.360
    9    HE3  MET 692           HE3      MET 692  55.645   9.145 -31.318

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ASN 693           H        ASN 693  53.959   8.127 -25.938
    2    HA   ASN 693           HA       ASN 693  54.995   9.987 -23.923
    3    HB2  ASN 693           HB2      ASN 693  52.159   9.190 -24.651
    4    HB3  ASN 693           HB3      ASN 693  52.549  10.164 -23.246
    5   HD21  ASN 693          HD21      ASN 693  54.645  11.684 -24.726
    6   HD22  ASN 693          HD22      ASN 693  53.764  12.720 -25.767

  No H/Q in entry =           6
  In of MODEL    2
    1    HA   PRO 694           HA       PRO 694  55.240   6.691 -21.008
    2    HB2  PRO 694           HB2      PRO 694  54.601   7.941 -18.684
    3    HB3  PRO 694           HB3      PRO 694  56.125   8.204 -19.535
    4    HG2  PRO 694           HG2      PRO 694  53.623   9.842 -19.594
    5    HG3  PRO 694           HG3      PRO 694  55.303  10.391 -19.407
    6    HD2  PRO 694           HD2      PRO 694  54.020  10.545 -21.743
    7    HD3  PRO 694           HD3      PRO 694  55.748  10.150 -21.654

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LEU 695           H        LEU 695  52.572   6.889 -22.319
    2    HA   LEU 695           HA       LEU 695  50.674   6.162 -20.256
    3    HB2  LEU 695           HB2      LEU 695  50.537   6.096 -23.272
    4    HB3  LEU 695           HB3      LEU 695  49.318   5.294 -22.312
    5    HG   LEU 695           HG       LEU 695  48.458   7.402 -23.032
    6   HD11  LEU 695          HD11      LEU 695  47.797   6.706 -20.829
    7   HD13  LEU 695          HD12      LEU 695  47.888   8.461 -20.939
    8   HD12  LEU 695          HD13      LEU 695  49.165   7.569 -20.120
    9   HD21  LEU 695          HD21      LEU 695  50.871   8.682 -21.748
   10   HD23  LEU 695          HD22      LEU 695  49.480   9.546 -22.403
   11   HD22  LEU 695          HD23      LEU 695  50.514   8.603 -23.475

  No H/Q in entry =          11
  In of MODEL    2
    1    H    THR 696           H        THR 696  50.761   4.360 -19.269
    2    HA   THR 696           HA       THR 696  51.448   2.372 -18.583
    3    HB   THR 696           HB       THR 696  51.558   1.499 -21.510
    4    HG1  THR 696           HG1      THR 696  49.440   2.126 -19.893
    5   HG21  THR 696          HG21      THR 696  52.638  -0.005 -19.883
    6   HG23  THR 696          HG22      THR 696  51.206  -0.745 -20.590
    7   HG22  THR 696          HG23      THR 696  51.139  -0.073 -18.956

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLN 697           H        GLN 697  53.267   3.339 -17.858
    2    HA   GLN 697           HA       GLN 697  55.576   3.842 -19.413
    3    HB2  GLN 697           HB2      GLN 697  54.936   5.022 -17.292
    4    HB3  GLN 697           HB3      GLN 697  55.326   3.558 -16.410
    5    HG2  GLN 697           HG2      GLN 697  57.122   5.153 -16.201
    6    HG3  GLN 697           HG3      GLN 697  57.676   3.771 -17.134
    7   HE21  GLN 697          HE21      GLN 697  58.627   6.560 -16.997
    8   HE22  GLN 697          HE22      GLN 697  58.612   7.128 -18.627

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ALA 698           H        ALA 698  57.474   2.652 -19.575
    2    HA   ALA 698           HA       ALA 698  57.155  -0.197 -19.220
    3    HB3  ALA 698           HB1      ALA 698  59.570   1.299 -20.200
    4    HB1  ALA 698           HB2      ALA 698  58.266   0.701 -21.231
    5    HB2  ALA 698           HB3      ALA 698  59.273  -0.432 -20.328

  No H/Q in entry =           5
  In of MODEL    2
    1    H    VAL 699           H        VAL 699  56.944  -0.551 -17.232
    2    HA   VAL 699           HA       VAL 699  59.263  -0.178 -15.590
    3    HB   VAL 699           HB       VAL 699  57.738  -0.908 -13.846
    4   HG11  VAL 699          HG11      VAL 699  56.834   1.529 -15.404
    5   HG13  VAL 699          HG12      VAL 699  58.113   1.486 -14.190
    6   HG12  VAL 699          HG13      VAL 699  56.433   1.233 -13.712
    7   HG22  VAL 699          HG21      VAL 699  55.279  -0.865 -14.211
    8   HG21  VAL 699          HG22      VAL 699  56.089  -2.145 -15.118
    9   HG23  VAL 699          HG23      VAL 699  55.579  -0.670 -15.936

  No H/Q in entry =           9
  In of MODEL    2
    1    HA   PRO 700           HA       PRO 700  60.382  -4.525 -15.865
    2    HB2  PRO 700           HB2      PRO 700  60.267  -4.352 -12.874
    3    HB3  PRO 700           HB3      PRO 700  61.525  -5.047 -13.904
    4    HG2  PRO 700           HG2      PRO 700  61.886  -2.668 -12.800
    5    HG3  PRO 700           HG3      PRO 700  62.401  -2.970 -14.471
    6    HD2  PRO 700           HD2      PRO 700  60.054  -1.430 -13.461
    7    HD3  PRO 700           HD3      PRO 700  61.049  -1.168 -14.909

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LYS 701           H        LYS 701  59.294  -6.446 -15.783
    2    HA   LYS 701           HA       LYS 701  56.494  -6.140 -15.171
    3    HB2  LYS 701           HB2      LYS 701  57.929  -8.429 -16.509
    4    HB3  LYS 701           HB3      LYS 701  56.183  -8.229 -16.399
    5    HG2  LYS 701           HG2      LYS 701  58.082  -6.373 -17.779
    6    HG3  LYS 701           HG3      LYS 701  57.053  -7.570 -18.584
    7    HD2  LYS 701           HD2      LYS 701  55.066  -6.369 -17.790
    8    HD3  LYS 701           HD3      LYS 701  56.087  -5.233 -16.914
    9    HE2  LYS 701           HE2      LYS 701  56.039  -5.616 -19.904
   10    HE3  LYS 701           HE3      LYS 701  55.301  -4.286 -19.019
   11    HZ3  LYS 701           HZ1      LYS 701  57.416  -3.629 -19.924
   12    HZ2  LYS 701           HZ2      LYS 701  58.202  -4.894 -19.168
   13    HZ1  LYS 701           HZ3      LYS 701  57.559  -3.649 -18.241

  No H/Q in entry =          13
  In of MODEL    2
    1    H    CYS 702           H        CYS 702  55.989  -6.369 -13.239
    2    HA   CYS 702           HA       CYS 702  57.116  -8.527 -11.602
    3    HB2  CYS 702           HB2      CYS 702  55.319  -6.304 -10.610
    4    HB3  CYS 702           HB3      CYS 702  56.461  -7.275  -9.724

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLN 703           H        GLN 703  55.581  -9.857 -10.446
    2    HA   GLN 703           HA       GLN 703  53.189 -10.245 -11.963
    3    HB2  GLN 703           HB2      GLN 703  54.343 -11.685  -9.593
    4    HB3  GLN 703           HB3      GLN 703  52.829 -12.141 -10.363
    5    HG2  GLN 703           HG2      GLN 703  55.500 -12.008 -11.705
    6    HG3  GLN 703           HG3      GLN 703  54.703 -13.488 -11.161
    7   HE21  GLN 703          HE21      GLN 703  55.491 -12.593 -13.858
    8   HE22  GLN 703          HE22      GLN 703  54.059 -12.688 -14.821

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ARG 704           H        ARG 704  51.197 -10.822 -10.574
    2    HA   ARG 704           HA       ARG 704  50.138  -8.375  -9.732
    3    HB2  ARG 704           HB2      ARG 704  49.132 -11.181  -9.476
    4    HB3  ARG 704           HB3      ARG 704  48.205  -9.800  -8.909
    5    HG2  ARG 704           HG2      ARG 704  49.145 -10.179 -11.750
    6    HG3  ARG 704           HG3      ARG 704  47.539 -10.603 -11.152
    7    HD2  ARG 704           HD2      ARG 704  47.233  -8.274 -10.436
    8    HD3  ARG 704           HD3      ARG 704  48.797  -7.893 -11.156
    9    HE   ARG 704           HE       ARG 704  47.030  -9.118 -13.037
   10   HH11  ARG 704          HH11      ARG 704  47.793  -5.914 -11.588
   11   HH12  ARG 704          HH12      ARG 704  47.088  -5.075 -12.877
   12   HH21  ARG 704          HH21      ARG 704  46.078  -7.887 -14.720
   13   HH22  ARG 704          HH22      ARG 704  46.064  -6.189 -14.692

  No H/Q in entry =          13
  In of MODEL    2
    1    H    TRP 705           H        TRP 705  51.740 -10.796  -7.835
    2    HA   TRP 705           HA       TRP 705  50.877  -9.615  -5.289
    3    HB2  TRP 705           HB2      TRP 705  51.953 -11.666  -4.340
    4    HB3  TRP 705           HB3      TRP 705  50.594 -11.975  -5.422
    5    HD1  TRP 705           HD1      TRP 705  54.330 -12.668  -5.022
    6    HE1  TRP 705           HE1      TRP 705  55.095 -14.215  -6.891
    7    HE3  TRP 705           HE3      TRP 705  50.107 -12.645  -7.950
    8    HZ2  TRP 705           HZ2      TRP 705  54.085 -15.333  -9.264
    9    HZ3  TRP 705           HZ3      TRP 705  50.105 -14.001 -10.000
   10    HH2  TRP 705           HH2      TRP 705  52.058 -15.318 -10.641

  No H/Q in entry =          10
  In of MODEL    2
    1    H    GLU 706           H        GLU 706  52.954  -8.812  -7.475
    2    HA   GLU 706           HA       GLU 706  55.135  -8.306  -5.615
    3    HB2  GLU 706           HB2      GLU 706  55.232  -8.906  -8.563
    4    HB3  GLU 706           HB3      GLU 706  56.611  -8.281  -7.648
    5    HG2  GLU 706           HG2      GLU 706  56.453 -10.361  -6.284
    6    HG3  GLU 706           HG3      GLU 706  55.207 -10.925  -7.399

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS 707           H        LYS 707  56.338  -6.385  -6.240
    2    HA   LYS 707           HA       LYS 707  54.935  -4.438  -7.828
    3    HB2  LYS 707           HB2      LYS 707  54.918  -2.750  -6.031
    4    HB3  LYS 707           HB3      LYS 707  53.865  -4.105  -5.673
    5    HG2  LYS 707           HG2      LYS 707  55.559  -4.996  -4.135
    6    HG3  LYS 707           HG3      LYS 707  56.599  -3.614  -4.503
    7    HD2  LYS 707           HD2      LYS 707  54.869  -2.090  -3.692
    8    HD3  LYS 707           HD3      LYS 707  53.833  -3.470  -3.329
    9    HE2  LYS 707           HE2      LYS 707  55.452  -4.257  -1.683
   10    HE3  LYS 707           HE3      LYS 707  56.513  -2.908  -2.080
   11    HZ2  LYS 707           HZ1      LYS 707  53.769  -2.659  -0.929
   12    HZ1  LYS 707           HZ2      LYS 707  54.792  -1.388  -1.349
   13    HZ3  LYS 707           HZ3      LYS 707  55.233  -2.429  -0.111

  No H/Q in entry =          13
  In of MODEL    2
    1    H    LEU 708           H        LEU 708  56.283  -2.431  -7.995
    2    HA   LEU 708           HA       LEU 708  59.029  -3.293  -8.355
    3    HB2  LEU 708           HB2      LEU 708  57.895  -2.343 -10.268
    4    HB3  LEU 708           HB3      LEU 708  57.476  -0.912  -9.348
    5    HG   LEU 708           HG       LEU 708  59.950  -0.426  -9.183
    6   HD11  LEU 708          HD11      LEU 708  60.138  -2.602 -11.229
    7   HD13  LEU 708          HD12      LEU 708  60.810  -2.621  -9.594
    8   HD12  LEU 708          HD13      LEU 708  61.426  -1.480 -10.785
    9   HD22  LEU 708          HD21      LEU 708  58.522   0.757 -10.756
   10   HD21  LEU 708          HD22      LEU 708  58.721  -0.538 -11.934
   11   HD23  LEU 708          HD23      LEU 708  60.105   0.451 -11.471

  No H/Q in entry =          11
  In of MODEL    2
    1    H    GLN 709           H        GLN 709  60.589  -2.619  -7.029
    2    HA   GLN 709           HA       GLN 709  60.444   0.093  -6.030
    3    HB2  GLN 709           HB2      GLN 709  60.921  -0.388  -3.772
    4    HB3  GLN 709           HB3      GLN 709  59.642  -1.523  -4.166
    5    HG2  GLN 709           HG2      GLN 709  61.354  -3.275  -4.443
    6    HG3  GLN 709           HG3      GLN 709  62.583  -2.094  -3.959
    7   HE21  GLN 709          HE21      GLN 709  63.127  -3.261  -2.115
    8   HE22  GLN 709          HE22      GLN 709  62.106  -3.379  -0.743

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ASN 710           H        ASN 710  62.418   1.007  -5.893
    2    HA   ASN 710           HA       ASN 710  64.649   1.354  -6.255
    3    HB2  ASN 710           HB2      ASN 710  64.815  -0.703  -4.701
    4    HB3  ASN 710           HB3      ASN 710  65.057  -1.640  -6.152
    5   HD21  ASN 710          HD21      ASN 710  66.356   0.593  -4.020
    6   HD22  ASN 710          HD22      ASN 710  67.988   0.641  -4.601

  No H/Q in entry =           6
  In of MODEL    2
    1    H    SER 711           H        SER 711  64.397  -1.689  -7.816
    2    HA   SER 711           HA       SER 711  64.136  -0.612 -10.441
    3    HB2  SER 711           HB2      SER 711  66.421  -1.372 -11.188
    4    HB3  SER 711           HB3      SER 711  66.399  -0.016 -10.044
    5    HG   SER 711           HG       SER 711  67.437  -1.095  -8.702

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ARG 712           H        ARG 712  63.179  -2.783  -8.408
    2    HA   ARG 712           HA       ARG 712  63.279  -5.015 -10.226
    3    HB2  ARG 712           HB2      ARG 712  63.970  -6.554  -8.460
    4    HB3  ARG 712           HB3      ARG 712  65.226  -5.402  -8.882
    5    HG2  ARG 712           HG2      ARG 712  64.788  -4.125  -6.866
    6    HG3  ARG 712           HG3      ARG 712  63.414  -5.157  -6.490
    7    HD2  ARG 712           HD2      ARG 712  64.852  -7.080  -6.211
    8    HD3  ARG 712           HD3      ARG 712  66.241  -6.192  -6.819
    9    HE   ARG 712           HE       ARG 712  65.519  -4.766  -4.654
   10   HH11  ARG 712          HH11      ARG 712  66.079  -8.273  -5.036
   11   HH12  ARG 712          HH12      ARG 712  66.742  -8.433  -3.475
   12   HH21  ARG 712          HH21      ARG 712  66.494  -5.062  -2.554
   13   HH22  ARG 712          HH22      ARG 712  67.006  -6.619  -2.074

  No H/Q in entry =          13
  In of MODEL    2
    1    H    CYS 713           H        CYS 713  61.948  -6.791  -9.323
    2    HA   CYS 713           HA       CYS 713  59.559  -5.645  -8.182
    3    HB2  CYS 713           HB2      CYS 713  60.028  -8.274  -9.579
    4    HB3  CYS 713           HB3      CYS 713  58.466  -7.632  -9.075

  No H/Q in entry =           4
  In of MODEL    2
    1    H    VAL 714           H        VAL 714  59.058  -6.039  -6.249
    2    HA   VAL 714           HA       VAL 714  60.224  -8.291  -4.776
    3    HB   VAL 714           HB       VAL 714  60.054  -6.865  -2.735
    4   HG13  VAL 714          HG11      VAL 714  61.958  -5.388  -3.205
    5   HG12  VAL 714          HG12      VAL 714  61.696  -5.607  -4.934
    6   HG11  VAL 714          HG13      VAL 714  62.201  -6.973  -3.945
    7   HG23  VAL 714          HG21      VAL 714  59.397  -4.682  -4.695
    8   HG22  VAL 714          HG22      VAL 714  59.667  -4.460  -2.968
    9   HG21  VAL 714          HG23      VAL 714  58.266  -5.383  -3.534

  No H/Q in entry =           9
  In of MODEL    2
    1    H    CYS 715           H        CYS 715  58.660  -8.528  -2.704
    2    HA   CYS 715           HA       CYS 715  56.132  -9.028  -3.999
    3    HB2  CYS 715           HB2      CYS 715  57.222  -9.856  -1.320
    4    HB3  CYS 715           HB3      CYS 715  55.581 -10.193  -1.844

  No H/Q in entry =           4
  In of MODEL    2
    1    H    LYS 716           H        LYS 716  54.188  -8.424  -3.218
    2    HA   LYS 716           HA       LYS 716  53.907  -5.837  -2.057
    3    HB2  LYS 716           HB2      LYS 716  52.459  -6.950  -3.811
    4    HB3  LYS 716           HB3      LYS 716  51.917  -8.062  -2.581
    5    HG2  LYS 716           HG2      LYS 716  50.826  -6.224  -1.396
    6    HG3  LYS 716           HG3      LYS 716  51.392  -5.090  -2.634
    7    HD2  LYS 716           HD2      LYS 716  50.226  -6.451  -4.344
    8    HD3  LYS 716           HD3      LYS 716  49.600  -7.477  -3.064
    9    HE2  LYS 716           HE2      LYS 716  48.400  -5.586  -2.111
   10    HE3  LYS 716           HE3      LYS 716  49.067  -4.525  -3.355
   11    HZ2  LYS 716           HZ1      LYS 716  47.256  -6.841  -3.851
   12    HZ1  LYS 716           HZ2      LYS 716  47.955  -5.874  -5.026
   13    HZ3  LYS 716           HZ3      LYS 716  46.845  -5.206  -3.974

  No H/Q in entry =          13
  In of MODEL    2
    1    H    MET 717           H        MET 717  52.085  -5.939  -0.063
    2    HA   MET 717           HA       MET 717  53.153  -7.942   1.786
    3    HB2  MET 717           HB2      MET 717  52.327  -5.111   2.434
    4    HB3  MET 717           HB3      MET 717  52.917  -6.287   3.597
    5    HG2  MET 717           HG2      MET 717  54.491  -5.100   1.310
    6    HG3  MET 717           HG3      MET 717  54.641  -4.669   3.007
    7    HE2  MET 717           HE1      MET 717  54.539  -7.512   4.473
    8    HE1  MET 717           HE2      MET 717  55.717  -6.255   4.844
    9    HE3  MET 717           HE3      MET 717  56.258  -7.903   4.527

  No H/Q in entry =           9
  In of MODEL    2
    1    HA   PRO 718           HA       PRO 718  49.106  -9.516   2.273
    2    HB2  PRO 718           HB2      PRO 718  49.012 -10.055   4.973
    3    HB3  PRO 718           HB3      PRO 718  49.823 -11.068   3.774
    4    HG2  PRO 718           HG2      PRO 718  50.974  -8.945   5.549
    5    HG3  PRO 718           HG3      PRO 718  51.614 -10.570   5.202
    6    HD2  PRO 718           HD2      PRO 718  52.625  -8.426   4.015
    7    HD3  PRO 718           HD3      PRO 718  52.369  -9.923   3.091

  No H/Q in entry =           7
  In of MODEL    2
    1    H    TYR 719           H        TYR 719  49.861  -7.032   4.700
    2    HA   TYR 719           HA       TYR 719  47.116  -6.507   5.427
    3    HB2  TYR 719           HB2      TYR 719  47.977  -4.692   6.749
    4    HB3  TYR 719           HB3      TYR 719  49.238  -5.923   6.791
    5    HD1  TYR 719           HD1      TYR 719  48.447  -2.517   5.915
    6    HD2  TYR 719           HD2      TYR 719  51.210  -5.666   5.205
    7    HE1  TYR 719           HE1      TYR 719  50.020  -0.913   4.933
    8    HE2  TYR 719           HE2      TYR 719  52.781  -4.090   4.265
    9    HH   TYR 719           HH       TYR 719  52.425  -1.826   3.008

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLU 720           H        GLU 720  48.988  -5.807   2.768
    2    HA   GLU 720           HA       GLU 720  47.877  -3.193   2.098
    3    HB2  GLU 720           HB2      GLU 720  50.345  -3.794   2.256
    4    HB3  GLU 720           HB3      GLU 720  50.112  -4.820   0.867
    5    HG2  GLU 720           HG2      GLU 720  49.692  -2.908  -0.511
    6    HG3  GLU 720           HG3      GLU 720  49.731  -1.836   0.900

  No H/Q in entry =           6
  In of MODEL    2
    1    H    CYS 721           H        CYS 721  46.943  -6.211   1.845
    2    HA   CYS 721           HA       CYS 721  46.131  -6.306  -0.953
    3    HB2  CYS 721           HB2      CYS 721  45.929  -8.255   1.322
    4    HB3  CYS 721           HB3      CYS 721  45.290  -8.565  -0.286

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLY 722           H        GLY 722  43.925  -6.490  -1.560
    2    HA3  GLY 722           HA2      GLY 722  41.908  -6.280   0.533
    3    HA2  GLY 722           HA3      GLY 722  41.940  -5.050  -0.724

  No H/Q in entry =           3
  In of MODEL    2
    1    HA   PRO 723           HA       PRO 723  39.240  -7.604  -3.207
    2    HB2  PRO 723           HB2      PRO 723  40.801  -6.538  -5.506
    3    HB3  PRO 723           HB3      PRO 723  39.062  -6.468  -5.212
    4    HG2  PRO 723           HG2      PRO 723  40.522  -4.291  -4.927
    5    HG3  PRO 723           HG3      PRO 723  39.244  -4.679  -3.759
    6    HD2  PRO 723           HD2      PRO 723  42.202  -5.027  -3.504
    7    HD3  PRO 723           HD3      PRO 723  41.018  -4.411  -2.324

  No H/Q in entry =           7
  In of MODEL    2
    1    H    SER 724           H        SER 724  39.566  -9.752  -3.321
    2    HA   SER 724           HA       SER 724  41.442 -11.091  -5.096
    3    HB2  SER 724           HB2      SER 724  41.811 -11.256  -2.111
    4    HB3  SER 724           HB3      SER 724  42.629 -12.265  -3.321
    5    HG   SER 724           HG       SER 724  42.909  -9.695  -3.837

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU 725           H        LEU 725  40.938 -13.122  -5.385
    2    HA   LEU 725           HA       LEU 725  38.407 -14.225  -4.676
    3    HB2  LEU 725           HB2      LEU 725  40.940 -15.309  -5.824
    4    HB3  LEU 725           HB3      LEU 725  39.680 -16.431  -5.408
    5    HG   LEU 725           HG       LEU 725  39.247 -14.112  -7.282
    6   HD12  LEU 725          HD11      LEU 725  39.595 -15.736  -9.120
    7   HD11  LEU 725          HD12      LEU 725  40.049 -16.965  -7.938
    8   HD13  LEU 725          HD13      LEU 725  41.065 -15.542  -8.165
    9   HD22  LEU 725          HD21      LEU 725  37.418 -15.459  -8.101
   10   HD21  LEU 725          HD22      LEU 725  37.246 -15.140  -6.375
   11   HD23  LEU 725          HD23      LEU 725  37.798 -16.728  -6.932

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ASP 726           H        ASP 726  37.778 -15.206  -2.814
    2    HA   ASP 726           HA       ASP 726  39.800 -15.826  -0.837
    3    HB2  ASP 726           HB2      ASP 726  36.781 -15.846  -0.681
    4    HB3  ASP 726           HB3      ASP 726  37.791 -16.462   0.622

  No H/Q in entry =           4
  In of MODEL    2
    1    H    VAL 727           H        VAL 727  40.343 -17.783  -0.111
    2    HA   VAL 727           HA       VAL 727  39.225 -20.101  -1.525
    3    HB   VAL 727           HB       VAL 727  41.546 -20.947  -1.981
    4   HG13  VAL 727          HG11      VAL 727  40.205 -20.011  -3.788
    5   HG12  VAL 727          HG12      VAL 727  41.900 -19.589  -4.013
    6   HG11  VAL 727          HG13      VAL 727  40.772 -18.390  -3.389
    7   HG22  VAL 727          HG21      VAL 727  43.394 -19.322  -2.083
    8   HG21  VAL 727          HG22      VAL 727  42.792 -19.533  -0.438
    9   HG23  VAL 727          HG23      VAL 727  42.343 -18.101  -1.362

  No H/Q in entry =           9
  In of MODEL    2
    1    H    CYS 728           H        CYS 728  39.889 -22.190  -0.597
    2    HA   CYS 728           HA       CYS 728  40.375 -21.990   2.276
    3    HB2  CYS 728           HB2      CYS 728  39.417 -24.289   0.566
    4    HB3  CYS 728           HB3      CYS 728  39.703 -24.407   2.296

  No H/Q in entry =           4
  In of MODEL    2
    1    H    ALA 729           H        ALA 729  42.393 -22.234   2.920
    2    HA   ALA 729           HA       ALA 729  44.113 -24.005   1.361
    3    HB2  ALA 729           HB1      ALA 729  45.974 -22.499   1.822
    4    HB1  ALA 729           HB2      ALA 729  44.883 -21.416   2.676
    5    HB3  ALA 729           HB3      ALA 729  44.699 -21.660   0.935

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLN 730           H        GLN 730  45.867 -24.810   2.627
    2    HA   GLN 730           HA       GLN 730  45.107 -25.214   5.418
    3    HB2  GLN 730           HB2      GLN 730  45.010 -27.322   4.312
    4    HB3  GLN 730           HB3      GLN 730  46.470 -26.986   3.438
    5    HG2  GLN 730           HG2      GLN 730  47.837 -27.292   5.340
    6    HG3  GLN 730           HG3      GLN 730  46.441 -27.318   6.416
    7   HE21  GLN 730          HE21      GLN 730  45.421 -29.168   6.758
    8   HE22  GLN 730          HE22      GLN 730  45.857 -30.668   6.020

  No H/Q in entry =           8
  In of MODEL    2
    1    H    ASP 731           H        ASP 731  46.322 -24.423   6.842
    2    HA   ASP 731           HA       ASP 731  48.836 -23.098   6.362
    3    HB2  ASP 731           HB2      ASP 731  47.202 -22.409   8.156
    4    HB3  ASP 731           HB3      ASP 731  47.493 -23.940   8.940

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLU 732           H        GLU 732  50.818 -24.107   6.326
    2    HA   GLU 732           HA       GLU 732  50.830 -26.915   6.824
    3    HB2  GLU 732           HB2      GLU 732  52.957 -25.061   5.826
    4    HB3  GLU 732           HB3      GLU 732  53.275 -26.761   6.170
    5    HG2  GLU 732           HG2      GLU 732  51.252 -25.695   4.221
    6    HG3  GLU 732           HG3      GLU 732  52.808 -26.421   3.822

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ARG 733           H        ARG 733  51.104 -24.537   9.079
    2    HA   ARG 733           HA       ARG 733  53.062 -25.995  10.636
    3    HB2  ARG 733           HB2      ARG 733  51.586 -23.409  11.061
    4    HB3  ARG 733           HB3      ARG 733  52.758 -24.086  12.169
    5    HG2  ARG 733           HG2      ARG 733  53.373 -23.266   9.330
    6    HG3  ARG 733           HG3      ARG 733  53.594 -22.213  10.721
    7    HD2  ARG 733           HD2      ARG 733  55.711 -23.141  10.207
    8    HD3  ARG 733           HD3      ARG 733  55.144 -23.947  11.662
    9    HE   ARG 733           HE       ARG 733  54.565 -25.347   9.212
   10   HH11  ARG 733          HH11      ARG 733  56.951 -24.844  11.761
   11   HH12  ARG 733          HH12      ARG 733  57.799 -26.288  11.498
   12   HH21  ARG 733          HH21      ARG 733  55.717 -27.372   8.790
   13   HH22  ARG 733          HH22      ARG 733  57.054 -27.782   9.753

  No H/Q in entry =          13
  In of MODEL    2
    1    H    SER 734           H        SER 734  49.807 -24.672  10.818
    2    HA   SER 734           HA       SER 734  49.156 -26.242  13.154
    3    HB2  SER 734           HB2      SER 734  47.470 -24.337  11.538
    4    HB3  SER 734           HB3      SER 734  47.116 -24.933  13.163
    5    HG   SER 734           HG       SER 734  49.213 -23.217  12.329

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LYS 735           H        LYS 735  48.756 -26.501   9.693
    2    HA   LYS 735           HA       LYS 735  47.840 -27.889   8.318
    3    HB2  LYS 735           HB2      LYS 735  47.654 -29.745  10.692
    4    HB3  LYS 735           HB3      LYS 735  47.434 -30.236   9.021
    5    HG2  LYS 735           HG2      LYS 735  49.965 -29.092  10.209
    6    HG3  LYS 735           HG3      LYS 735  49.677 -30.783   9.814
    7    HD2  LYS 735           HD2      LYS 735  49.699 -28.512   7.812
    8    HD3  LYS 735           HD3      LYS 735  51.051 -29.589   8.113
    9    HE2  LYS 735           HE2      LYS 735  49.606 -31.503   7.453
   10    HE3  LYS 735           HE3      LYS 735  48.323 -30.364   7.074
   11    HZ3  LYS 735           HZ1      LYS 735  49.469 -30.977   5.082
   12    HZ2  LYS 735           HZ2      LYS 735  50.959 -30.517   5.682
   13    HZ1  LYS 735           HZ3      LYS 735  49.808 -29.360   5.360

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ARG 736           H        ARG 736  46.168 -26.067   9.819
    2    HA   ARG 736           HA       ARG 736  43.578 -27.405   9.690
    3    HB2  ARG 736           HB2      ARG 736  42.667 -25.423  10.746
    4    HB3  ARG 736           HB3      ARG 736  44.016 -26.052  11.679
    5    HG2  ARG 736           HG2      ARG 736  45.464 -24.342  10.698
    6    HG3  ARG 736           HG3      ARG 736  44.082 -23.708   9.807
    7    HD2  ARG 736           HD2      ARG 736  44.308 -23.904  12.794
    8    HD3  ARG 736           HD3      ARG 736  44.581 -22.475  11.787
    9    HE   ARG 736           HE       ARG 736  42.010 -23.463  11.266
   10   HH11  ARG 736          HH11      ARG 736  43.748 -21.799  13.862
   11   HH12  ARG 736          HH12      ARG 736  42.339 -21.117  14.545
   12   HH21  ARG 736          HH21      ARG 736  40.124 -22.531  12.174
   13   HH22  ARG 736          HH22      ARG 736  40.213 -21.555  13.571

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ILE 737           H        ILE 737  41.904 -26.533   8.365
    2    HA   ILE 737           HA       ILE 737  42.940 -25.276   5.970
    3    HB   ILE 737           HB       ILE 737  40.055 -26.026   6.479
    4   HG12  ILE 737          HG12      ILE 737  41.477 -28.037   6.923
    5   HG13  ILE 737          HG13      ILE 737  40.448 -28.239   5.515
    6   HG21  ILE 737          HG21      ILE 737  40.774 -24.590   4.548
    7   HG23  ILE 737          HG22      ILE 737  39.910 -26.053   4.097
    8   HG22  ILE 737          HG23      ILE 737  41.666 -25.980   3.923
    9   HD13  ILE 737          HD11      ILE 737  42.629 -29.146   5.086
   10   HD12  ILE 737          HD12      ILE 737  43.381 -27.614   5.550
   11   HD11  ILE 737          HD13      ILE 737  42.365 -27.699   4.101

  No H/Q in entry =          11
  In of MODEL    2
    1    H    LEU 738           H        LEU 738  42.933 -23.150   5.981
    2    HA   LEU 738           HA       LEU 738  40.841 -21.813   7.519
    3    HB2  LEU 738           HB2      LEU 738  42.255 -20.006   8.096
    4    HB3  LEU 738           HB3      LEU 738  43.112 -21.464   8.568
    5    HG   LEU 738           HG       LEU 738  43.688 -19.602   6.254
    6   HD11  LEU 738          HD11      LEU 738  45.230 -20.205   8.763
    7   HD13  LEU 738          HD12      LEU 738  44.353 -18.720   8.391
    8   HD12  LEU 738          HD13      LEU 738  45.771 -19.169   7.443
    9   HD22  LEU 738          HD21      LEU 738  44.150 -21.847   5.604
   10   HD21  LEU 738          HD22      LEU 738  45.130 -22.118   7.050
   11   HD23  LEU 738          HD23      LEU 738  45.652 -20.954   5.803

  No H/Q in entry =          11
  In of MODEL    2
    1    HA   PRO 739           HA       PRO 739  39.845 -19.797   3.759
    2    HB2  PRO 739           HB2      PRO 739  38.612 -17.619   4.700
    3    HB3  PRO 739           HB3      PRO 739  37.869 -19.228   4.805
    4    HG2  PRO 739           HG2      PRO 739  39.256 -17.640   6.928
    5    HG3  PRO 739           HG3      PRO 739  37.812 -18.662   7.058
    6    HD2  PRO 739           HD2      PRO 739  40.370 -19.483   7.765
    7    HD3  PRO 739           HD3      PRO 739  39.047 -20.580   7.290

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LEU 740           H        LEU 740  41.468 -19.045   2.719
    2    HA   LEU 740           HA       LEU 740  42.810 -16.629   3.672
    3    HB2  LEU 740           HB2      LEU 740  43.790 -18.820   1.869
    4    HB3  LEU 740           HB3      LEU 740  44.565 -17.256   1.958
    5    HG   LEU 740           HG       LEU 740  44.343 -19.286   4.172
    6   HD11  LEU 740          HD11      LEU 740  45.940 -19.777   2.417
    7   HD13  LEU 740          HD12      LEU 740  46.744 -19.368   3.938
    8   HD12  LEU 740          HD13      LEU 740  46.664 -18.184   2.618
    9   HD21  LEU 740          HD21      LEU 740  45.565 -16.522   4.170
   10   HD23  LEU 740          HD22      LEU 740  45.768 -17.723   5.440
   11   HD22  LEU 740          HD23      LEU 740  44.172 -17.050   5.122

  No H/Q in entry =          11
  In of MODEL    2
    1    H    THR 741           H        THR 741  43.756 -15.601   1.558
    2    HA   THR 741           HA       THR 741  41.660 -15.591  -0.432
    3    HB   THR 741           HB       THR 741  42.959 -13.044   0.522
    4    HG1  THR 741           HG1      THR 741  40.422 -13.944   1.488
    5   HG21  THR 741          HG21      THR 741  41.706 -13.218  -1.555
    6   HG23  THR 741          HG22      THR 741  40.979 -12.061  -0.401
    7   HG22  THR 741          HG23      THR 741  40.268 -13.661  -0.643

  No H/Q in entry =           7
  In of MODEL    2
    1    H    VAL 742           H        VAL 742  42.539 -14.760  -2.509
    2    HA   VAL 742           HA       VAL 742  45.023 -15.924  -2.799
    3    HB   VAL 742           HB       VAL 742  45.041 -15.449  -5.116
    4   HG12  VAL 742          HG11      VAL 742  42.424 -16.313  -4.120
    5   HG11  VAL 742          HG12      VAL 742  43.893 -17.315  -4.324
    6   HG13  VAL 742          HG13      VAL 742  43.063 -16.607  -5.743
    7   HG22  VAL 742          HG21      VAL 742  43.269 -14.597  -6.235
    8   HG21  VAL 742          HG22      VAL 742  44.122 -13.337  -5.303
    9   HG23  VAL 742          HG23      VAL 742  42.513 -13.946  -4.769

  No H/Q in entry =           9
  In of MODEL    2
    1    H    CYS 743           H        CYS 743  44.445 -12.454  -2.512
    2    HA   CYS 743           HA       CYS 743  46.993 -11.826  -3.412
    3    HB2  CYS 743           HB2      CYS 743  45.247 -10.091  -2.810
    4    HB3  CYS 743           HB3      CYS 743  45.620 -10.409  -1.121

  No H/Q in entry =           4
  In of MODEL    2
    1    H    LYS 744           H        LYS 744  45.657 -12.549  -0.212
    2    HA   LYS 744           HA       LYS 744  47.808 -12.443   1.467
    3    HB2  LYS 744           HB2      LYS 744  45.327 -14.074   1.380
    4    HB3  LYS 744           HB3      LYS 744  46.565 -14.546   2.519
    5    HG2  LYS 744           HG2      LYS 744  45.488 -11.757   2.413
    6    HG3  LYS 744           HG3      LYS 744  44.716 -13.036   3.356
    7    HD2  LYS 744           HD2      LYS 744  46.968 -13.430   4.423
    8    HD3  LYS 744           HD3      LYS 744  47.498 -11.931   3.659
    9    HE2  LYS 744           HE2      LYS 744  46.797 -11.559   5.968
   10    HE3  LYS 744           HE3      LYS 744  45.762 -10.701   4.839
   11    HZ1  LYS 744           HZ1      LYS 744  44.081 -12.461   5.099
   12    HZ3  LYS 744           HZ2      LYS 744  44.467 -11.764   6.563
   13    HZ2  LYS 744           HZ3      LYS 744  45.081 -13.281   6.190

  No H/Q in entry =          13
  In of MODEL    2
    1    H    MET 745           H        MET 745  46.565 -15.428   0.029
    2    HA   MET 745           HA       MET 745  48.655 -17.098   0.688
    3    HB2  MET 745           HB2      MET 745  46.935 -18.262   0.009
    4    HB3  MET 745           HB3      MET 745  46.451 -17.185  -1.294
    5    HG2  MET 745           HG2      MET 745  47.157 -19.091  -2.448
    6    HG3  MET 745           HG3      MET 745  48.566 -18.085  -2.465
    7    HE1  MET 745           HE1      MET 745  46.913 -21.225  -1.009
    8    HE3  MET 745           HE2      MET 745  47.194 -20.382   0.523
    9    HE2  MET 745           HE3      MET 745  48.093 -21.849   0.132

  No H/Q in entry =           9
  In of MODEL    2
    1    H    HIS 746           H        HIS 746  48.306 -15.152  -2.289
    2    HA   HIS 746           HA       HIS 746  50.494 -16.284  -3.554
    3    HB2  HIS 746           HB2      HIS 746  48.815 -13.989  -3.957
    4    HB3  HIS 746           HB3      HIS 746  50.457 -13.736  -4.585
    5    HD1  HIS 746           HD1      HIS 746  51.106 -16.150  -6.101
    6    HD2  HIS 746           HD2      HIS 746  47.195 -14.768  -5.858
    7    HE1  HIS 746           HE1      HIS 746  49.986 -16.989  -8.124
    8    HE2  HIS 746           HE2      HIS 746  47.576 -16.424  -7.803

  No H/Q in entry =           8
  In of MODEL    2
    1    H    VAL 747           H        VAL 747  50.177 -13.185  -1.845
    2    HA   VAL 747           HA       VAL 747  52.830 -12.330  -2.030
    3    HB   VAL 747           HB       VAL 747  50.503 -11.610  -0.263
    4   HG12  VAL 747          HG11      VAL 747  53.239 -10.327  -0.199
    5   HG11  VAL 747          HG12      VAL 747  52.539 -11.296   1.098
    6   HG13  VAL 747          HG13      VAL 747  51.810  -9.752   0.660
    7   HG23  VAL 747          HG21      VAL 747  52.050 -10.142  -2.353
    8   HG22  VAL 747          HG22      VAL 747  50.629  -9.518  -1.481
    9   HG21  VAL 747          HG23      VAL 747  50.475 -10.902  -2.574

  No H/Q in entry =           9
  In of MODEL    2
    1    H    LEU 748           H        LEU 748  51.080 -13.902   0.556
    2    HA   LEU 748           HA       LEU 748  53.214 -14.108   2.334
    3    HB2  LEU 748           HB2      LEU 748  51.257 -14.312   3.438
    4    HB3  LEU 748           HB3      LEU 748  50.445 -15.020   2.083
    5    HG   LEU 748           HG       LEU 748  52.184 -16.628   3.968
    6   HD12  LEU 748          HD11      LEU 748  49.199 -16.112   3.997
    7   HD11  LEU 748          HD12      LEU 748  50.346 -15.493   5.186
    8   HD13  LEU 748          HD13      LEU 748  50.054 -17.228   5.050
    9   HD23  LEU 748          HD21      LEU 748  49.938 -17.398   2.074
   10   HD22  LEU 748          HD22      LEU 748  50.887 -18.490   3.074
   11   HD21  LEU 748          HD23      LEU 748  51.656 -17.634   1.745

  No H/Q in entry =          11
  In of MODEL    2
    1    H    HIS 749           H        HIS 749  52.287 -16.073  -0.373
    2    HA   HIS 749           HA       HIS 749  53.920 -18.294   0.342
    3    HB2  HIS 749           HB2      HIS 749  51.956 -18.188  -1.388
    4    HB3  HIS 749           HB3      HIS 749  53.217 -17.676  -2.509
    5    HD1  HIS 749           HD1      HIS 749  55.153 -19.470  -2.959
    6    HD2  HIS 749           HD2      HIS 749  51.855 -20.776  -0.844
    7    HE1  HIS 749           HE1      HIS 749  55.372 -21.960  -2.913
    8    HE2  HIS 749           HE2      HIS 749  53.544 -22.724  -1.387

  No H/Q in entry =           8
  In of MODEL    2
    1    H    CYS 750           H        CYS 750  54.426 -15.303  -1.506
    2    HA   CYS 750           HA       CYS 750  56.990 -16.307  -2.314
    3    HB2  CYS 750           HB2      CYS 750  57.339 -14.246  -3.533
    4    HB3  CYS 750           HB3      CYS 750  55.751 -14.895  -3.906

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLN 751           H        GLN 751  55.666 -14.494   0.268
    2    HA   GLN 751           HA       GLN 751  58.035 -13.351   1.248
    3    HB2  GLN 751           HB2      GLN 751  55.633 -14.397   2.764
    4    HB3  GLN 751           HB3      GLN 751  56.917 -13.441   3.481
    5    HG2  GLN 751           HG2      GLN 751  55.042 -12.561   1.306
    6    HG3  GLN 751           HG3      GLN 751  54.933 -12.095   2.991
    7   HE21  GLN 751          HE21      GLN 751  55.153 -10.339   0.740
    8   HE22  GLN 751          HE22      GLN 751  56.621  -9.469   0.922

  No H/Q in entry =           8
  In of MODEL    2
    1    H    GLY 752           H        GLY 752  56.752 -16.575   1.307
    2    HA3  GLY 752           HA2      GLY 752  58.476 -18.342   1.338
    3    HA2  GLY 752           HA3      GLY 752  59.204 -17.490   2.691

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ARG 753           H        ARG 753  55.731 -17.950   2.350
    2    HA   ARG 753           HA       ARG 753  55.839 -19.684   4.713
    3    HB2  ARG 753           HB2      ARG 753  53.555 -18.035   3.636
    4    HB3  ARG 753           HB3      ARG 753  53.525 -18.983   5.114
    5    HG2  ARG 753           HG2      ARG 753  55.240 -16.561   4.577
    6    HG3  ARG 753           HG3      ARG 753  53.810 -16.607   5.603
    7    HD2  ARG 753           HD2      ARG 753  54.924 -18.258   7.068
    8    HD3  ARG 753           HD3      ARG 753  56.364 -18.160   6.060
    9    HE   ARG 753           HE       ARG 753  55.604 -15.597   7.019
   10   HH11  ARG 753          HH11      ARG 753  57.219 -18.593   8.023
   11   HH12  ARG 753          HH12      ARG 753  58.142 -17.842   9.233
   12   HH21  ARG 753          HH21      ARG 753  56.867 -14.582   8.676
   13   HH22  ARG 753          HH22      ARG 753  57.934 -15.505   9.630

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ASN 754           H        ASN 754  54.703 -21.620   4.713
    2    HA   ASN 754           HA       ASN 754  54.024 -22.551   2.043
    3    HB2  ASN 754           HB2      ASN 754  54.754 -24.136   4.502
    4    HB3  ASN 754           HB3      ASN 754  54.213 -24.849   2.993
    5   HD21  ASN 754          HD21      ASN 754  56.742 -23.311   4.659
    6   HD22  ASN 754          HD22      ASN 754  57.993 -23.550   3.502

  No H/Q in entry =           6
  In of MODEL    2
    1    H    TYR 755           H        TYR 755  52.097 -22.976   1.515
    2    HA   TYR 755           HA       TYR 755  50.169 -23.841   3.466
    3    HB2  TYR 755           HB2      TYR 755  49.834 -21.426   1.699
    4    HB3  TYR 755           HB3      TYR 755  48.463 -22.382   2.256
    5    HD1  TYR 755           HD1      TYR 755  51.364 -20.400   3.479
    6    HD2  TYR 755           HD2      TYR 755  47.518 -21.938   4.356
    7    HE1  TYR 755           HE1      TYR 755  51.319 -19.082   5.542
    8    HE2  TYR 755           HE2      TYR 755  47.465 -20.628   6.431
    9    HH   TYR 755           HH       TYR 755  49.113 -19.718   7.974

  No H/Q in entry =           9
  In of MODEL    2
    1    H    THR 756           H        THR 756  48.776 -25.201   2.634
    2    HA   THR 756           HA       THR 756  49.286 -26.125  -0.093
    3    HB   THR 756           HB       THR 756  47.935 -27.393   2.300
    4    HG1  THR 756           HG1      THR 756  49.868 -27.822   2.845
    5   HG22  THR 756          HG21      THR 756  48.626 -28.609  -0.374
    6   HG21  THR 756          HG22      THR 756  47.010 -28.199   0.213
    7   HG23  THR 756          HG23      THR 756  47.935 -29.469   1.020

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LEU 757           H        LEU 757  47.473 -26.285  -1.556
    2    HA   LEU 757           HA       LEU 757  45.172 -24.902  -0.495
    3    HB2  LEU 757           HB2      LEU 757  45.957 -25.348  -3.341
    4    HB3  LEU 757           HB3      LEU 757  44.376 -24.756  -2.868
    5    HG   LEU 757           HG       LEU 757  45.954 -23.078  -1.516
    6   HD12  LEU 757          HD11      LEU 757  47.730 -22.287  -2.988
    7   HD11  LEU 757          HD12      LEU 757  47.463 -23.682  -4.037
    8   HD13  LEU 757          HD13      LEU 757  48.014 -23.918  -2.377
    9   HD21  LEU 757          HD21      LEU 757  44.058 -22.541  -2.842
   10   HD23  LEU 757          HD22      LEU 757  44.984 -22.766  -4.339
   11   HD22  LEU 757          HD23      LEU 757  45.396 -21.461  -3.212

  No H/Q in entry =          11
  In of MODEL    2
    1    H    THR 758           H        THR 758  43.184 -25.624  -0.582
    2    HA   THR 758           HA       THR 758  42.968 -28.485  -1.058
    3    HB   THR 758           HB       THR 758  41.376 -28.528   0.912
    4    HG1  THR 758           HG1      THR 758  41.872 -25.849   0.830
    5   HG22  THR 758          HG21      THR 758  44.205 -27.650   1.546
    6   HG21  THR 758          HG22      THR 758  43.747 -29.267   1.040
    7   HG23  THR 758          HG23      THR 758  43.158 -28.636   2.572

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLY 759           H        GLY 759  40.283 -28.790  -0.634
    2    HA3  GLY 759           HA2      GLY 759  39.209 -27.763  -3.059
    3    HA2  GLY 759           HA3      GLY 759  38.396 -28.768  -1.876

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ARG 760           H        ARG 760  36.772 -27.161  -2.792
    2    HA   ARG 760           HA       ARG 760  36.758 -24.542  -1.546
    3    HB2  ARG 760           HB2      ARG 760  34.577 -24.273  -2.718
    4    HB3  ARG 760           HB3      ARG 760  35.877 -24.785  -3.787
    5    HG2  ARG 760           HG2      ARG 760  34.100 -26.122  -4.492
    6    HG3  ARG 760           HG3      ARG 760  34.987 -27.162  -3.379
    7    HD2  ARG 760           HD2      ARG 760  33.356 -26.376  -1.582
    8    HD3  ARG 760           HD3      ARG 760  32.390 -25.732  -2.913
    9    HE   ARG 760           HE       ARG 760  33.054 -28.422  -3.401
   10   HH11  ARG 760          HH11      ARG 760  30.831 -26.474  -1.442
   11   HH12  ARG 760          HH12      ARG 760  29.755 -27.758  -1.170
   12   HH21  ARG 760          HH21      ARG 760  31.588 -30.135  -3.026
   13   HH22  ARG 760          HH22      ARG 760  30.169 -29.896  -2.111

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ASP 761           H        ASP 761  35.942 -27.592  -0.591
    2    HA   ASP 761           HA       ASP 761  33.655 -26.764   1.027
    3    HB2  ASP 761           HB2      ASP 761  33.324 -28.703  -0.412
    4    HB3  ASP 761           HB3      ASP 761  34.668 -29.527   0.363

  No H/Q in entry =           4
  In of MODEL    2
    1    H    SER 762           H        SER 762  37.002 -27.499   1.332
    2    HA   SER 762           HA       SER 762  36.998 -28.800   3.796
    3    HB2  SER 762           HB2      SER 762  39.457 -28.051   3.705
    4    HB3  SER 762           HB3      SER 762  38.858 -29.162   2.471
    5    HG   SER 762           HG       SER 762  40.092 -27.067   1.888

  No H/Q in entry =           5
  In of MODEL    2
    1    H    CYS 763           H        CYS 763  36.942 -25.350   3.042
    2    HA   CYS 763           HA       CYS 763  37.035 -24.944   5.949
    3    HB2  CYS 763           HB2      CYS 763  38.096 -22.878   5.763
    4    HB3  CYS 763           HB3      CYS 763  38.995 -23.905   4.660

  No H/Q in entry =           4
  In of MODEL    2
    1    H    THR 764           H        THR 764  35.887 -22.968   6.586
    2    HA   THR 764           HA       THR 764  33.437 -22.741   5.062
    3    HB   THR 764           HB       THR 764  34.174 -21.646   7.790
    4    HG1  THR 764           HG1      THR 764  33.041 -24.063   6.888
    5   HG23  THR 764          HG21      THR 764  32.381 -20.410   6.675
    6   HG22  THR 764          HG22      THR 764  31.755 -21.336   8.043
    7   HG21  THR 764          HG23      THR 764  31.510 -21.917   6.393

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LEU 765           H        LEU 765  33.659 -21.395   3.475
    2    HA   LEU 765           HA       LEU 765  35.518 -19.202   3.594
    3    HB2  LEU 765           HB2      LEU 765  34.816 -20.867   1.619
    4    HB3  LEU 765           HB3      LEU 765  33.597 -19.624   1.398
    5    HG   LEU 765           HG       LEU 765  35.367 -17.941   1.083
    6   HD11  LEU 765          HD11      LEU 765  37.185 -20.322   1.278
    7   HD13  LEU 765          HD12      LEU 765  37.123 -18.956   2.392
    8   HD12  LEU 765          HD13      LEU 765  37.672 -18.718   0.732
    9   HD23  LEU 765          HD21      LEU 765  36.075 -18.712  -1.127
   10   HD22  LEU 765          HD22      LEU 765  34.369 -19.066  -0.846
   11   HD21  LEU 765          HD23      LEU 765  35.567 -20.352  -0.722

  No H/Q in entry =          11
  In of MODEL    2
    1    HA   PRO 766           HA       PRO 766  32.451 -16.240   4.931
    2    HB2  PRO 766           HB2      PRO 766  33.476 -14.013   3.654
    3    HB3  PRO 766           HB3      PRO 766  34.029 -14.614   5.214
    4    HG2  PRO 766           HG2      PRO 766  35.225 -14.983   2.508
    5    HG3  PRO 766           HG3      PRO 766  36.031 -14.772   4.072
    6    HD2  PRO 766           HD2      PRO 766  35.844 -17.159   2.855
    7    HD3  PRO 766           HD3      PRO 766  35.818 -17.022   4.614

  No H/Q in entry =           7
  In of MODEL    2
    1    H    ALA 767           H        ALA 767  33.378 -16.386   1.580
    2    HA   ALA 767           HA       ALA 767  30.730 -15.413   0.795
    3    HB1  ALA 767           HB1      ALA 767  33.276 -15.546  -0.821
    4    HB2  ALA 767           HB2      ALA 767  32.642 -14.097  -0.051
    5    HB3  ALA 767           HB3      ALA 767  31.734 -14.869  -1.360

  No H/Q in entry =           5
  In of MODEL    2
    1    H    SER 768           H        SER 768  29.415 -16.930   0.457
    2    HA   SER 768           HA       SER 768  30.244 -19.144  -1.230
    3    HB2  SER 768           HB2      SER 768  28.800 -19.452   1.416
    4    HB3  SER 768           HB3      SER 768  29.115 -20.737   0.245
    5    HG   SER 768           HG       SER 768  31.372 -19.452   0.715

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA 769           H        ALA 769  28.432 -16.589  -1.081
    2    HA   ALA 769           HA       ALA 769  26.370 -17.663  -2.755
    3    HB1  ALA 769           HB1      ALA 769  24.588 -16.494  -1.510
    4    HB2  ALA 769           HB2      ALA 769  25.744 -16.108  -0.232
    5    HB3  ALA 769           HB3      ALA 769  25.300 -17.790  -0.541

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLU 770           H        GLU 770  25.169 -15.678  -3.667
    2    HA   GLU 770           HA       GLU 770  27.214 -13.773  -4.311
    3    HB2  GLU 770           HB2      GLU 770  25.549 -12.825  -5.869
    4    HB3  GLU 770           HB3      GLU 770  25.821 -14.545  -6.113
    5    HG2  GLU 770           HG2      GLU 770  23.768 -15.078  -5.017
    6    HG3  GLU 770           HG3      GLU 770  23.505 -13.382  -4.602

  No H/Q in entry =           6
  In of MODEL    2
    1    H    LYS 771           H        LYS 771  26.711 -11.457  -4.244
    2    HA   LYS 771           HA       LYS 771  25.666 -10.918  -1.574
    3    HB2  LYS 771           HB2      LYS 771  27.544  -9.340  -3.307
    4    HB3  LYS 771           HB3      LYS 771  26.979  -8.851  -1.723
    5    HG2  LYS 771           HG2      LYS 771  28.675 -11.287  -2.309
    6    HG3  LYS 771           HG3      LYS 771  29.273  -9.752  -1.699
    7    HD2  LYS 771           HD2      LYS 771  29.115 -10.945   0.261
    8    HD3  LYS 771           HD3      LYS 771  27.520 -10.211   0.225
    9    HE2  LYS 771           HE2      LYS 771  26.584 -12.314  -0.694
   10    HE3  LYS 771           HE3      LYS 771  28.198 -13.008  -0.699
   11    HZ1  LYS 771           HZ1      LYS 771  26.737 -12.111   1.715
   12    HZ3  LYS 771           HZ2      LYS 771  28.257 -12.850   1.682
   13    HZ2  LYS 771           HZ3      LYS 771  26.906 -13.704   1.208

  No H/Q in entry =          13
  In of MODEL    2
    1    H    ALA 772           H        ALA 772  24.589  -8.948  -1.241
    2    HA   ALA 772           HA       ALA 772  22.902  -8.122  -3.482
    3    HB2  ALA 772           HB1      ALA 772  22.635  -7.676  -0.499
    4    HB3  ALA 772           HB2      ALA 772  21.714  -8.831  -1.463
    5    HB1  ALA 772           HB3      ALA 772  21.497  -7.100  -1.716

  No H/Q in entry =           5
  In of MODEL    2
    1    H    CYS 773           H        CYS 773  22.478  -5.718  -3.518
    2    HA   CYS 773           HA       CYS 773  24.969  -4.407  -3.818
    3    HB2  CYS 773           HB2      CYS 773  23.025  -3.848  -5.217
    4    HB3  CYS 773           HB3      CYS 773  22.182  -3.238  -3.804

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLY 774           H        GLY 774  26.096  -3.110  -2.500
    2    HA3  GLY 774           HA2      GLY 774  25.845  -1.426  -0.669
    3    HA2  GLY 774           HA3      GLY 774  24.995  -2.717   0.189

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ALA 775           H        ALA 775  26.744  -4.693  -1.121
    2    HA   ALA 775           HA       ALA 775  29.430  -4.143  -0.360
    3    HB2  ALA 775           HB1      ALA 775  27.869  -6.294   1.112
    4    HB1  ALA 775           HB2      ALA 775  28.521  -4.824   1.836
    5    HB3  ALA 775           HB3      ALA 775  29.614  -6.053   1.205

  No H/Q in entry =           5
  In of MODEL    2
    1    H    CYS 776           H        CYS 776  30.143  -4.733  -2.330
    2    HA   CYS 776           HA       CYS 776  29.431  -7.416  -3.243
    3    HB2  CYS 776           HB2      CYS 776  29.606  -4.910  -4.947
    4    HB3  CYS 776           HB3      CYS 776  29.429  -6.540  -5.572

  No H/Q in entry =           4
  In of MODEL    2
    1    HA   PRO 777           HA       PRO 777  33.867  -7.684  -3.667
    2    HB2  PRO 777           HB2      PRO 777  34.055  -9.770  -5.399
    3    HB3  PRO 777           HB3      PRO 777  33.608  -9.988  -3.704
    4    HG2  PRO 777           HG2      PRO 777  31.843  -9.880  -6.124
    5    HG3  PRO 777           HG3      PRO 777  31.763 -10.967  -4.725
    6    HD2  PRO 777           HD2      PRO 777  30.157  -8.788  -5.011
    7    HD3  PRO 777           HD3      PRO 777  30.664  -9.422  -3.434

  No H/Q in entry =           7
  In of MODEL    2
    1    H    LEU 778           H        LEU 778  35.511  -7.733  -5.518
    2    HA   LEU 778           HA       LEU 778  35.008  -5.590  -7.170
    3    HB2  LEU 778           HB2      LEU 778  37.234  -5.944  -8.207
    4    HB3  LEU 778           HB3      LEU 778  37.221  -5.905  -6.467
    5    HG   LEU 778           HG       LEU 778  38.873  -7.456  -7.197
    6   HD12  LEU 778          HD11      LEU 778  36.586  -9.056  -6.132
    7   HD11  LEU 778          HD12      LEU 778  37.788  -8.166  -5.196
    8   HD13  LEU 778          HD13      LEU 778  38.276  -9.550  -6.169
    9   HD21  LEU 778          HD21      LEU 778  36.736  -8.808  -8.794
   10   HD23  LEU 778          HD22      LEU 778  38.336  -9.478  -8.485
   11   HD22  LEU 778          HD23      LEU 778  38.171  -7.968  -9.406

  No H/Q in entry =          11
  In of MODEL    2
    1    H    TRP 779           H        TRP 779  34.128  -8.750  -7.893
    2    HA   TRP 779           HA       TRP 779  33.814  -8.058 -10.734
    3    HB2  TRP 779           HB2      TRP 779  33.172 -10.500 -11.015
    4    HB3  TRP 779           HB3      TRP 779  34.837 -10.215 -10.534
    5    HD1  TRP 779           HD1      TRP 779  31.479 -11.441  -9.042
    6    HE1  TRP 779           HE1      TRP 779  32.020 -12.885  -6.976
    7    HE3  TRP 779           HE3      TRP 779  36.512 -10.768  -8.887
    8    HZ2  TRP 779           HZ2      TRP 779  34.315 -13.612  -5.476
    9    HZ3  TRP 779           HZ3      TRP 779  37.811 -11.849  -7.119
   10    HH2  TRP 779           HH2      TRP 779  36.726 -13.254  -5.450

  No H/Q in entry =          10
  In of MODEL    2
    1    H    GLY 780           H        GLY 780  32.196  -7.589  -8.035
    2    HA3  GLY 780           HA2      GLY 780  29.571  -8.112  -9.233
    3    HA2  GLY 780           HA3      GLY 780  29.882  -8.162  -7.494

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LYS 781           H        LYS 781  28.222  -6.388  -9.345
    2    HA   LYS 781           HA       LYS 781  28.870  -3.944  -7.966
    3    HB2  LYS 781           HB2      LYS 781  30.478  -4.095  -9.858
    4    HB3  LYS 781           HB3      LYS 781  29.132  -4.030 -10.974
    5    HG2  LYS 781           HG2      LYS 781  28.570  -1.785 -10.132
    6    HG3  LYS 781           HG3      LYS 781  29.951  -1.874  -9.036
    7    HD2  LYS 781           HD2      LYS 781  30.038  -1.926 -12.057
    8    HD3  LYS 781           HD3      LYS 781  30.573  -0.614 -11.008
    9    HE2  LYS 781           HE2      LYS 781  32.302  -2.107 -10.049
   10    HE3  LYS 781           HE3      LYS 781  31.782  -3.383 -11.142
   11    HZ2  LYS 781           HZ1      LYS 781  32.979  -0.791 -11.913
   12    HZ1  LYS 781           HZ2      LYS 781  32.396  -1.918 -13.012
   13    HZ3  LYS 781           HZ3      LYS 781  33.709  -2.311 -11.997

  No H/Q in entry =          13
  In of MODEL    2
    1    H    CYS 782           H        CYS 782  27.056  -2.765  -7.760
    2    HA   CYS 782           HA       CYS 782  24.726  -3.608  -9.302
    3    HB2  CYS 782           HB2      CYS 782  23.467  -2.332  -7.461
    4    HB3  CYS 782           HB3      CYS 782  24.224  -3.856  -7.018

  No H/Q in entry =           4
  In of MODEL    2
    1    H    ASP 783           H        ASP 783  23.110  -1.664  -9.572
    2    HA   ASP 783           HA       ASP 783  24.687   0.507 -10.774
    3    HB2  ASP 783           HB2      ASP 783  21.994  -0.632 -11.587
    4    HB3  ASP 783           HB3      ASP 783  22.790   0.735 -12.353

  No H/Q in entry =           4
  In of MODEL    2
    1    H    ALA 784           H        ALA 784  22.458   2.175 -11.274
    2    HA   ALA 784           HA       ALA 784  22.032   3.408  -8.774
    3    HB2  ALA 784           HB1      ALA 784  21.869   4.625 -10.924
    4    HB3  ALA 784           HB2      ALA 784  20.419   4.832  -9.950
    5    HB1  ALA 784           HB3      ALA 784  20.407   3.720 -11.317

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLU 785           H        GLU 785  20.290   1.073 -10.641
    2    HA   GLU 785           HA       GLU 785  18.186   0.734  -8.733
    3    HB2  GLU 785           HB2      GLU 785  17.776   0.132 -11.072
    4    HB3  GLU 785           HB3      GLU 785  19.165  -0.930 -11.085
    5    HG2  GLU 785           HG2      GLU 785  16.999  -2.119 -11.012
    6    HG3  GLU 785           HG3      GLU 785  18.050  -2.495  -9.652

  No H/Q in entry =           6
  In of MODEL    2
    1    H    SER 786           H        SER 786  19.014   0.310  -6.745
    2    HA   SER 786           HA       SER 786  21.325  -1.373  -6.496
    3    HB2  SER 786           HB2      SER 786  21.245  -0.399  -4.161
    4    HB3  SER 786           HB3      SER 786  21.569   0.712  -5.494
    5    HG   SER 786           HG       SER 786  19.852   1.124  -3.750

  No H/Q in entry =           5
  In of MODEL    2
    1    H    SER 787           H        SER 787  18.321  -2.288  -6.742
    2    HA   SER 787           HA       SER 787  17.800  -3.623  -4.318
    3    HB2  SER 787           HB2      SER 787  16.864  -4.350  -7.101
    4    HB3  SER 787           HB3      SER 787  16.176  -4.953  -5.592
    5    HG   SER 787           HG       SER 787  16.046  -2.411  -6.745

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LYS 788           H        LYS 788  19.397  -4.791  -7.302
    2    HA   LYS 788           HA       LYS 788  20.356  -7.039  -5.681
    3    HB2  LYS 788           HB2      LYS 788  20.481  -8.388  -7.705
    4    HB3  LYS 788           HB3      LYS 788  18.834  -7.838  -7.429
    5    HG2  LYS 788           HG2      LYS 788  19.110  -6.138  -9.143
    6    HG3  LYS 788           HG3      LYS 788  20.788  -6.636  -9.384
    7    HD2  LYS 788           HD2      LYS 788  19.978  -8.876 -10.065
    8    HD3  LYS 788           HD3      LYS 788  18.318  -8.306  -9.881
    9    HE2  LYS 788           HE2      LYS 788  20.376  -7.186 -11.785
   10    HE3  LYS 788           HE3      LYS 788  19.049  -8.251 -12.230
   11    HZ1  LYS 788           HZ1      LYS 788  17.506  -6.544 -11.488
   12    HZ3  LYS 788           HZ2      LYS 788  18.517  -5.955 -12.706
   13    HZ2  LYS 788           HZ3      LYS 788  18.789  -5.516 -11.103

  No H/Q in entry =          13
  In of MODEL    2
    1    H    CYS 789           H        CYS 789  22.451  -7.958  -6.551
    2    HA   CYS 789           HA       CYS 789  24.128  -5.829  -7.667
    3    HB2  CYS 789           HB2      CYS 789  24.651  -6.324  -5.249
    4    HB3  CYS 789           HB3      CYS 789  24.953  -7.996  -5.698

  No H/Q in entry =           4
  In of MODEL    2
    1    H    VAL 790           H        VAL 790  25.197  -6.485  -9.525
    2    HA   VAL 790           HA       VAL 790  24.580  -9.252 -10.212
    3    HB   VAL 790           HB       VAL 790  24.585  -8.614 -12.565
    4   HG13  VAL 790          HG11      VAL 790  22.487  -8.584 -11.379
    5   HG12  VAL 790          HG12      VAL 790  22.528  -7.275 -12.562
    6   HG11  VAL 790          HG13      VAL 790  22.776  -6.927 -10.856
    7   HG21  VAL 790          HG21      VAL 790  26.153  -6.736 -12.472
    8   HG23  VAL 790          HG22      VAL 790  24.968  -5.781 -11.588
    9   HG22  VAL 790          HG23      VAL 790  24.647  -6.264 -13.255

  No H/Q in entry =           9
  In of MODEL    2
    1    H    CYS 791           H        CYS 791  26.020 -10.054 -11.993
    2    HA   CYS 791           HA       CYS 791  28.754  -9.722 -11.055
    3    HB2  CYS 791           HB2      CYS 791  27.763 -11.792 -13.030
    4    HB3  CYS 791           HB3      CYS 791  29.134 -11.869 -11.938

  No H/Q in entry =           4
  In of MODEL    2
    1    H    ARG 792           H        ARG 792  30.196  -8.793 -12.407
    2    HA   ARG 792           HA       ARG 792  29.058  -7.545 -14.781
    3    HB2  ARG 792           HB2      ARG 792  31.629  -7.029 -13.294
    4    HB3  ARG 792           HB3      ARG 792  31.070  -6.128 -14.704
    5    HG2  ARG 792           HG2      ARG 792  29.647  -6.314 -12.058
    6    HG3  ARG 792           HG3      ARG 792  30.574  -4.930 -12.649
    7    HD2  ARG 792           HD2      ARG 792  29.049  -4.696 -14.532
    8    HD3  ARG 792           HD3      ARG 792  28.144  -6.102 -13.999
    9    HE   ARG 792           HE       ARG 792  27.663  -4.784 -11.961
   10   HH11  ARG 792          HH11      ARG 792  28.391  -3.123 -15.037
   11   HH12  ARG 792          HH12      ARG 792  27.275  -1.872 -14.743
   12   HH21  ARG 792          HH21      ARG 792  26.082  -3.083 -11.657
   13   HH22  ARG 792          HH22      ARG 792  25.882  -1.893 -12.850

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLU 793           H        GLU 793  30.605  -7.186 -16.613
    2    HA   GLU 793           HA       GLU 793  31.534  -9.805 -17.427
    3    HB2  GLU 793           HB2      GLU 793  31.569  -7.173 -18.923
    4    HB3  GLU 793           HB3      GLU 793  31.941  -8.748 -19.607
    5    HG2  GLU 793           HG2      GLU 793  29.277  -7.817 -18.560
    6    HG3  GLU 793           HG3      GLU 793  29.726  -8.061 -20.248

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ALA 794           H        ALA 794  33.741  -9.798 -18.578
    2    HA   ALA 794           HA       ALA 794  35.621  -9.113 -16.567
    3    HB2  ALA 794           HB1      ALA 794  35.858 -11.137 -17.890
    4    HB3  ALA 794           HB2      ALA 794  37.294 -10.125 -18.054
    5    HB1  ALA 794           HB3      ALA 794  36.098 -10.182 -19.350

  No H/Q in entry =           5
  In of MODEL    2
    1    H    SER 795           H        SER 795  34.456  -7.576 -19.383
    2    HA   SER 795           HA       SER 795  36.602  -5.809 -19.930
    3    HB2  SER 795           HB2      SER 795  33.664  -5.431 -20.509
    4    HB3  SER 795           HB3      SER 795  35.016  -4.653 -21.334
    5    HG   SER 795           HG       SER 795  35.549  -6.519 -22.281

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLU 796           H        GLU 796  34.243  -5.947 -17.449
    2    HA   GLU 796           HA       GLU 796  34.293  -3.077 -16.903
    3    HB2  GLU 796           HB2      GLU 796  32.733  -5.336 -15.662
    4    HB3  GLU 796           HB3      GLU 796  32.541  -3.632 -15.259
    5    HG2  GLU 796           HG2      GLU 796  31.822  -3.187 -17.564
    6    HG3  GLU 796           HG3      GLU 796  31.986  -4.898 -17.938

  No H/Q in entry =           6
  In of MODEL    2
    1    H    CYS 797           H        CYS 797  36.487  -5.108 -16.489
    2    HA   CYS 797           HA       CYS 797  36.767  -5.266 -13.635
    3    HB2  CYS 797           HB2      CYS 797  37.544  -7.103 -15.033
    4    HB3  CYS 797           HB3      CYS 797  38.669  -6.009 -15.836

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLU 798           H        GLU 798  36.919  -3.289 -12.908
    2    HA   GLU 798           HA       GLU 798  39.229  -1.714 -13.742
    3    HB2  GLU 798           HB2      GLU 798  36.740  -0.802 -12.283
    4    HB3  GLU 798           HB3      GLU 798  38.128   0.222 -12.630
    5    HG2  GLU 798           HG2      GLU 798  36.271  -1.055 -14.621
    6    HG3  GLU 798           HG3      GLU 798  36.408   0.661 -14.240

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU 799           H        GLU 799  40.259  -3.388 -12.585
    2    HA   GLU 799           HA       GLU 799  41.216  -2.568 -10.071
    3    HB2  GLU 799           HB2      GLU 799  39.065  -3.636  -9.345
    4    HB3  GLU 799           HB3      GLU 799  39.505  -5.103 -10.196
    5    HG2  GLU 799           HG2      GLU 799  39.779  -5.180  -7.718
    6    HG3  GLU 799           HG3      GLU 799  41.235  -5.571  -8.628

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLU 800           H        GLU 800  42.893  -4.402  -9.446
    2    HA   GLU 800           HA       GLU 800  44.251  -5.073 -11.853
    3    HB2  GLU 800           HB2      GLU 800  44.807  -5.873  -9.012
    4    HB3  GLU 800           HB3      GLU 800  45.792  -6.391 -10.365
    5    HG2  GLU 800           HG2      GLU 800  46.072  -3.914 -10.875
    6    HG3  GLU 800           HG3      GLU 800  45.442  -3.645  -9.247

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLY 801           H        GLY 801  43.259  -7.310  -9.273
    2    HA3  GLY 801           HA2      GLY 801  42.130  -9.266  -9.508
    3    HA2  GLY 801           HA3      GLY 801  42.114  -9.044 -11.259

  No H/Q in entry =           3
  In of MODEL    2
    1    H    PHE 802           H        PHE 802  43.404 -10.793  -8.788
    2    HA   PHE 802           HA       PHE 802  46.002 -11.235  -9.772
    3    HB2  PHE 802           HB2      PHE 802  44.301 -12.931  -7.952
    4    HB3  PHE 802           HB3      PHE 802  45.977 -13.308  -8.364
    5    HD1  PHE 802           HD1      PHE 802  47.693 -11.592  -7.947
    6    HD2  PHE 802           HD2      PHE 802  43.844 -11.416  -6.258
    7    HE1  PHE 802           HE1      PHE 802  48.493  -9.975  -6.388
    8    HE2  PHE 802           HE2      PHE 802  44.572  -9.841  -4.667
    9    HZ   PHE 802           HZ       PHE 802  46.947  -9.043  -4.675

  No H/Q in entry =           9
  In of MODEL    2
    1    H    SER 803           H        SER 803  46.757 -12.408 -11.290
    2    HA   SER 803           HA       SER 803  44.989 -13.748 -13.025
    3    HB2  SER 803           HB2      SER 803  47.260 -14.322 -14.124
    4    HB3  SER 803           HB3      SER 803  46.772 -12.629 -14.006
    5    HG   SER 803           HG       SER 803  48.979 -13.236 -13.342

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ILE 804           H        ILE 804  44.335 -15.780 -12.897
    2    HA   ILE 804           HA       ILE 804  45.856 -17.661 -11.255
    3    HB   ILE 804           HB       ILE 804  43.866 -18.593 -10.223
    4   HG12  ILE 804          HG12      ILE 804  42.252 -18.118 -12.102
    5   HG13  ILE 804          HG13      ILE 804  41.605 -17.806 -10.502
    6   HG23  ILE 804          HG21      ILE 804  44.864 -16.802  -8.989
    7   HG22  ILE 804          HG22      ILE 804  43.114 -16.739  -8.782
    8   HG21  ILE 804          HG23      ILE 804  43.919 -15.610  -9.875
    9   HD11  ILE 804          HD11      ILE 804  41.976 -15.403 -10.870
   10   HD13  ILE 804          HD12      ILE 804  40.898 -16.113 -12.070
   11   HD12  ILE 804          HD13      ILE 804  42.568 -15.754 -12.494

  No H/Q in entry =          11
  In of MODEL    2
    1    H    CYS 805           H        CYS 805  45.000 -19.978 -11.646
    2    HA   CYS 805           HA       CYS 805  44.664 -20.239 -14.535
    3    HB2  CYS 805           HB2      CYS 805  46.739 -21.208 -13.489
    4    HB3  CYS 805           HB3      CYS 805  45.688 -22.346 -12.635

  No H/Q in entry =           4
  In of MODEL    2
    1    H    VAL 806           H        VAL 806  42.710 -21.097 -15.192
    2    HA   VAL 806           HA       VAL 806  41.133 -22.619 -13.238
    3    HB   VAL 806           HB       VAL 806  40.055 -20.452 -15.066
    4   HG12  VAL 806          HG11      VAL 806  38.663 -21.985 -12.889
    5   HG11  VAL 806          HG12      VAL 806  38.460 -22.222 -14.615
    6   HG13  VAL 806          HG13      VAL 806  38.002 -20.675 -13.871
    7   HG22  VAL 806          HG21      VAL 806  41.348 -19.446 -13.326
    8   HG21  VAL 806          HG22      VAL 806  40.475 -20.353 -12.088
    9   HG23  VAL 806          HG23      VAL 806  39.635 -19.134 -13.058

  No H/Q in entry =           9
  In of MODEL    2
    1    H    GLU 807           H        GLU 807  40.158 -24.397 -14.128
    2    HA   GLU 807           HA       GLU 807  40.605 -24.974 -16.918
    3    HB2  GLU 807           HB2      GLU 807  40.863 -26.753 -15.178
    4    HB3  GLU 807           HB3      GLU 807  39.153 -26.609 -14.815
    5    HG2  GLU 807           HG2      GLU 807  38.619 -27.289 -17.111
    6    HG3  GLU 807           HG3      GLU 807  40.351 -27.433 -17.430

  No H/Q in entry =           6
  In of MODEL    2
    1    H    VAL 808           H        VAL 808  39.356 -24.237 -18.330
    2    HA   VAL 808           HA       VAL 808  36.476 -24.041 -17.954
    3    HB   VAL 808           HB       VAL 808  38.388 -21.841 -18.650
    4   HG13  VAL 808          HG11      VAL 808  36.623 -20.401 -19.403
    5   HG12  VAL 808          HG12      VAL 808  35.432 -21.703 -19.231
    6   HG11  VAL 808          HG13      VAL 808  36.719 -21.812 -20.444
    7   HG23  VAL 808          HG21      VAL 808  37.016 -20.555 -17.126
    8   HG22  VAL 808          HG22      VAL 808  37.880 -21.945 -16.455
    9   HG21  VAL 808          HG23      VAL 808  36.145 -22.062 -16.799

  No H/Q in entry =           9
  In of MODEL    2
    1    H    ASN 809           H        ASN 809  35.482 -24.769 -19.730
    2    HA   ASN 809           HA       ASN 809  35.034 -25.453 -21.871
    3    HB2  ASN 809           HB2      ASN 809  37.592 -23.989 -22.479
    4    HB3  ASN 809           HB3      ASN 809  36.803 -24.941 -23.715
    5   HD21  ASN 809          HD21      ASN 809  34.936 -23.190 -21.333
    6   HD22  ASN 809          HD22      ASN 809  34.401 -21.936 -22.375

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLY 810           H        GLY 810  37.064 -26.688 -19.861
    2    HA3  GLY 810           HA2      GLY 810  37.615 -29.019 -19.832
    3    HA2  GLY 810           HA3      GLY 810  37.635 -28.961 -21.598

  No H/Q in entry =           3
  In of MODEL    2
    1    H    LYS 811           H        LYS 811  39.155 -26.288 -20.878
    2    HA   LYS 811           HA       LYS 811  41.790 -27.592 -20.786
    3    HB2  LYS 811           HB2      LYS 811  42.556 -25.732 -22.258
    4    HB3  LYS 811           HB3      LYS 811  41.364 -26.771 -23.031
    5    HG2  LYS 811           HG2      LYS 811  39.616 -25.091 -22.414
    6    HG3  LYS 811           HG3      LYS 811  40.900 -24.037 -21.846
    7    HD2  LYS 811           HD2      LYS 811  40.628 -25.105 -24.639
    8    HD3  LYS 811           HD3      LYS 811  40.111 -23.503 -24.123
    9    HE2  LYS 811           HE2      LYS 811  42.444 -22.997 -23.478
   10    HE3  LYS 811           HE3      LYS 811  42.931 -24.580 -24.082
   11    HZ2  LYS 811           HZ1      LYS 811  41.721 -22.403 -25.702
   12    HZ1  LYS 811           HZ2      LYS 811  42.109 -23.927 -26.274
   13    HZ3  LYS 811           HZ3      LYS 811  43.329 -22.894 -25.763

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLU 812           H        GLU 812  43.434 -26.257 -19.765
    2    HA   GLU 812           HA       GLU 812  42.224 -24.538 -17.776
    3    HB2  GLU 812           HB2      GLU 812  44.986 -25.700 -18.018
    4    HB3  GLU 812           HB3      GLU 812  44.542 -24.530 -16.776
    5    HG2  GLU 812           HG2      GLU 812  42.883 -26.009 -15.894
    6    HG3  GLU 812           HG3      GLU 812  43.145 -27.154 -17.202

  No H/Q in entry =           6
  In of MODEL    2
    1    H    GLN 813           H        GLN 813  42.491 -22.457 -17.613
    2    HA   GLN 813           HA       GLN 813  44.178 -21.155 -19.583
    3    HB2  GLN 813           HB2      GLN 813  42.051 -21.364 -20.611
    4    HB3  GLN 813           HB3      GLN 813  41.224 -20.813 -19.169
    5    HG2  GLN 813           HG2      GLN 813  42.133 -18.610 -19.474
    6    HG3  GLN 813           HG3      GLN 813  43.056 -19.212 -20.869
    7   HE21  GLN 813          HE21      GLN 813  40.738 -17.204 -20.510
    8   HE22  GLN 813          HE22      GLN 813  39.600 -17.713 -21.689

  No H/Q in entry =           8
  In of MODEL    2
    1    H    THR 814           H        THR 814  44.988 -19.264 -18.938
    2    HA   THR 814           HA       THR 814  44.797 -18.569 -16.130
    3    HB   THR 814           HB       THR 814  46.376 -17.345 -18.324
    4    HG1  THR 814           HG1      THR 814  46.464 -19.773 -17.491
    5   HG21  THR 814          HG21      THR 814  46.801 -17.431 -15.330
    6   HG23  THR 814          HG22      THR 814  46.292 -16.025 -16.266
    7   HG22  THR 814          HG23      THR 814  47.910 -16.692 -16.484

  No H/Q in entry =           7
  In of MODEL    2
    1    H    MET 815           H        MET 815  43.451 -17.112 -15.554
    2    HA   MET 815           HA       MET 815  42.663 -15.043 -17.430
    3    HB2  MET 815           HB2      MET 815  40.332 -15.306 -16.526
    4    HB3  MET 815           HB3      MET 815  40.911 -16.593 -17.579
    5    HG2  MET 815           HG2      MET 815  41.515 -17.868 -15.610
    6    HG3  MET 815           HG3      MET 815  40.748 -16.662 -14.581
    7    HE1  MET 815           HE1      MET 815  40.321 -19.471 -17.121
    8    HE3  MET 815           HE2      MET 815  39.682 -18.134 -18.094
    9    HE2  MET 815           HE3      MET 815  38.614 -19.438 -17.557

  No H/Q in entry =           9
  In of MODEL    2
    1    H    SER 816           H        SER 816  41.423 -13.346 -16.217
    2    HA   SER 816           HA       SER 816  43.055 -12.580 -13.954
    3    HB2  SER 816           HB2      SER 816  40.756 -11.113 -15.254
    4    HB3  SER 816           HB3      SER 816  41.950 -10.445 -14.133
    5    HG   SER 816           HG       SER 816  42.879 -11.688 -16.452

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLU 817           H        GLU 817  42.200 -12.100 -11.947
    2    HA   GLU 817           HA       GLU 817  40.453 -13.752 -10.671
    3    HB2  GLU 817           HB2      GLU 817  42.154 -12.234  -9.764
    4    HB3  GLU 817           HB3      GLU 817  41.067 -10.920 -10.149
    5    HG2  GLU 817           HG2      GLU 817  39.531 -11.554  -8.526
    6    HG3  GLU 817           HG3      GLU 817  40.411 -13.084  -8.266

  No H/Q in entry =           6
  In of MODEL    2
    1    H    CYS 818           H        CYS 818  39.786 -10.468 -11.857
    2    HA   CYS 818           HA       CYS 818  37.095 -10.386 -11.052
    3    HB2  CYS 818           HB2      CYS 818  37.029  -8.482 -12.776
    4    HB3  CYS 818           HB3      CYS 818  38.143  -8.324 -11.418

  No H/Q in entry =           4
  In of MODEL    2
    1    H    GLU 819           H        GLU 819  38.663 -11.751 -13.752
    2    HA   GLU 819           HA       GLU 819  36.414 -11.888 -15.534
    3    HB2  GLU 819           HB2      GLU 819  38.712 -11.652 -16.261
    4    HB3  GLU 819           HB3      GLU 819  39.139 -13.167 -15.492
    5    HG2  GLU 819           HG2      GLU 819  37.960 -14.362 -17.180
    6    HG3  GLU 819           HG3      GLU 819  37.293 -12.863 -17.846

  No H/Q in entry =           6
  In of MODEL    2
    1    H    ALA 820           H        ALA 820  38.407 -14.216 -13.744
    2    HA   ALA 820           HA       ALA 820  36.794 -16.432 -14.151
    3    HB3  ALA 820           HB1      ALA 820  38.637 -15.869 -11.831
    4    HB1  ALA 820           HB2      ALA 820  39.089 -16.612 -13.366
    5    HB2  ALA 820           HB3      ALA 820  37.999 -17.454 -12.267

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLY 821           H        GLY 821  36.906 -14.055 -11.540
    2    HA3  GLY 821           HA2      GLY 821  34.979 -15.166  -9.854
    3    HA2  GLY 821           HA3      GLY 821  35.430 -13.467  -9.926

  No H/Q in entry =           3
  In of MODEL    2
    1    H    ALA 822           H        ALA 822  34.654 -12.860 -12.571
    2    HA   ALA 822           HA       ALA 822  31.921 -12.372 -12.281
    3    HB3  ALA 822           HB1      ALA 822  32.018 -11.660 -14.606
    4    HB1  ALA 822           HB2      ALA 822  33.589 -12.446 -14.786
    5    HB2  ALA 822           HB3      ALA 822  33.416 -11.060 -13.712

  No H/Q in entry =           5
  In of MODEL    2
    1    H    LEU 823           H        LEU 823  33.694 -14.760 -14.117
    2    HA   LEU 823           HA       LEU 823  31.519 -16.037 -15.341
    3    HB2  LEU 823           HB2      LEU 823  34.266 -17.041 -14.619
    4    HB3  LEU 823           HB3      LEU 823  33.161 -17.885 -15.690
    5    HG   LEU 823           HG       LEU 823  34.204 -15.105 -16.211
    6   HD12  LEU 823          HD11      LEU 823  35.657 -16.114 -17.895
    7   HD11  LEU 823          HD12      LEU 823  35.236 -17.726 -17.285
    8   HD13  LEU 823          HD13      LEU 823  36.082 -16.559 -16.255
    9   HD23  LEU 823          HD21      LEU 823  33.433 -15.604 -18.532
   10   HD22  LEU 823          HD22      LEU 823  32.147 -15.480 -17.340
   11   HD21  LEU 823          HD23      LEU 823  32.653 -17.065 -17.901

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ARG 824           H        ARG 824  33.213 -16.655 -12.336
    2    HA   ARG 824           HA       ARG 824  31.814 -18.977 -11.511
    3    HB2  ARG 824           HB2      ARG 824  33.979 -18.328 -10.604
    4    HB3  ARG 824           HB3      ARG 824  33.293 -16.860  -9.951
    5    HG2  ARG 824           HG2      ARG 824  33.689 -18.434  -8.170
    6    HG3  ARG 824           HG3      ARG 824  31.956 -18.212  -8.380
    7    HD2  ARG 824           HD2      ARG 824  33.422 -20.494  -9.665
    8    HD3  ARG 824           HD3      ARG 824  32.859 -20.607  -8.013
    9    HE   ARG 824           HE       ARG 824  30.727 -19.791  -9.657
   10   HH11  ARG 824          HH11      ARG 824  32.700 -22.676  -8.984
   11   HH12  ARG 824          HH12      ARG 824  31.479 -23.763  -9.441
   12   HH21  ARG 824          HH21      ARG 824  29.024 -21.353 -10.204
   13   HH22  ARG 824          HH22      ARG 824  29.381 -23.011 -10.090

  No H/Q in entry =          13
  In of MODEL    2
    1    H    CYS 825           H        CYS 825  31.248 -15.583 -11.079
    2    HA   CYS 825           HA       CYS 825  29.171 -15.782  -9.165
    3    HB2  CYS 825           HB2      CYS 825  30.590 -13.752  -9.575
    4    HB3  CYS 825           HB3      CYS 825  29.794 -13.570 -11.117

  No H/Q in entry =           4
  In of MODEL    2
    1    H    ARG 826           H        ARG 826  29.226 -15.369 -12.682
    2    HA   ARG 826           HA       ARG 826  26.438 -14.975 -12.926
    3    HB2  ARG 826           HB2      ARG 826  26.802 -15.134 -15.337
    4    HB3  ARG 826           HB3      ARG 826  27.937 -14.032 -14.552
    5    HG2  ARG 826           HG2      ARG 826  29.608 -15.825 -14.632
    6    HG3  ARG 826           HG3      ARG 826  28.473 -16.828 -15.527
    7    HD2  ARG 826           HD2      ARG 826  29.637 -14.181 -16.362
    8    HD3  ARG 826           HD3      ARG 826  29.952 -15.761 -17.085
    9    HE   ARG 826           HE       ARG 826  27.409 -15.662 -17.484
   10   HH11  ARG 826          HH11      ARG 826  29.725 -12.995 -17.771
   11   HH12  ARG 826          HH12      ARG 826  28.841 -12.099 -18.882
   12   HH21  ARG 826          HH21      ARG 826  26.144 -14.432 -19.072
   13   HH22  ARG 826          HH22      ARG 826  26.768 -12.970 -19.694

  No H/Q in entry =          13
  In of MODEL    2
    1    H    GLY 827           H        GLY 827  28.386 -17.906 -13.187
    2    HA3  GLY 827           HA2      GLY 827  26.943 -19.930 -12.688
    3    HA2  GLY 827           HA3      GLY 827  25.906 -19.270 -13.954

  No H/Q in entry =           3
  In of MODEL    2
    1    H    GLN 828           H        GLN 828  28.950 -18.614 -14.879
    2    HA   GLN 828           HA       GLN 828  28.988 -20.497 -16.977
    3    HB2  GLN 828           HB2      GLN 828  30.112 -18.296 -17.099
    4    HB3  GLN 828           HB3      GLN 828  31.261 -18.829 -15.884
    5    HG2  GLN 828           HG2      GLN 828  32.225 -18.946 -18.132
    6    HG3  GLN 828           HG3      GLN 828  32.108 -20.525 -17.381
    7   HE21  GLN 828          HE21      GLN 828  30.771 -18.463 -19.881
    8   HE22  GLN 828          HE22      GLN 828  29.968 -19.724 -20.723

  No H/Q in entry =           8
  In of MODEL    2
    1    H    SER 829           H        SER 829  30.375 -22.309 -17.271
    2    HA   SER 829           HA       SER 829  31.032 -23.629 -14.794
    3    HB2  SER 829           HB2      SER 829  31.091 -24.636 -17.650
    4    HB3  SER 829           HB3      SER 829  31.314 -25.625 -16.203
    5    HG   SER 829           HG       SER 829  29.217 -24.669 -15.566

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ILE 830           H        ILE 830  32.876 -23.208 -13.957
    2    HA   ILE 830           HA       ILE 830  35.422 -23.178 -15.469
    3    HB   ILE 830           HB       ILE 830  36.229 -21.261 -14.291
    4   HG12  ILE 830          HG12      ILE 830  35.021 -21.634 -12.114
    5   HG13  ILE 830          HG13      ILE 830  35.084 -19.952 -12.574
    6   HG23  ILE 830          HG21      ILE 830  35.124 -20.575 -16.257
    7   HG22  ILE 830          HG22      ILE 830  34.791 -19.376 -15.015
    8   HG21  ILE 830          HG23      ILE 830  33.553 -20.561 -15.451
    9   HD12  ILE 830          HD11      ILE 830  32.941 -20.538 -11.656
   10   HD11  ILE 830          HD12      ILE 830  32.708 -21.773 -12.891
   11   HD13  ILE 830          HD13      ILE 830  32.791 -20.066 -13.348

  No H/Q in entry =          11
  In of MODEL    2
    1    H    SER 831           H        SER 831  37.051 -24.052 -14.203
    2    HA   SER 831           HA       SER 831  36.333 -24.789 -11.486
    3    HB2  SER 831           HB2      SER 831  37.671 -26.436 -13.604
    4    HB3  SER 831           HB3      SER 831  37.553 -26.869 -11.899
    5    HG   SER 831           HG       SER 831  35.504 -26.537 -13.808

  No H/Q in entry =           5
  In of MODEL    2
    1    H    VAL 832           H        VAL 832  37.626 -23.376 -10.411
    2    HA   VAL 832           HA       VAL 832  40.119 -22.420 -11.345
    3    HB   VAL 832           HB       VAL 832  39.102 -22.486  -8.490
    4   HG13  VAL 832          HG11      VAL 832  40.628 -20.577  -8.123
    5   HG12  VAL 832          HG12      VAL 832  41.203 -20.732  -9.782
    6   HG11  VAL 832          HG13      VAL 832  41.502 -22.028  -8.621
    7   HG22  VAL 832          HG21      VAL 832  38.306 -20.196  -8.905
    8   HG21  VAL 832          HG22      VAL 832  37.517 -21.364  -9.968
    9   HG23  VAL 832          HG23      VAL 832  38.804 -20.335 -10.591

  No H/Q in entry =           9
  In of MODEL    2
    1    H    THR 833           H        THR 833  41.834 -23.710 -11.684
    2    HA   THR 833           HA       THR 833  42.122 -26.045 -10.062
    3    HB   THR 833           HB       THR 833  44.011 -26.540 -11.665
    4    HG1  THR 833           HG1      THR 833  44.130 -25.271 -13.516
    5   HG23  THR 833          HG21      THR 833  42.514 -27.079 -13.550
    6   HG22  THR 833          HG22      THR 833  41.292 -26.006 -12.879
    7   HG21  THR 833          HG23      THR 833  41.764 -27.461 -12.000

  No H/Q in entry =           7
  In of MODEL    2
    1    H    SER 834           H        SER 834  43.723 -22.973 -10.628
    2    HA   SER 834           HA       SER 834  45.220 -23.401  -8.175
    3    HB2  SER 834           HB2      SER 834  46.498 -22.661 -10.802
    4    HB3  SER 834           HB3      SER 834  47.315 -22.637  -9.257
    5    HG   SER 834           HG       SER 834  46.071 -25.010  -9.725

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ILE 835           H        ILE 835  45.653 -21.530  -7.094
    2    HA   ILE 835           HA       ILE 835  44.440 -18.987  -7.922
    3    HB   ILE 835           HB       ILE 835  45.287 -18.163  -5.807
    4   HG12  ILE 835          HG12      ILE 835  46.234 -19.898  -4.145
    5   HG13  ILE 835          HG13      ILE 835  46.683 -20.840  -5.554
    6   HG23  ILE 835          HG21      ILE 835  43.190 -19.276  -5.821
    7   HG22  ILE 835          HG22      ILE 835  44.047 -19.632  -4.310
    8   HG21  ILE 835          HG23      ILE 835  43.986 -20.839  -5.602
    9   HD11  ILE 835          HD11      ILE 835  47.607 -18.077  -4.873
   10   HD13  ILE 835          HD12      ILE 835  48.158 -19.031  -6.267
   11   HD12  ILE 835          HD13      ILE 835  48.506 -19.565  -4.608

  No H/Q in entry =          11
  In of MODEL    2
    1    H    ARG 836           H        ARG 836  47.278 -20.673  -8.435
    2    HA   ARG 836           HA       ARG 836  48.929 -18.360  -8.996
    3    HB2  ARG 836           HB2      ARG 836  49.339 -21.261  -9.686
    4    HB3  ARG 836           HB3      ARG 836  50.521 -19.987  -9.883
    5    HG2  ARG 836           HG2      ARG 836  50.524 -19.723  -7.407
    6    HG3  ARG 836           HG3      ARG 836  49.483 -21.149  -7.315
    7    HD2  ARG 836           HD2      ARG 836  51.122 -22.388  -8.649
    8    HD3  ARG 836           HD3      ARG 836  52.194 -20.999  -8.591
    9    HE   ARG 836           HE       ARG 836  51.320 -22.216  -6.088
   10   HH11  ARG 836          HH11      ARG 836  53.952 -21.505  -8.375
   11   HH12  ARG 836          HH12      ARG 836  55.189 -22.044  -7.347
   12   HH21  ARG 836          HH21      ARG 836  53.028 -23.086  -4.725
   13   HH22  ARG 836          HH22      ARG 836  54.643 -23.041  -5.248

  No H/Q in entry =          13
  In of MODEL    2
    1    HA   PRO 837           HA       PRO 837  47.433 -18.226 -13.221
    2    HB2  PRO 837           HB2      PRO 837  49.453 -16.834 -14.361
    3    HB3  PRO 837           HB3      PRO 837  48.264 -16.060 -13.316
    4    HG2  PRO 837           HG2      PRO 837  51.044 -16.953 -12.683
    5    HG3  PRO 837           HG3      PRO 837  50.213 -15.467 -12.195
    6    HD2  PRO 837           HD2      PRO 837  50.497 -17.625 -10.560
    7    HD3  PRO 837           HD3      PRO 837  49.127 -16.502 -10.455

  No H/Q in entry =           7
  In of MODEL    2
    1    H    CYS 838           H        CYS 838  47.809 -19.481 -15.087
    2    HA   CYS 838           HA       CYS 838  50.212 -20.984 -14.876
    3    HB2  CYS 838           HB2      CYS 838  49.055 -22.487 -16.695
    4    HB3  CYS 838           HB3      CYS 838  48.603 -22.676 -15.019

  No H/Q in entry =           4
  In of MODEL    2
    1    H    ALA 839           H        ALA 839  50.761 -21.766 -17.499
    2    HA   ALA 839           HA       ALA 839  51.399 -19.178 -18.655
    3    HB1  ALA 839           HB1      ALA 839  52.227 -21.958 -19.507
    4    HB2  ALA 839           HB2      ALA 839  53.160 -20.882 -18.466
    5    HB3  ALA 839           HB3      ALA 839  52.864 -20.443 -20.148

  No H/Q in entry =           5
  In of MODEL    2
    1    H    ALA 840           H        ALA 840  48.891 -21.074 -18.670
    2    HA   ALA 840           HA       ALA 840  48.278 -21.479 -21.417
    3    HB3  ALA 840           HB1      ALA 840  47.446 -23.023 -19.790
    4    HB1  ALA 840           HB2      ALA 840  46.061 -22.159 -20.526
    5    HB2  ALA 840           HB3      ALA 840  46.640 -21.719 -18.932

  No H/Q in entry =           5
  In of MODEL    2
    1    H    GLU 841           H        GLU 841  48.567 -19.244 -22.025
    2    HA   GLU 841           HA       GLU 841  46.073 -17.726 -21.676
    3    HB2  GLU 841           HB2      GLU 841  48.834 -16.783 -22.471
    4    HB3  GLU 841           HB3      GLU 841  47.402 -15.765 -22.455
    5    HG2  GLU 841           HG2      GLU 841  47.189 -16.094 -20.047
    6    HG3  GLU 841           HG3      GLU 841  48.626 -17.121 -20.063

  No H/Q in entry =           6
  In of MODEL    2
    1    H    THR 842           H        THR 842  46.146 -19.916 -23.212
    2    HA   THR 842           HA       THR 842  46.839 -19.429 -25.881
    3    HB   THR 842           HB       THR 842  45.502 -21.600 -26.190
    4    HG1  THR 842           HG1      THR 842  45.424 -22.601 -23.886
    5   HG21  THR 842          HG21      THR 842  47.769 -21.525 -24.192
    6   HG23  THR 842          HG22      THR 842  47.946 -21.531 -25.946
    7   HG22  THR 842          HG23      THR 842  47.271 -22.938 -25.121

  No H/Q in entry =           7
  In of MODEL    2
    1    H    GLN 843           H        GLN 843  45.823 -17.670 -26.631
    2    HA   GLN 843           HA       GLN 843  42.906 -17.774 -26.788
    3    HB2  GLN 843           HB2      GLN 843  43.647 -16.084 -25.139
    4    HB3  GLN 843           HB3      GLN 843  44.665 -15.341 -26.350
    5    HG2  GLN 843           HG2      GLN 843  42.671 -14.722 -27.634
    6    HG3  GLN 843           HG3      GLN 843  41.659 -15.488 -26.411
    7   HE21  GLN 843          HE21      GLN 843  40.597 -13.541 -25.997
    8   HE22  GLN 843          HE22      GLN 843  41.334 -12.252 -25.136

  No H/Q in entry =           8
  In of MODEL    3
    1    H1   GLY 689           H1       GLY 689  43.290  15.733 -14.844
    2    H2   GLY 689           H3       GLY 689  41.654  15.737 -14.423
    3    H3   GLY 689           H2       GLY 689  42.659  17.013 -13.930
    4    HA2  GLY 689           HA2      GLY 689  42.814  14.193 -13.057
    5    HA3  GLY 689           HA3      GLY 689  42.258  15.556 -12.092

  No H/Q in entry =           5
  In of MODEL    3
    1    H    SER 690           H        SER 690  43.908  14.873 -10.607
    2    HA   SER 690           HA       SER 690  46.392  16.248 -11.124
    3    HB2  SER 690           HB2      SER 690  45.398  14.786  -8.671
    4    HB3  SER 690           HB3      SER 690  46.785  15.869  -8.752
    5    HG   SER 690           HG       SER 690  44.354  16.858  -9.636

  No H/Q in entry =           5
  In of MODEL    3
    1    H    HIS 691           H        HIS 691  48.353  15.178 -11.244
    2    HA   HIS 691           HA       HIS 691  48.130  12.330 -11.663
    3    HB2  HIS 691           HB2      HIS 691  50.443  12.367 -12.582
    4    HB3  HIS 691           HB3      HIS 691  49.409  13.509 -13.402
    5    HD1  HIS 691           HD1      HIS 691  49.884  16.110 -12.817
    6    HD2  HIS 691           HD2      HIS 691  52.751  13.395 -11.518
    7    HE1  HIS 691           HE1      HIS 691  51.915  17.467 -12.313
    8    HE2  HIS 691           HE2      HIS 691  53.696  15.754 -11.934

  No H/Q in entry =           8
  In of MODEL    3
    1    H    MET 692           H        MET 692  47.819  11.512  -9.742
    2    HA   MET 692           HA       MET 692  49.335  12.229  -7.425
    3    HB2  MET 692           HB2      MET 692  47.057  11.298  -7.233
    4    HB3  MET 692           HB3      MET 692  47.622   9.778  -7.912
    5    HG2  MET 692           HG2      MET 692  49.132   9.503  -5.982
    6    HG3  MET 692           HG3      MET 692  48.493  10.990  -5.294
    7    HE1  MET 692           HE1      MET 692  47.935   9.749  -3.048
    8    HE3  MET 692           HE2      MET 692  48.578   8.243  -3.708
    9    HE2  MET 692           HE3      MET 692  46.985   8.266  -2.950

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ASN 693           H        ASN 693  49.446   9.723  -9.820
    2    HA   ASN 693           HA       ASN 693  51.885   8.693  -8.616
    3    HB2  ASN 693           HB2      ASN 693  51.605   6.726 -10.046
    4    HB3  ASN 693           HB3      ASN 693  50.120   7.006  -9.149
    5   HD21  ASN 693          HD21      ASN 693  51.621   6.975 -12.307
    6   HD22  ASN 693          HD22      ASN 693  50.156   7.118 -13.200

  No H/Q in entry =           6
  In of MODEL    3
    1    HA   PRO 694           HA       PRO 694  53.968  10.701 -12.059
    2    HB2  PRO 694           HB2      PRO 694  56.249   8.933 -11.532
    3    HB3  PRO 694           HB3      PRO 694  56.156  10.685 -11.353
    4    HG2  PRO 694           HG2      PRO 694  56.335   9.025  -9.230
    5    HG3  PRO 694           HG3      PRO 694  55.450  10.561  -9.166
    6    HD2  PRO 694           HD2      PRO 694  54.389   7.777  -9.494
    7    HD3  PRO 694           HD3      PRO 694  53.775   9.124  -8.504

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LEU 695           H        LEU 695  54.990   9.913 -14.103
    2    HA   LEU 695           HA       LEU 695  53.677   7.470 -14.930
    3    HB2  LEU 695           HB2      LEU 695  55.240   9.522 -16.502
    4    HB3  LEU 695           HB3      LEU 695  54.417   8.141 -17.202
    5    HG   LEU 695           HG       LEU 695  53.060  10.411 -15.739
    6   HD11  LEU 695          HD11      LEU 695  53.974  11.125 -17.878
    7   HD13  LEU 695          HD12      LEU 695  52.215  11.053 -17.926
    8   HD12  LEU 695          HD13      LEU 695  53.168   9.773 -18.676
    9   HD23  LEU 695          HD21      LEU 695  50.990   9.408 -16.614
   10   HD22  LEU 695          HD22      LEU 695  51.827   8.335 -15.498
   11   HD21  LEU 695          HD23      LEU 695  51.924   8.050 -17.240

  No H/Q in entry =          11
  In of MODEL    3
    1    H    THR 696           H        THR 696  54.655   5.615 -15.312
    2    HA   THR 696           HA       THR 696  57.105   5.085 -14.145
    3    HB   THR 696           HB       THR 696  55.377   3.356 -14.397
    4    HG1  THR 696           HG1      THR 696  57.433   2.214 -15.887
    5   HG21  THR 696          HG21      THR 696  54.573   3.911 -16.660
    6   HG23  THR 696          HG22      THR 696  55.023   2.208 -16.549
    7   HG22  THR 696          HG23      THR 696  56.104   3.357 -17.337

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLN 697           H        GLN 697  59.123   4.945 -14.808
    2    HA   GLN 697           HA       GLN 697  59.729   5.763 -17.531
    3    HB2  GLN 697           HB2      GLN 697  60.928   6.943 -15.735
    4    HB3  GLN 697           HB3      GLN 697  61.515   5.415 -15.099
    5    HG2  GLN 697           HG2      GLN 697  63.243   6.611 -16.341
    6    HG3  GLN 697           HG3      GLN 697  62.854   5.067 -17.088
    7   HE21  GLN 697          HE21      GLN 697  63.640   5.697 -19.055
    8   HE22  GLN 697          HE22      GLN 697  62.881   6.841 -20.085

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ALA 698           H        ALA 698  59.544   4.148 -18.822
    2    HA   ALA 698           HA       ALA 698  59.796   2.212 -19.898
    3    HB2  ALA 698           HB1      ALA 698  61.881   1.475 -17.818
    4    HB1  ALA 698           HB2      ALA 698  62.213   2.297 -19.342
    5    HB3  ALA 698           HB3      ALA 698  61.608   0.639 -19.349

  No H/Q in entry =           5
  In of MODEL    3
    1    H    VAL 699           H        VAL 699  59.651  -0.341 -19.396
    2    HA   VAL 699           HA       VAL 699  57.604  -0.505 -17.312
    3    HB   VAL 699           HB       VAL 699  57.784  -2.161 -19.852
    4   HG12  VAL 699          HG11      VAL 699  55.651  -2.109 -17.715
    5   HG11  VAL 699          HG12      VAL 699  56.794  -3.417 -18.015
    6   HG13  VAL 699          HG13      VAL 699  55.569  -3.023 -19.223
    7   HG22  VAL 699          HG21      VAL 699  55.750  -0.968 -20.565
    8   HG21  VAL 699          HG22      VAL 699  57.110   0.134 -20.346
    9   HG23  VAL 699          HG23      VAL 699  55.847   0.039 -19.121

  No H/Q in entry =           9
  In of MODEL    3
    1    HA   PRO 700           HA       PRO 700  60.535  -3.597 -15.841
    2    HB2  PRO 700           HB2      PRO 700  60.044  -3.213 -13.219
    3    HB3  PRO 700           HB3      PRO 700  61.091  -2.124 -14.130
    4    HG2  PRO 700           HG2      PRO 700  58.333  -1.695 -13.146
    5    HG3  PRO 700           HG3      PRO 700  59.614  -0.516 -13.470
    6    HD2  PRO 700           HD2      PRO 700  57.408  -1.161 -15.139
    7    HD3  PRO 700           HD3      PRO 700  58.780  -0.107 -15.526

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LYS 701           H        LYS 701  60.148  -5.627 -14.794
    2    HA   LYS 701           HA       LYS 701  57.301  -6.246 -14.808
    3    HB2  LYS 701           HB2      LYS 701  59.618  -8.002 -15.555
    4    HB3  LYS 701           HB3      LYS 701  57.980  -8.592 -15.319
    5    HG2  LYS 701           HG2      LYS 701  57.212  -7.099 -17.127
    6    HG3  LYS 701           HG3      LYS 701  58.881  -6.588 -17.379
    7    HD2  LYS 701           HD2      LYS 701  59.539  -8.824 -17.872
    8    HD3  LYS 701           HD3      LYS 701  57.912  -9.434 -17.564
    9    HE2  LYS 701           HE2      LYS 701  57.075  -8.065 -19.439
   10    HE3  LYS 701           HE3      LYS 701  58.718  -7.508 -19.750
   11    HZ1  LYS 701           HZ1      LYS 701  59.352  -9.815 -20.219
   12    HZ3  LYS 701           HZ2      LYS 701  58.101  -9.336 -21.232
   13    HZ2  LYS 701           HZ3      LYS 701  57.781 -10.322 -19.932

  No H/Q in entry =          13
  In of MODEL    3
    1    H    CYS 702           H        CYS 702  56.417  -6.855 -13.060
    2    HA   CYS 702           HA       CYS 702  57.946  -8.352 -11.106
    3    HB2  CYS 702           HB2      CYS 702  55.963  -6.101 -10.438
    4    HB3  CYS 702           HB3      CYS 702  56.511  -7.311  -9.345

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLN 703           H        GLN 703  56.668  -9.934 -10.076
    2    HA   GLN 703           HA       GLN 703  54.477 -10.777 -11.757
    3    HB2  GLN 703           HB2      GLN 703  55.337 -11.901  -9.089
    4    HB3  GLN 703           HB3      GLN 703  54.315 -12.693 -10.277
    5    HG2  GLN 703           HG2      GLN 703  57.237 -12.035 -10.565
    6    HG3  GLN 703           HG3      GLN 703  56.540 -13.632 -10.334
    7   HE21  GLN 703          HE21      GLN 703  54.357 -13.193 -12.244
    8   HE22  GLN 703          HE22      GLN 703  55.080 -13.206 -13.804

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ARG 704           H        ARG 704  52.478 -11.562 -10.545
    2    HA   ARG 704           HA       ARG 704  51.072  -9.197 -10.266
    3    HB2  ARG 704           HB2      ARG 704  50.375 -11.435 -11.172
    4    HB3  ARG 704           HB3      ARG 704  50.214 -11.969  -9.512
    5    HG2  ARG 704           HG2      ARG 704  48.143 -11.414 -10.470
    6    HG3  ARG 704           HG3      ARG 704  48.538 -10.318  -9.130
    7    HD2  ARG 704           HD2      ARG 704  47.576  -8.988 -10.939
    8    HD3  ARG 704           HD3      ARG 704  49.311  -8.689 -10.807
    9    HE   ARG 704           HE       ARG 704  49.470 -10.384 -12.685
   10   HH11  ARG 704          HH11      ARG 704  46.644  -8.204 -12.389
   11   HH12  ARG 704          HH12      ARG 704  46.583  -7.849 -14.024
   12   HH21  ARG 704          HH21      ARG 704  49.320  -9.877 -14.993
   13   HH22  ARG 704          HH22      ARG 704  48.100  -8.829 -15.537

  No H/Q in entry =          13
  In of MODEL    3
    1    H    TRP 705           H        TRP 705  52.654 -11.120  -7.906
    2    HA   TRP 705           HA       TRP 705  51.326  -9.791  -5.638
    3    HB2  TRP 705           HB2      TRP 705  52.354 -11.623  -4.335
    4    HB3  TRP 705           HB3      TRP 705  51.238 -12.195  -5.571
    5    HD1  TRP 705           HD1      TRP 705  54.892 -12.235  -4.585
    6    HE1  TRP 705           HE1      TRP 705  56.149 -13.904  -6.018
    7    HE3  TRP 705           HE3      TRP 705  51.190 -13.321  -7.929
    8    HZ2  TRP 705           HZ2      TRP 705  55.639 -15.521  -8.323
    9    HZ3  TRP 705           HZ3      TRP 705  51.654 -14.941  -9.717
   10    HH2  TRP 705           HH2      TRP 705  53.828 -16.017  -9.908

  No H/Q in entry =          10
  In of MODEL    3
    1    H    GLU 706           H        GLU 706  53.731  -9.035  -7.600
    2    HA   GLU 706           HA       GLU 706  55.508  -8.188  -5.430
    3    HB2  GLU 706           HB2      GLU 706  56.323  -8.864  -8.281
    4    HB3  GLU 706           HB3      GLU 706  57.353  -8.186  -7.041
    5    HG2  GLU 706           HG2      GLU 706  57.057 -10.219  -5.726
    6    HG3  GLU 706           HG3      GLU 706  56.059 -10.888  -7.019

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS 707           H        LYS 707  56.620  -6.227  -5.804
    2    HA   LYS 707           HA       LYS 707  55.205  -4.383  -7.568
    3    HB2  LYS 707           HB2      LYS 707  54.939  -2.730  -5.785
    4    HB3  LYS 707           HB3      LYS 707  54.012  -4.190  -5.464
    5    HG2  LYS 707           HG2      LYS 707  55.473  -4.879  -3.754
    6    HG3  LYS 707           HG3      LYS 707  56.738  -3.772  -4.277
    7    HD2  LYS 707           HD2      LYS 707  55.637  -2.998  -2.228
    8    HD3  LYS 707           HD3      LYS 707  55.403  -1.868  -3.554
    9    HE2  LYS 707           HE2      LYS 707  53.169  -2.872  -3.935
   10    HE3  LYS 707           HE3      LYS 707  53.432  -3.892  -2.520
   11    HZ3  LYS 707           HZ1      LYS 707  52.151  -2.036  -1.919
   12    HZ2  LYS 707           HZ2      LYS 707  53.238  -0.922  -2.551
   13    HZ1  LYS 707           HZ3      LYS 707  53.650  -1.835  -1.196

  No H/Q in entry =          13
  In of MODEL    3
    1    H    LEU 708           H        LEU 708  56.304  -2.431  -7.873
    2    HA   LEU 708           HA       LEU 708  59.186  -2.613  -7.535
    3    HB2  LEU 708           HB2      LEU 708  58.247  -2.119  -9.774
    4    HB3  LEU 708           HB3      LEU 708  57.456  -0.701  -9.120
    5    HG   LEU 708           HG       LEU 708  59.763   0.173  -8.550
    6   HD12  LEU 708          HD11      LEU 708  61.638  -0.720  -9.831
    7   HD11  LEU 708          HD12      LEU 708  60.621  -2.053 -10.381
    8   HD13  LEU 708          HD13      LEU 708  61.006  -1.885  -8.669
    9   HD23  LEU 708          HD21      LEU 708  60.179   0.950 -10.845
   10   HD22  LEU 708          HD22      LEU 708  58.480   1.057 -10.398
   11   HD21  LEU 708          HD23      LEU 708  59.037  -0.255 -11.440

  No H/Q in entry =          11
  In of MODEL    3
    1    H    GLN 709           H        GLN 709  59.842  -1.740  -5.641
    2    HA   GLN 709           HA       GLN 709  59.023   0.977  -5.053
    3    HB2  GLN 709           HB2      GLN 709  58.500   0.612  -2.753
    4    HB3  GLN 709           HB3      GLN 709  57.607  -0.629  -3.617
    5    HG2  GLN 709           HG2      GLN 709  59.297  -2.267  -3.039
    6    HG3  GLN 709           HG3      GLN 709  60.227  -1.019  -2.206
    7   HE21  GLN 709          HE21      GLN 709  60.103  -2.042  -0.257
    8   HE22  GLN 709          HE22      GLN 709  58.655  -2.135   0.674

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ASN 710           H        ASN 710  60.662   2.077  -3.951
    2    HA   ASN 710           HA       ASN 710  62.845   2.571  -3.371
    3    HB2  ASN 710           HB2      ASN 710  62.333   0.571  -1.826
    4    HB3  ASN 710           HB3      ASN 710  63.218  -0.420  -2.949
    5   HD21  ASN 710          HD21      ASN 710  63.390   1.793  -0.408
    6   HD22  ASN 710          HD22      ASN 710  65.111   1.805  -0.208

  No H/Q in entry =           6
  In of MODEL    3
    1    H    SER 711           H        SER 711  61.956   1.695  -6.089
    2    HA   SER 711           HA       SER 711  62.711   1.378  -8.186
    3    HB2  SER 711           HB2      SER 711  64.394   3.124  -7.436
    4    HB3  SER 711           HB3      SER 711  65.495   1.808  -7.053
    5    HG   SER 711           HG       SER 711  65.871   1.486  -9.089

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ARG 712           H        ARG 712  62.581  -0.889  -6.198
    2    HA   ARG 712           HA       ARG 712  63.986  -2.844  -7.837
    3    HB2  ARG 712           HB2      ARG 712  64.607  -4.112  -5.815
    4    HB3  ARG 712           HB3      ARG 712  65.409  -2.548  -5.902
    5    HG2  ARG 712           HG2      ARG 712  63.765  -1.654  -4.332
    6    HG3  ARG 712           HG3      ARG 712  63.021  -3.244  -4.232
    7    HD2  ARG 712           HD2      ARG 712  65.090  -4.181  -3.371
    8    HD3  ARG 712           HD3      ARG 712  65.894  -2.624  -3.555
    9    HE   ARG 712           HE       ARG 712  63.596  -2.490  -1.856
   10   HH11  ARG 712          HH11      ARG 712  67.052  -3.208  -1.939
   11   HH12  ARG 712          HH12      ARG 712  67.305  -2.979  -0.277
   12   HH21  ARG 712          HH21      ARG 712  63.933  -2.139   0.435
   13   HH22  ARG 712          HH22      ARG 712  65.475  -2.347   1.114

  No H/Q in entry =          13
  In of MODEL    3
    1    H    CYS 713           H        CYS 713  63.096  -5.087  -7.380
    2    HA   CYS 713           HA       CYS 713  60.221  -4.741  -7.030
    3    HB2  CYS 713           HB2      CYS 713  60.980  -5.607  -9.268
    4    HB3  CYS 713           HB3      CYS 713  61.613  -7.034  -8.440

  No H/Q in entry =           4
  In of MODEL    3
    1    H    VAL 714           H        VAL 714  59.358  -5.491  -5.289
    2    HA   VAL 714           HA       VAL 714  60.628  -7.709  -3.839
    3    HB   VAL 714           HB       VAL 714  59.877  -6.673  -1.702
    4   HG11  VAL 714          HG11      VAL 714  61.670  -4.881  -3.334
    5   HG13  VAL 714          HG12      VAL 714  62.172  -6.287  -2.396
    6   HG12  VAL 714          HG13      VAL 714  61.536  -4.861  -1.578
    7   HG21  VAL 714          HG21      VAL 714  59.145  -4.305  -3.430
    8   HG23  VAL 714          HG22      VAL 714  59.168  -4.301  -1.671
    9   HG22  VAL 714          HG23      VAL 714  58.025  -5.330  -2.536

  No H/Q in entry =           9
  In of MODEL    3
    1    H    CYS 715           H        CYS 715  58.807  -8.509  -2.129
    2    HA   CYS 715           HA       CYS 715  56.512  -9.114  -3.824
    3    HB2  CYS 715           HB2      CYS 715  56.937 -10.027  -0.945
    4    HB3  CYS 715           HB3      CYS 715  55.920 -10.761  -2.168

  No H/Q in entry =           4
  In of MODEL    3
    1    H    LYS 716           H        LYS 716  54.382  -8.515  -3.148
    2    HA   LYS 716           HA       LYS 716  54.185  -6.003  -1.824
    3    HB2  LYS 716           HB2      LYS 716  52.034  -8.003  -2.567
    4    HB3  LYS 716           HB3      LYS 716  51.722  -6.372  -1.993
    5    HG2  LYS 716           HG2      LYS 716  52.715  -5.431  -3.969
    6    HG3  LYS 716           HG3      LYS 716  53.255  -7.021  -4.507
    7    HD2  LYS 716           HD2      LYS 716  51.261  -6.332  -5.739
    8    HD3  LYS 716           HD3      LYS 716  50.917  -7.735  -4.735
    9    HE2  LYS 716           HE2      LYS 716  49.869  -6.281  -3.062
   10    HE3  LYS 716           HE3      LYS 716  50.231  -4.873  -4.058
   11    HZ3  LYS 716           HZ1      LYS 716  47.954  -5.590  -4.382
   12    HZ2  LYS 716           HZ2      LYS 716  48.442  -7.127  -4.835
   13    HZ1  LYS 716           HZ3      LYS 716  48.792  -5.795  -5.800

  No H/Q in entry =          13
  In of MODEL    3
    1    H    MET 717           H        MET 717  52.200  -5.981  -0.053
    2    HA   MET 717           HA       MET 717  53.100  -7.852   2.002
    3    HB2  MET 717           HB2      MET 717  51.959  -5.071   2.358
    4    HB3  MET 717           HB3      MET 717  52.422  -6.147   3.667
    5    HG2  MET 717           HG2      MET 717  54.260  -4.935   1.606
    6    HG3  MET 717           HG3      MET 717  54.137  -4.472   3.299
    7    HE1  MET 717           HE1      MET 717  53.962  -7.263   4.815
    8    HE3  MET 717           HE2      MET 717  55.045  -5.966   5.315
    9    HE2  MET 717           HE3      MET 717  55.666  -7.602   5.113

  No H/Q in entry =           9
  In of MODEL    3
    1    HA   PRO 718           HA       PRO 718  49.267  -9.804   1.746
    2    HB2  PRO 718           HB2      PRO 718  48.852 -10.653   4.320
    3    HB3  PRO 718           HB3      PRO 718  49.976 -11.409   3.191
    4    HG2  PRO 718           HG2      PRO 718  50.534  -9.418   5.356
    5    HG3  PRO 718           HG3      PRO 718  51.447 -10.875   4.917
    6    HD2  PRO 718           HD2      PRO 718  52.241  -8.426   4.178
    7    HD3  PRO 718           HD3      PRO 718  52.467  -9.834   3.116

  No H/Q in entry =           7
  In of MODEL    3
    1    H    TYR 719           H        TYR 719  49.443  -7.265   4.120
    2    HA   TYR 719           HA       TYR 719  46.594  -7.208   4.553
    3    HB2  TYR 719           HB2      TYR 719  46.980  -5.230   5.923
    4    HB3  TYR 719           HB3      TYR 719  48.177  -6.449   6.321
    5    HD1  TYR 719           HD1      TYR 719  50.562  -6.115   5.582
    6    HD2  TYR 719           HD2      TYR 719  47.594  -3.116   5.041
    7    HE1  TYR 719           HE1      TYR 719  52.321  -4.425   5.270
    8    HE2  TYR 719           HE2      TYR 719  49.344  -1.427   4.708
    9    HH   TYR 719           HH       TYR 719  52.501  -2.155   4.068

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLU 720           H        GLU 720  48.716  -6.027   2.209
    2    HA   GLU 720           HA       GLU 720  47.104  -3.754   1.398
    3    HB2  GLU 720           HB2      GLU 720  49.647  -3.851   1.409
    4    HB3  GLU 720           HB3      GLU 720  49.529  -4.970   0.067
    5    HG2  GLU 720           HG2      GLU 720  48.377  -3.221  -1.232
    6    HG3  GLU 720           HG3      GLU 720  48.627  -2.105   0.109

  No H/Q in entry =           6
  In of MODEL    3
    1    H    CYS 721           H        CYS 721  46.784  -6.941   1.146
    2    HA   CYS 721           HA       CYS 721  45.949  -7.017  -1.617
    3    HB2  CYS 721           HB2      CYS 721  46.193  -9.141   0.493
    4    HB3  CYS 721           HB3      CYS 721  45.464  -9.443  -1.077

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLY 722           H        GLY 722  44.106  -6.157  -1.971
    2    HA3  GLY 722           HA2      GLY 722  41.863  -6.759  -0.179
    3    HA2  GLY 722           HA3      GLY 722  41.953  -5.356  -1.245

  No H/Q in entry =           3
  In of MODEL    3
    1    HA   PRO 723           HA       PRO 723  40.003  -7.554  -4.560
    2    HB2  PRO 723           HB2      PRO 723  41.610  -7.083  -6.737
    3    HB3  PRO 723           HB3      PRO 723  40.549  -5.860  -6.027
    4    HG2  PRO 723           HG2      PRO 723  43.469  -6.291  -5.579
    5    HG3  PRO 723           HG3      PRO 723  42.599  -4.781  -5.916
    6    HD2  PRO 723           HD2      PRO 723  43.308  -5.420  -3.433
    7    HD3  PRO 723           HD3      PRO 723  41.746  -4.644  -3.760

  No H/Q in entry =           7
  In of MODEL    3
    1    H    SER 724           H        SER 724  39.967  -9.764  -4.428
    2    HA   SER 724           HA       SER 724  41.700 -11.372  -5.963
    3    HB2  SER 724           HB2      SER 724  42.067 -11.440  -2.999
    4    HB3  SER 724           HB3      SER 724  42.389 -12.848  -4.007
    5    HG   SER 724           HG       SER 724  43.408 -10.479  -4.863

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU 725           H        LEU 725  40.987 -13.480  -6.201
    2    HA   LEU 725           HA       LEU 725  38.353 -14.250  -5.373
    3    HB2  LEU 725           HB2      LEU 725  40.640 -15.644  -6.626
    4    HB3  LEU 725           HB3      LEU 725  39.374 -16.582  -5.891
    5    HG   LEU 725           HG       LEU 725  38.628 -16.564  -7.950
    6   HD11  LEU 725          HD11      LEU 725  36.894 -15.764  -6.740
    7   HD13  LEU 725          HD12      LEU 725  36.867 -15.295  -8.435
    8   HD12  LEU 725          HD13      LEU 725  37.315 -14.114  -7.217
    9   HD21  LEU 725          HD21      LEU 725  40.430 -15.379  -8.987
   10   HD23  LEU 725          HD22      LEU 725  39.708 -13.851  -8.468
   11   HD22  LEU 725          HD23      LEU 725  38.877 -14.864  -9.647

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ASP 726           H        ASP 726  37.810 -15.055  -3.425
    2    HA   ASP 726           HA       ASP 726  39.797 -15.743  -1.509
    3    HB2  ASP 726           HB2      ASP 726  36.794 -16.155  -1.531
    4    HB3  ASP 726           HB3      ASP 726  37.821 -16.661  -0.198

  No H/Q in entry =           4
  In of MODEL    3
    1    H    VAL 727           H        VAL 727  40.490 -17.687  -0.928
    2    HA   VAL 727           HA       VAL 727  39.454 -20.072  -2.261
    3    HB   VAL 727           HB       VAL 727  41.804 -20.844  -2.719
    4   HG12  VAL 727          HG11      VAL 727  42.089 -19.559  -4.795
    5   HG11  VAL 727          HG12      VAL 727  40.919 -18.377  -4.209
    6   HG13  VAL 727          HG13      VAL 727  40.409 -20.034  -4.539
    7   HG21  VAL 727          HG21      VAL 727  42.972 -19.301  -1.220
    8   HG23  VAL 727          HG22      VAL 727  42.513 -17.943  -2.248
    9   HG22  VAL 727          HG23      VAL 727  43.599 -19.190  -2.861

  No H/Q in entry =           9
  In of MODEL    3
    1    H    CYS 728           H        CYS 728  40.133 -22.063  -1.187
    2    HA   CYS 728           HA       CYS 728  40.732 -21.589   1.629
    3    HB2  CYS 728           HB2      CYS 728  39.729 -24.080   0.244
    4    HB3  CYS 728           HB3      CYS 728  40.031 -23.932   1.964

  No H/Q in entry =           4
  In of MODEL    3
    1    H    ALA 729           H        ALA 729  42.692 -21.920   2.311
    2    HA   ALA 729           HA       ALA 729  44.412 -23.770   0.823
    3    HB1  ALA 729           HB1      ALA 729  45.167 -21.198   2.199
    4    HB3  ALA 729           HB2      ALA 729  45.098 -21.446   0.456
    5    HB2  ALA 729           HB3      ALA 729  46.295 -22.310   1.426

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLN 730           H        GLN 730  46.048 -24.715   2.224
    2    HA   GLN 730           HA       GLN 730  45.022 -24.984   4.951
    3    HB2  GLN 730           HB2      GLN 730  45.063 -27.082   3.611
    4    HB3  GLN 730           HB3      GLN 730  46.789 -26.868   3.422
    5    HG2  GLN 730           HG2      GLN 730  47.169 -27.088   5.765
    6    HG3  GLN 730           HG3      GLN 730  45.447 -27.182   6.092
    7   HE21  GLN 730          HE21      GLN 730  45.555 -29.234   7.013
    8   HE22  GLN 730          HE22      GLN 730  45.883 -30.627   6.054

  No H/Q in entry =           8
  In of MODEL    3
    1    H    ASP 731           H        ASP 731  46.179 -24.316   6.476
    2    HA   ASP 731           HA       ASP 731  48.760 -23.103   6.051
    3    HB2  ASP 731           HB2      ASP 731  47.192 -22.075   7.624
    4    HB3  ASP 731           HB3      ASP 731  47.079 -23.577   8.499

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLU 732           H        GLU 732  50.667 -24.163   6.292
    2    HA   GLU 732           HA       GLU 732  50.565 -26.905   7.110
    3    HB2  GLU 732           HB2      GLU 732  52.853 -25.176   6.202
    4    HB3  GLU 732           HB3      GLU 732  53.042 -26.864   6.657
    5    HG2  GLU 732           HG2      GLU 732  51.308 -25.812   4.426
    6    HG3  GLU 732           HG3      GLU 732  52.871 -26.610   4.243

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ARG 733           H        ARG 733  50.980 -24.000   8.742
    2    HA   ARG 733           HA       ARG 733  52.711 -24.994  10.773
    3    HB2  ARG 733           HB2      ARG 733  52.647 -22.623  10.244
    4    HB3  ARG 733           HB3      ARG 733  50.943 -22.540  10.663
    5    HG2  ARG 733           HG2      ARG 733  52.353 -21.584  12.409
    6    HG3  ARG 733           HG3      ARG 733  51.495 -23.011  12.988
    7    HD2  ARG 733           HD2      ARG 733  53.831 -22.997  13.727
    8    HD3  ARG 733           HD3      ARG 733  53.464 -24.360  12.667
    9    HE   ARG 733           HE       ARG 733  54.557 -22.052  11.343
   10   HH11  ARG 733          HH11      ARG 733  55.287 -25.132  12.959
   11   HH12  ARG 733          HH12      ARG 733  56.790 -25.339  12.203
   12   HH21  ARG 733          HH21      ARG 733  56.637 -22.298  10.341
   13   HH22  ARG 733          HH22      ARG 733  57.590 -23.674  10.639

  No H/Q in entry =          13
  In of MODEL    3
    1    H    SER 734           H        SER 734  49.261 -24.225  10.615
    2    HA   SER 734           HA       SER 734  48.816 -25.679  13.123
    3    HB2  SER 734           HB2      SER 734  46.805 -24.097  11.554
    4    HB3  SER 734           HB3      SER 734  46.810 -24.448  13.287
    5    HG   SER 734           HG       SER 734  48.480 -22.743  11.795

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LYS 735           H        LYS 735  48.654 -26.263   9.796
    2    HA   LYS 735           HA       LYS 735  47.791 -27.770   8.432
    3    HB2  LYS 735           HB2      LYS 735  47.349 -29.357  10.963
    4    HB3  LYS 735           HB3      LYS 735  47.185 -30.017   9.342
    5    HG2  LYS 735           HG2      LYS 735  49.697 -28.921  10.602
    6    HG3  LYS 735           HG3      LYS 735  49.343 -30.612  10.261
    7    HD2  LYS 735           HD2      LYS 735  49.641 -28.423   8.183
    8    HD3  LYS 735           HD3      LYS 735  50.875 -29.589   8.599
    9    HE2  LYS 735           HE2      LYS 735  49.388 -31.416   7.843
   10    HE3  LYS 735           HE3      LYS 735  48.156 -30.225   7.428
   11    HZ2  LYS 735           HZ1      LYS 735  50.854 -30.417   6.187
   12    HZ1  LYS 735           HZ2      LYS 735  49.708 -29.290   5.755
   13    HZ3  LYS 735           HZ3      LYS 735  49.422 -30.921   5.487

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ARG 736           H        ARG 736  46.034 -25.705   9.322
    2    HA   ARG 736           HA       ARG 736  43.440 -27.088   9.209
    3    HB2  ARG 736           HB2      ARG 736  42.451 -25.060  10.094
    4    HB3  ARG 736           HB3      ARG 736  43.700 -25.696  11.156
    5    HG2  ARG 736           HG2      ARG 736  45.256 -24.040  10.319
    6    HG3  ARG 736           HG3      ARG 736  44.007 -23.409   9.253
    7    HD2  ARG 736           HD2      ARG 736  44.274 -22.122  11.251
    8    HD3  ARG 736           HD3      ARG 736  42.643 -22.791  11.129
    9    HE   ARG 736           HE       ARG 736  43.835 -24.613  12.660
   10   HH11  ARG 736          HH11      ARG 736  43.945 -21.076  12.951
   11   HH12  ARG 736          HH12      ARG 736  44.116 -21.084  14.644
   12   HH21  ARG 736          HH21      ARG 736  44.117 -24.619  14.995
   13   HH22  ARG 736          HH22      ARG 736  44.238 -23.148  15.817

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ILE 737           H        ILE 737  41.824 -26.294   7.771
    2    HA   ILE 737           HA       ILE 737  42.924 -25.061   5.388
    3    HB   ILE 737           HB       ILE 737  40.033 -25.790   5.898
    4   HG12  ILE 737          HG12      ILE 737  41.474 -27.806   6.278
    5   HG13  ILE 737          HG13      ILE 737  40.395 -27.977   4.905
    6   HG21  ILE 737          HG21      ILE 737  40.606 -24.323   4.001
    7   HG23  ILE 737          HG22      ILE 737  39.885 -25.851   3.502
    8   HG22  ILE 737          HG23      ILE 737  41.625 -25.608   3.341
    9   HD13  ILE 737          HD11      ILE 737  42.577 -28.889   4.410
   10   HD12  ILE 737          HD12      ILE 737  43.329 -27.338   4.798
   11   HD11  ILE 737          HD13      ILE 737  42.244 -27.474   3.408

  No H/Q in entry =          11
  In of MODEL    3
    1    H    LEU 738           H        LEU 738  42.842 -22.901   5.207
    2    HA   LEU 738           HA       LEU 738  40.673 -21.543   6.572
    3    HB2  LEU 738           HB2      LEU 738  42.040 -19.698   7.304
    4    HB3  LEU 738           HB3      LEU 738  42.694 -21.183   7.970
    5    HG   LEU 738           HG       LEU 738  43.835 -19.599   5.657
    6   HD13  LEU 738          HD11      LEU 738  45.597 -18.978   7.236
    7   HD12  LEU 738          HD12      LEU 738  44.741 -19.829   8.520
    8   HD11  LEU 738          HD13      LEU 738  44.017 -18.408   7.766
    9   HD22  LEU 738          HD21      LEU 738  44.330 -21.909   5.485
   10   HD21  LEU 738          HD22      LEU 738  44.842 -21.971   7.168
   11   HD23  LEU 738          HD23      LEU 738  45.805 -21.058   5.981

  No H/Q in entry =          11
  In of MODEL    3
    1    HA   PRO 739           HA       PRO 739  40.049 -19.503   2.752
    2    HB2  PRO 739           HB2      PRO 739  38.685 -17.354   3.653
    3    HB3  PRO 739           HB3      PRO 739  37.980 -18.986   3.626
    4    HG2  PRO 739           HG2      PRO 739  39.195 -17.497   5.907
    5    HG3  PRO 739           HG3      PRO 739  37.703 -18.459   5.875
    6    HD2  PRO 739           HD2      PRO 739  40.109 -19.458   6.806
    7    HD3  PRO 739           HD3      PRO 739  38.854 -20.457   6.021

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LEU 740           H        LEU 740  41.583 -18.552   1.755
    2    HA   LEU 740           HA       LEU 740  42.865 -16.104   2.779
    3    HB2  LEU 740           HB2      LEU 740  44.003 -18.361   1.155
    4    HB3  LEU 740           HB3      LEU 740  44.745 -16.784   1.248
    5    HG   LEU 740           HG       LEU 740  44.349 -18.701   3.540
    6   HD13  LEU 740          HD11      LEU 740  46.762 -18.835   3.463
    7   HD12  LEU 740          HD12      LEU 740  46.795 -17.737   2.082
    8   HD11  LEU 740          HD13      LEU 740  46.069 -19.336   1.921
    9   HD21  LEU 740          HD21      LEU 740  45.633 -15.974   3.425
   10   HD23  LEU 740          HD22      LEU 740  45.736 -17.082   4.792
   11   HD22  LEU 740          HD23      LEU 740  44.177 -16.399   4.327

  No H/Q in entry =          11
  In of MODEL    3
    1    H    THR 741           H        THR 741  43.873 -15.102   0.643
    2    HA   THR 741           HA       THR 741  41.957 -15.426  -1.512
    3    HB   THR 741           HB       THR 741  42.990 -12.907  -1.750
    4    HG1  THR 741           HG1      THR 741  42.104 -13.110   0.924
    5   HG23  THR 741          HG21      THR 741  40.789 -13.594  -2.230
    6   HG22  THR 741          HG22      THR 741  40.730 -12.163  -1.177
    7   HG21  THR 741          HG23      THR 741  40.383 -13.785  -0.521

  No H/Q in entry =           7
  In of MODEL    3
    1    H    VAL 742           H        VAL 742  42.887 -14.834  -3.594
    2    HA   VAL 742           HA       VAL 742  45.321 -16.106  -3.832
    3    HB   VAL 742           HB       VAL 742  43.904 -16.377  -5.634
    4   HG11  VAL 742          HG11      VAL 742  43.883 -13.430  -6.102
    5   HG13  VAL 742          HG12      VAL 742  42.547 -14.474  -5.531
    6   HG12  VAL 742          HG13      VAL 742  43.243 -14.709  -7.147
    7   HG21  VAL 742          HG21      VAL 742  46.314 -16.197  -6.214
    8   HG23  VAL 742          HG22      VAL 742  45.978 -14.529  -6.705
    9   HG22  VAL 742          HG23      VAL 742  45.204 -15.865  -7.553

  No H/Q in entry =           9
  In of MODEL    3
    1    H    CYS 743           H        CYS 743  44.837 -12.547  -4.000
    2    HA   CYS 743           HA       CYS 743  47.547 -11.965  -4.423
    3    HB2  CYS 743           HB2      CYS 743  45.795 -10.212  -4.472
    4    HB3  CYS 743           HB3      CYS 743  45.545 -10.402  -2.749

  No H/Q in entry =           4
  In of MODEL    3
    1    H    LYS 744           H        LYS 744  45.676 -12.622  -1.515
    2    HA   LYS 744           HA       LYS 744  47.644 -11.924   0.318
    3    HB2  LYS 744           HB2      LYS 744  45.120 -12.381   0.601
    4    HB3  LYS 744           HB3      LYS 744  45.603 -14.048   0.817
    5    HG2  LYS 744           HG2      LYS 744  46.972 -13.471   2.734
    6    HG3  LYS 744           HG3      LYS 744  46.599 -11.761   2.511
    7    HD2  LYS 744           HD2      LYS 744  44.187 -12.309   2.822
    8    HD3  LYS 744           HD3      LYS 744  44.657 -13.963   3.205
    9    HE2  LYS 744           HE2      LYS 744  44.298 -12.744   5.258
   10    HE3  LYS 744           HE3      LYS 744  46.010 -13.104   5.085
   11    HZ2  LYS 744           HZ1      LYS 744  45.621 -10.847   5.847
   12    HZ1  LYS 744           HZ2      LYS 744  44.725 -10.492   4.473
   13    HZ3  LYS 744           HZ3      LYS 744  46.378 -10.804   4.345

  No H/Q in entry =          13
  In of MODEL    3
    1    H    MET 745           H        MET 745  46.605 -15.183  -0.737
    2    HA   MET 745           HA       MET 745  48.588 -16.705   0.479
    3    HB2  MET 745           HB2      MET 745  47.196 -18.096  -0.241
    4    HB3  MET 745           HB3      MET 745  46.562 -17.113  -1.581
    5    HG2  MET 745           HG2      MET 745  47.423 -19.015  -2.674
    6    HG3  MET 745           HG3      MET 745  48.741 -17.887  -2.773
    7    HE3  MET 745           HE1      MET 745  47.588 -20.138   0.318
    8    HE2  MET 745           HE2      MET 745  48.583 -21.570  -0.031
    9    HE1  MET 745           HE3      MET 745  47.361 -21.030  -1.181

  No H/Q in entry =           9
  In of MODEL    3
    1    H    HIS 746           H        HIS 746  48.714 -15.047  -2.694
    2    HA   HIS 746           HA       HIS 746  51.186 -16.346  -3.397
    3    HB2  HIS 746           HB2      HIS 746  49.556 -14.242  -4.582
    4    HB3  HIS 746           HB3      HIS 746  51.283 -14.165  -4.990
    5    HD1  HIS 746           HD1      HIS 746  52.071 -16.849  -5.849
    6    HD2  HIS 746           HD2      HIS 746  48.187 -15.482  -6.407
    7    HE1  HIS 746           HE1      HIS 746  51.154 -18.182  -7.748
    8    HE2  HIS 746           HE2      HIS 746  48.754 -17.441  -7.968

  No H/Q in entry =           8
  In of MODEL    3
    1    H    VAL 747           H        VAL 747  50.374 -13.238  -2.029
    2    HA   VAL 747           HA       VAL 747  53.038 -12.347  -1.836
    3    HB   VAL 747           HB       VAL 747  50.420 -11.560  -0.581
    4   HG13  VAL 747          HG11      VAL 747  51.555  -9.657   0.478
    5   HG12  VAL 747          HG12      VAL 747  53.108 -10.274  -0.073
    6   HG11  VAL 747          HG13      VAL 747  52.171 -11.178   1.116
    7   HG22  VAL 747          HG21      VAL 747  50.803 -10.959  -2.885
    8   HG21  VAL 747          HG22      VAL 747  52.323 -10.188  -2.455
    9   HG23  VAL 747          HG23      VAL 747  50.795  -9.520  -1.866

  No H/Q in entry =           9
  In of MODEL    3
    1    H    LEU 748           H        LEU 748  50.844 -13.900   0.332
    2    HA   LEU 748           HA       LEU 748  52.149 -14.403   2.699
    3    HB2  LEU 748           HB2      LEU 748  49.838 -14.820   2.171
    4    HB3  LEU 748           HB3      LEU 748  50.288 -15.858   0.873
    5    HG   LEU 748           HG       LEU 748  49.131 -17.018   2.457
    6   HD13  LEU 748          HD11      LEU 748  50.503 -18.375   1.468
    7   HD12  LEU 748          HD12      LEU 748  50.611 -18.816   3.176
    8   HD11  LEU 748          HD13      LEU 748  51.921 -17.897   2.402
    9   HD23  LEU 748          HD21      LEU 748  49.866 -17.362   4.781
   10   HD22  LEU 748          HD22      LEU 748  49.200 -15.813   4.339
   11   HD21  LEU 748          HD23      LEU 748  50.966 -15.964   4.578

  No H/Q in entry =          11
  In of MODEL    3
    1    H    HIS 749           H        HIS 749  52.247 -16.219  -0.329
    2    HA   HIS 749           HA       HIS 749  54.110 -18.188   0.558
    3    HB2  HIS 749           HB2      HIS 749  52.283 -18.164  -1.375
    4    HB3  HIS 749           HB3      HIS 749  53.650 -17.615  -2.334
    5    HD1  HIS 749           HD1      HIS 749  55.600 -19.351  -2.686
    6    HD2  HIS 749           HD2      HIS 749  52.290 -20.797  -0.652
    7    HE1  HIS 749           HE1      HIS 749  55.824 -21.841  -2.728
    8    HE2  HIS 749           HE2      HIS 749  53.647 -22.662  -1.778

  No H/Q in entry =           8
  In of MODEL    3
    1    H    CYS 750           H        CYS 750  54.306 -15.097  -1.099
    2    HA   CYS 750           HA       CYS 750  57.014 -15.445  -1.998
    3    HB2  CYS 750           HB2      CYS 750  55.161 -13.867  -2.971
    4    HB3  CYS 750           HB3      CYS 750  55.641 -12.746  -1.720

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLN 751           H        GLN 751  55.415 -14.364   0.865
    2    HA   GLN 751           HA       GLN 751  57.676 -13.125   2.073
    3    HB2  GLN 751           HB2      GLN 751  55.108 -14.196   3.256
    4    HB3  GLN 751           HB3      GLN 751  56.313 -13.296   4.163
    5    HG2  GLN 751           HG2      GLN 751  54.802 -12.257   1.781
    6    HG3  GLN 751           HG3      GLN 751  54.369 -11.927   3.448
    7   HE21  GLN 751          HE21      GLN 751  55.047 -10.006   1.369
    8   HE22  GLN 751          HE22      GLN 751  56.429  -9.173   1.920

  No H/Q in entry =           8
  In of MODEL    3
    1    H    GLY 752           H        GLY 752  56.789 -16.328   1.463
    2    HA3  GLY 752           HA2      GLY 752  58.294 -18.109   1.775
    3    HA2  GLY 752           HA3      GLY 752  58.987 -17.253   3.138

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ARG 753           H        ARG 753  55.510 -17.736   2.823
    2    HA   ARG 753           HA       ARG 753  55.660 -19.443   5.197
    3    HB2  ARG 753           HB2      ARG 753  53.295 -18.138   3.854
    4    HB3  ARG 753           HB3      ARG 753  53.199 -19.137   5.296
    5    HG2  ARG 753           HG2      ARG 753  54.666 -16.517   5.053
    6    HG3  ARG 753           HG3      ARG 753  53.087 -16.750   5.800
    7    HD2  ARG 753           HD2      ARG 753  54.170 -18.343   7.409
    8    HD3  ARG 753           HD3      ARG 753  55.728 -17.885   6.714
    9    HE   ARG 753           HE       ARG 753  54.483 -15.546   7.383
   10   HH11  ARG 753          HH11      ARG 753  55.717 -18.375   9.130
   11   HH12  ARG 753          HH12      ARG 753  55.877 -17.592  10.624
   12   HH21  ARG 753          HH21      ARG 753  54.709 -14.439   9.387
   13   HH22  ARG 753          HH22      ARG 753  55.302 -15.241  10.773

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ASN 754           H        ASN 754  54.674 -21.527   5.273
    2    HA   ASN 754           HA       ASN 754  54.368 -22.706   2.623
    3    HB2  ASN 754           HB2      ASN 754  54.723 -24.093   5.303
    4    HB3  ASN 754           HB3      ASN 754  54.445 -24.922   3.786
    5   HD21  ASN 754          HD21      ASN 754  56.694 -23.272   5.734
    6   HD22  ASN 754          HD22      ASN 754  58.104 -23.580   4.782

  No H/Q in entry =           6
  In of MODEL    3
    1    H    TYR 755           H        TYR 755  52.452 -22.715   1.863
    2    HA   TYR 755           HA       TYR 755  50.250 -23.596   3.535
    3    HB2  TYR 755           HB2      TYR 755  50.328 -21.151   1.798
    4    HB3  TYR 755           HB3      TYR 755  48.834 -22.031   2.061
    5    HD1  TYR 755           HD1      TYR 755  51.637 -20.863   4.310
    6    HD2  TYR 755           HD2      TYR 755  47.474 -20.922   3.527
    7    HE1  TYR 755           HE1      TYR 755  51.245 -19.504   6.318
    8    HE2  TYR 755           HE2      TYR 755  47.075 -19.555   5.501
    9    HH   TYR 755           HH       TYR 755  48.305 -19.205   7.738

  No H/Q in entry =           9
  In of MODEL    3
    1    H    THR 756           H        THR 756  48.876 -24.846   2.521
    2    HA   THR 756           HA       THR 756  49.762 -25.853  -0.063
    3    HB   THR 756           HB       THR 756  48.040 -27.122   2.060
    4    HG1  THR 756           HG1      THR 756  49.841 -27.575   2.992
    5   HG22  THR 756          HG21      THR 756  49.364 -28.300  -0.368
    6   HG21  THR 756          HG22      THR 756  47.642 -27.952  -0.173
    7   HG23  THR 756          HG23      THR 756  48.409 -29.190   0.842

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LEU 757           H        LEU 757  48.378 -25.739  -1.797
    2    HA   LEU 757           HA       LEU 757  45.773 -24.528  -1.444
    3    HB2  LEU 757           HB2      LEU 757  47.272 -25.483  -3.873
    4    HB3  LEU 757           HB3      LEU 757  45.613 -24.957  -3.981
    5    HG   LEU 757           HG       LEU 757  46.958 -23.188  -4.735
    6   HD11  LEU 757          HD11      LEU 757  45.110 -22.483  -3.402
    7   HD13  LEU 757          HD12      LEU 757  46.469 -21.381  -3.183
    8   HD12  LEU 757          HD13      LEU 757  46.087 -22.565  -1.936
    9   HD22  LEU 757          HD21      LEU 757  49.119 -23.851  -3.817
   10   HD21  LEU 757          HD22      LEU 757  48.579 -23.421  -2.195
   11   HD23  LEU 757          HD23      LEU 757  48.777 -22.166  -3.417

  No H/Q in entry =          11
  In of MODEL    3
    1    H    THR 758           H        THR 758  44.253 -25.771  -0.632
    2    HA   THR 758           HA       THR 758  44.251 -28.599  -1.247
    3    HB   THR 758           HB       THR 758  42.375 -28.508   0.544
    4    HG1  THR 758           HG1      THR 758  43.140 -26.509   1.904
    5   HG23  THR 758          HG21      THR 758  44.047 -28.534   2.314
    6   HG22  THR 758          HG22      THR 758  45.195 -27.739   1.229
    7   HG21  THR 758          HG23      THR 758  44.654 -29.386   0.885

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLY 759           H        GLY 759  41.905 -26.073  -1.031
    2    HA3  GLY 759           HA2      GLY 759  40.801 -25.965  -3.491
    3    HA2  GLY 759           HA3      GLY 759  40.146 -27.484  -2.888

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ARG 760           H        ARG 760  38.643 -25.207  -3.595
    2    HA   ARG 760           HA       ARG 760  38.006 -23.593  -1.354
    3    HB2  ARG 760           HB2      ARG 760  36.067 -22.796  -2.641
    4    HB3  ARG 760           HB3      ARG 760  37.535 -22.786  -3.601
    5    HG2  ARG 760           HG2      ARG 760  35.885 -23.537  -5.054
    6    HG3  ARG 760           HG3      ARG 760  36.699 -25.018  -4.544
    7    HD2  ARG 760           HD2      ARG 760  34.853 -25.320  -2.854
    8    HD3  ARG 760           HD3      ARG 760  34.031 -23.949  -3.600
    9    HE   ARG 760           HE       ARG 760  34.730 -25.828  -5.537
   10   HH11  ARG 760          HH11      ARG 760  32.412 -25.439  -2.887
   11   HH12  ARG 760          HH12      ARG 760  31.217 -26.418  -3.597
   12   HH21  ARG 760          HH21      ARG 760  33.059 -27.220  -6.519
   13   HH22  ARG 760          HH22      ARG 760  31.594 -27.442  -5.682

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ASP 761           H        ASP 761  37.005 -26.739  -2.200
    2    HA   ASP 761           HA       ASP 761  34.526 -26.632  -0.807
    3    HB2  ASP 761           HB2      ASP 761  34.952 -28.183  -2.704
    4    HB3  ASP 761           HB3      ASP 761  36.081 -29.073  -1.696

  No H/Q in entry =           4
  In of MODEL    3
    1    H    SER 762           H        SER 762  37.724 -26.838   0.146
    2    HA   SER 762           HA       SER 762  37.401 -28.593   2.365
    3    HB2  SER 762           HB2      SER 762  39.708 -26.808   1.601
    4    HB3  SER 762           HB3      SER 762  39.755 -28.062   2.842
    5    HG   SER 762           HG       SER 762  39.383 -29.597   1.283

  No H/Q in entry =           5
  In of MODEL    3
    1    H    CYS 763           H        CYS 763  36.894 -25.146   1.964
    2    HA   CYS 763           HA       CYS 763  36.322 -25.057   4.825
    3    HB2  CYS 763           HB2      CYS 763  37.482 -23.065   5.271
    4    HB3  CYS 763           HB3      CYS 763  38.642 -24.039   4.389

  No H/Q in entry =           4
  In of MODEL    3
    1    H    THR 764           H        THR 764  35.279 -22.688   5.246
    2    HA   THR 764           HA       THR 764  33.084 -22.521   3.381
    3    HB   THR 764           HB       THR 764  33.646 -20.966   5.920
    4    HG1  THR 764           HG1      THR 764  32.231 -23.366   5.423
    5   HG22  THR 764          HG21      THR 764  31.088 -21.460   4.390
    6   HG21  THR 764          HG22      THR 764  31.995 -19.945   4.421
    7   HG23  THR 764          HG23      THR 764  31.226 -20.546   5.895

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LEU 765           H        LEU 765  33.332 -21.187   1.695
    2    HA   LEU 765           HA       LEU 765  35.349 -19.119   1.917
    3    HB2  LEU 765           HB2      LEU 765  35.304 -21.123   0.246
    4    HB3  LEU 765           HB3      LEU 765  34.154 -20.078  -0.576
    5    HG   LEU 765           HG       LEU 765  35.863 -18.311  -0.681
    6   HD11  LEU 765          HD11      LEU 765  37.576 -20.460   0.492
    7   HD13  LEU 765          HD12      LEU 765  37.155 -18.924   1.246
    8   HD12  LEU 765          HD13      LEU 765  38.180 -18.952  -0.193
    9   HD22  LEU 765          HD21      LEU 765  37.168 -19.370  -2.411
   10   HD21  LEU 765          HD22      LEU 765  35.485 -19.888  -2.532
   11   HD23  LEU 765          HD23      LEU 765  36.700 -20.964  -1.827

  No H/Q in entry =          11
  In of MODEL    3
    1    HA   PRO 766           HA       PRO 766  31.951 -16.241   1.702
    2    HB2  PRO 766           HB2      PRO 766  33.503 -14.007   1.230
    3    HB3  PRO 766           HB3      PRO 766  33.148 -14.660   2.820
    4    HG2  PRO 766           HG2      PRO 766  35.607 -14.903   1.186
    5    HG3  PRO 766           HG3      PRO 766  35.424 -14.903   2.950
    6    HD2  PRO 766           HD2      PRO 766  35.894 -17.113   1.381
    7    HD3  PRO 766           HD3      PRO 766  35.179 -17.198   2.995

  No H/Q in entry =           7
  In of MODEL    3
    1    H    ALA 767           H        ALA 767  34.534 -15.359  -0.635
    2    HA   ALA 767           HA       ALA 767  32.458 -14.767  -2.556
    3    HB3  ALA 767           HB1      ALA 767  34.204 -13.886  -3.971
    4    HB1  ALA 767           HB2      ALA 767  35.442 -14.485  -2.855
    5    HB2  ALA 767           HB3      ALA 767  34.332 -13.209  -2.348

  No H/Q in entry =           5
  In of MODEL    3
    1    H    SER 768           H        SER 768  31.578 -16.496  -2.994
    2    HA   SER 768           HA       SER 768  33.097 -18.374  -4.639
    3    HB2  SER 768           HB2      SER 768  30.860 -19.035  -2.729
    4    HB3  SER 768           HB3      SER 768  31.712 -20.162  -3.788
    5    HG   SER 768           HG       SER 768  32.470 -19.156  -1.362

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA 769           H        ALA 769  29.841 -17.154  -3.831
    2    HA   ALA 769           HA       ALA 769  29.114 -17.525  -6.635
    3    HB3  ALA 769           HB1      ALA 769  27.360 -18.000  -4.226
    4    HB2  ALA 769           HB2      ALA 769  28.163 -19.261  -5.150
    5    HB1  ALA 769           HB3      ALA 769  26.921 -18.273  -5.917

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLU 770           H        GLU 770  26.474 -16.496  -6.061
    2    HA   GLU 770           HA       GLU 770  26.705 -13.833  -6.740
    3    HB2  GLU 770           HB2      GLU 770  24.293 -13.721  -6.185
    4    HB3  GLU 770           HB3      GLU 770  24.720 -15.075  -7.229
    5    HG2  GLU 770           HG2      GLU 770  24.585 -16.620  -5.418
    6    HG3  GLU 770           HG3      GLU 770  24.437 -15.317  -4.247

  No H/Q in entry =           6
  In of MODEL    3
    1    H    LYS 771           H        LYS 771  25.907 -11.956  -5.715
    2    HA   LYS 771           HA       LYS 771  26.190 -11.871  -2.834
    3    HB2  LYS 771           HB2      LYS 771  27.713 -10.134  -4.789
    4    HB3  LYS 771           HB3      LYS 771  27.618  -9.825  -3.059
    5    HG2  LYS 771           HG2      LYS 771  28.701 -12.356  -4.253
    6    HG3  LYS 771           HG3      LYS 771  29.707 -10.980  -3.800
    7    HD2  LYS 771           HD2      LYS 771  29.301 -11.274  -1.536
    8    HD3  LYS 771           HD3      LYS 771  27.818 -12.185  -1.802
    9    HE2  LYS 771           HE2      LYS 771  29.043 -14.014  -2.656
   10    HE3  LYS 771           HE3      LYS 771  30.576 -13.158  -2.502
   11    HZ3  LYS 771           HZ1      LYS 771  30.243 -13.064  -0.075
   12    HZ2  LYS 771           HZ2      LYS 771  30.234 -14.663  -0.571
   13    HZ1  LYS 771           HZ3      LYS 771  28.790 -13.895  -0.206

  No H/Q in entry =          13
  In of MODEL    3
    1    H    ALA 772           H        ALA 772  24.920 -10.372  -1.893
    2    HA   ALA 772           HA       ALA 772  22.963  -9.049  -3.586
    3    HB2  ALA 772           HB1      ALA 772  22.116 -10.335  -1.685
    4    HB1  ALA 772           HB2      ALA 772  21.752  -8.622  -1.483
    5    HB3  ALA 772           HB3      ALA 772  23.075  -9.354  -0.577

  No H/Q in entry =           5
  In of MODEL    3
    1    H    CYS 773           H        CYS 773  22.373  -6.763  -2.993
    2    HA   CYS 773           HA       CYS 773  24.720  -5.189  -3.125
    3    HB2  CYS 773           HB2      CYS 773  22.654  -4.443  -4.215
    4    HB3  CYS 773           HB3      CYS 773  21.854  -4.336  -2.654

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLY 774           H        GLY 774  25.964  -4.556  -1.577
    2    HA3  GLY 774           HA2      GLY 774  25.910  -3.319   0.610
    3    HA2  GLY 774           HA3      GLY 774  24.957  -4.698   1.165

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ALA 775           H        ALA 775  26.542  -6.494  -0.590
    2    HA   ALA 775           HA       ALA 775  29.171  -6.366   0.645
    3    HB3  ALA 775           HB1      ALA 775  27.866  -8.008   1.938
    4    HB2  ALA 775           HB2      ALA 775  29.107  -8.818   0.982
    5    HB1  ALA 775           HB3      ALA 775  27.428  -8.840   0.444

  No H/Q in entry =           5
  In of MODEL    3
    1    H    CYS 776           H        CYS 776  30.313  -5.904  -1.145
    2    HA   CYS 776           HA       CYS 776  29.812  -7.570  -3.471
    3    HB2  CYS 776           HB2      CYS 776  30.084  -4.559  -3.497
    4    HB3  CYS 776           HB3      CYS 776  30.103  -5.573  -4.936

  No H/Q in entry =           4
  In of MODEL    3
    1    HA   PRO 777           HA       PRO 777  34.296  -7.884  -3.282
    2    HB2  PRO 777           HB2      PRO 777  34.525  -9.489  -5.474
    3    HB3  PRO 777           HB3      PRO 777  34.030 -10.123  -3.904
    4    HG2  PRO 777           HG2      PRO 777  32.359  -9.388  -6.264
    5    HG3  PRO 777           HG3      PRO 777  32.217 -10.785  -5.184
    6    HD2  PRO 777           HD2      PRO 777  30.636  -8.609  -4.988
    7    HD3  PRO 777           HD3      PRO 777  31.107  -9.577  -3.570

  No H/Q in entry =           7
  In of MODEL    3
    1    H    LEU 778           H        LEU 778  35.936  -7.755  -5.327
    2    HA   LEU 778           HA       LEU 778  35.441  -5.175  -6.315
    3    HB2  LEU 778           HB2      LEU 778  37.614  -5.318  -7.535
    4    HB3  LEU 778           HB3      LEU 778  37.708  -5.603  -5.822
    5    HG   LEU 778           HG       LEU 778  39.268  -7.005  -6.916
    6   HD13  LEU 778          HD11      LEU 778  38.759  -9.178  -6.176
    7   HD12  LEU 778          HD12      LEU 778  37.043  -8.826  -6.179
    8   HD11  LEU 778          HD13      LEU 778  38.095  -8.015  -5.020
    9   HD23  LEU 778          HD21      LEU 778  38.635  -8.710  -8.585
   10   HD22  LEU 778          HD22      LEU 778  38.433  -7.049  -9.154
   11   HD21  LEU 778          HD23      LEU 778  37.024  -7.984  -8.642

  No H/Q in entry =          11
  In of MODEL    3
    1    H    TRP 779           H        TRP 779  34.960  -8.249  -7.822
    2    HA   TRP 779           HA       TRP 779  34.379  -7.056 -10.395
    3    HB2  TRP 779           HB2      TRP 779  33.645  -9.413 -11.013
    4    HB3  TRP 779           HB3      TRP 779  35.328  -9.250 -10.527
    5    HD1  TRP 779           HD1      TRP 779  31.975 -10.680  -9.238
    6    HE1  TRP 779           HE1      TRP 779  32.507 -12.368  -7.362
    7    HE3  TRP 779           HE3      TRP 779  36.969  -9.933  -8.887
    8    HZ2  TRP 779           HZ2      TRP 779  34.862 -13.254  -5.907
    9    HZ3  TRP 779           HZ3      TRP 779  38.259 -11.183  -7.234
   10    HH2  TRP 779           HH2      TRP 779  37.198 -12.783  -5.783

  No H/Q in entry =          10
  In of MODEL    3
    1    H    GLY 780           H        GLY 780  32.788  -6.813  -7.661
    2    HA3  GLY 780           HA2      GLY 780  30.172  -7.035  -8.936
    3    HA2  GLY 780           HA3      GLY 780  30.444  -7.419  -7.235

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LYS 781           H        LYS 781  28.860  -5.329  -8.639
    2    HA   LYS 781           HA       LYS 781  29.711  -3.142  -6.918
    3    HB2  LYS 781           HB2      LYS 781  29.286  -2.905  -9.890
    4    HB3  LYS 781           HB3      LYS 781  29.142  -1.522  -8.813
    5    HG2  LYS 781           HG2      LYS 781  31.576  -3.240  -9.150
    6    HG3  LYS 781           HG3      LYS 781  31.326  -1.650  -9.902
    7    HD2  LYS 781           HD2      LYS 781  31.208  -0.633  -7.686
    8    HD3  LYS 781           HD3      LYS 781  31.402  -2.208  -6.928
    9    HE2  LYS 781           HE2      LYS 781  33.415  -0.843  -8.691
   10    HE3  LYS 781           HE3      LYS 781  33.438  -0.945  -6.923
   11    HZ1  LYS 781           HZ1      LYS 781  33.579  -3.349  -7.114
   12    HZ3  LYS 781           HZ2      LYS 781  34.893  -2.602  -7.831
   13    HZ2  LYS 781           HZ3      LYS 781  33.685  -3.263  -8.796

  No H/Q in entry =          13
  In of MODEL    3
    1    H    CYS 782           H        CYS 782  27.977  -1.826  -6.372
    2    HA   CYS 782           HA       CYS 782  25.428  -3.019  -7.145
    3    HB2  CYS 782           HB2      CYS 782  25.721  -3.158  -4.720
    4    HB3  CYS 782           HB3      CYS 782  26.002  -1.420  -4.636

  No H/Q in entry =           4
  In of MODEL    3
    1    H    ASP 783           H        ASP 783  25.309  -1.948  -9.022
    2    HA   ASP 783           HA       ASP 783  25.120   0.947  -8.931
    3    HB2  ASP 783           HB2      ASP 783  26.308  -0.076 -10.833
    4    HB3  ASP 783           HB3      ASP 783  24.870  -0.994 -11.251

  No H/Q in entry =           4
  In of MODEL    3
    1    H    ALA 784           H        ALA 784  23.371   1.008  -7.549
    2    HA   ALA 784           HA       ALA 784  21.227   0.685  -6.802
    3    HB2  ALA 784           HB1      ALA 784  20.812   2.429  -9.221
    4    HB1  ALA 784           HB2      ALA 784  21.468   2.961  -7.670
    5    HB3  ALA 784           HB3      ALA 784  19.810   2.376  -7.773

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLU 785           H        GLU 785  20.848  -1.497  -7.102
    2    HA   GLU 785           HA       GLU 785  19.292  -2.169  -9.483
    3    HB2  GLU 785           HB2      GLU 785  21.265  -3.619  -8.790
    4    HB3  GLU 785           HB3      GLU 785  20.377  -4.055  -7.352
    5    HG2  GLU 785           HG2      GLU 785  19.426  -4.627 -10.153
    6    HG3  GLU 785           HG3      GLU 785  20.375  -5.753  -9.200

  No H/Q in entry =           6
  In of MODEL    3
    1    H    SER 786           H        SER 786  19.104  -3.454  -6.225
    2    HA   SER 786           HA       SER 786  16.980  -2.165  -5.135
    3    HB2  SER 786           HB2      SER 786  15.672  -3.019  -7.133
    4    HB3  SER 786           HB3      SER 786  16.020  -4.656  -6.590
    5    HG   SER 786           HG       SER 786  14.157  -2.924  -5.789

  No H/Q in entry =           5
  In of MODEL    3
    1    H    SER 787           H        SER 787  18.042  -5.473  -5.897
    2    HA   SER 787           HA       SER 787  18.166  -5.963  -3.011
    3    HB2  SER 787           HB2      SER 787  17.290  -7.860  -5.187
    4    HB3  SER 787           HB3      SER 787  17.406  -8.249  -3.472
    5    HG   SER 787           HG       SER 787  15.772  -6.221  -4.598

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LYS 788           H        LYS 788  19.419  -6.938  -6.219
    2    HA   LYS 788           HA       LYS 788  21.494  -8.451  -4.863
    3    HB2  LYS 788           HB2      LYS 788  22.037  -9.401  -6.993
    4    HB3  LYS 788           HB3      LYS 788  20.291  -9.482  -6.775
    5    HG2  LYS 788           HG2      LYS 788  20.010  -7.593  -8.260
    6    HG3  LYS 788           HG3      LYS 788  21.757  -7.416  -8.406
    7    HD2  LYS 788           HD2      LYS 788  21.847  -9.701  -9.367
    8    HD3  LYS 788           HD3      LYS 788  20.085  -9.747  -9.330
    9    HE2  LYS 788           HE2      LYS 788  19.993  -7.803 -10.803
   10    HE3  LYS 788           HE3      LYS 788  21.753  -7.730 -10.819
   11    HZ1  LYS 788           HZ1      LYS 788  21.773  -9.932 -11.837
   12    HZ3  LYS 788           HZ2      LYS 788  20.952  -8.811 -12.788
   13    HZ2  LYS 788           HZ3      LYS 788  20.086  -9.939 -11.868

  No H/Q in entry =          13
  In of MODEL    3
    1    H    CYS 789           H        CYS 789  23.670  -8.358  -5.829
    2    HA   CYS 789           HA       CYS 789  24.534  -5.634  -6.435
    3    HB2  CYS 789           HB2      CYS 789  25.575  -6.832  -4.488
    4    HB3  CYS 789           HB3      CYS 789  26.025  -8.139  -5.565

  No H/Q in entry =           4
  In of MODEL    3
    1    H    VAL 790           H        VAL 790  25.913  -5.529  -8.447
    2    HA   VAL 790           HA       VAL 790  25.087  -7.728 -10.167
    3    HB   VAL 790           HB       VAL 790  25.299  -6.291 -12.097
    4   HG12  VAL 790          HG11      VAL 790  23.518  -4.672 -11.680
    5   HG11  VAL 790          HG12      VAL 790  23.680  -4.965  -9.946
    6   HG13  VAL 790          HG13      VAL 790  23.179  -6.272 -11.022
    7   HG23  VAL 790          HG21      VAL 790  26.128  -4.074 -10.217
    8   HG22  VAL 790          HG22      VAL 790  25.799  -3.884 -11.941
    9   HG21  VAL 790          HG23      VAL 790  27.156  -4.876 -11.403

  No H/Q in entry =           9
  In of MODEL    3
    1    H    CYS 791           H        CYS 791  26.481  -8.693 -11.473
    2    HA   CYS 791           HA       CYS 791  29.241  -8.485 -10.575
    3    HB2  CYS 791           HB2      CYS 791  28.048 -10.660 -12.314
    4    HB3  CYS 791           HB3      CYS 791  29.489 -10.721 -11.308

  No H/Q in entry =           4
  In of MODEL    3
    1    H    ARG 792           H        ARG 792  30.774  -7.894 -11.964
    2    HA   ARG 792           HA       ARG 792  29.922  -6.566 -14.335
    3    HB2  ARG 792           HB2      ARG 792  32.584  -6.909 -13.025
    4    HB3  ARG 792           HB3      ARG 792  32.400  -6.122 -14.584
    5    HG2  ARG 792           HG2      ARG 792  30.938  -4.467 -13.583
    6    HG3  ARG 792           HG3      ARG 792  31.107  -5.264 -12.014
    7    HD2  ARG 792           HD2      ARG 792  33.417  -4.819 -11.941
    8    HD3  ARG 792           HD3      ARG 792  33.435  -4.267 -13.616
    9    HE   ARG 792           HE       ARG 792  31.661  -2.691 -12.139
   10   HH11  ARG 792          HH11      ARG 792  35.151  -3.283 -12.463
   11   HH12  ARG 792          HH12      ARG 792  35.532  -1.657 -12.064
   12   HH21  ARG 792          HH21      ARG 792  32.298  -0.506 -11.559
   13   HH22  ARG 792          HH22      ARG 792  33.974  -0.135 -11.556

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLU 793           H        GLU 793  31.383  -6.751 -16.237
    2    HA   GLU 793           HA       GLU 793  31.499  -9.499 -17.134
    3    HB2  GLU 793           HB2      GLU 793  31.827  -6.842 -18.503
    4    HB3  GLU 793           HB3      GLU 793  32.040  -8.392 -19.301
    5    HG2  GLU 793           HG2      GLU 793  29.501  -7.547 -17.926
    6    HG3  GLU 793           HG3      GLU 793  29.812  -7.326 -19.650

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ALA 794           H        ALA 794  33.501  -9.956 -18.539
    2    HA   ALA 794           HA       ALA 794  35.703  -9.857 -16.751
    3    HB2  ALA 794           HB1      ALA 794  35.171 -11.813 -18.120
    4    HB3  ALA 794           HB2      ALA 794  36.827 -11.255 -18.331
    5    HB1  ALA 794           HB3      ALA 794  35.617 -10.904 -19.569

  No H/Q in entry =           5
  In of MODEL    3
    1    H    SER 795           H        SER 795  34.701  -7.718 -19.168
    2    HA   SER 795           HA       SER 795  37.423  -6.895 -19.686
    3    HB2  SER 795           HB2      SER 795  34.866  -6.052 -21.043
    4    HB3  SER 795           HB3      SER 795  36.503  -5.643 -21.564
    5    HG   SER 795           HG       SER 795  36.859  -7.978 -21.602

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLU 796           H        GLU 796  35.278  -6.185 -17.346
    2    HA   GLU 796           HA       GLU 796  35.959  -3.325 -17.384
    3    HB2  GLU 796           HB2      GLU 796  33.504  -3.884 -17.462
    4    HB3  GLU 796           HB3      GLU 796  33.673  -4.646 -15.893
    5    HG2  GLU 796           HG2      GLU 796  32.728  -2.400 -15.702
    6    HG3  GLU 796           HG3      GLU 796  34.287  -2.511 -14.894

  No H/Q in entry =           6
  In of MODEL    3
    1    H    CYS 797           H        CYS 797  37.830  -5.065 -16.633
    2    HA   CYS 797           HA       CYS 797  37.875  -5.194 -13.728
    3    HB2  CYS 797           HB2      CYS 797  38.604  -7.119 -15.072
    4    HB3  CYS 797           HB3      CYS 797  39.843  -6.126 -15.832

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLU 798           H        GLU 798  38.628  -3.476 -12.675
    2    HA   GLU 798           HA       GLU 798  40.340  -1.546 -14.121
    3    HB2  GLU 798           HB2      GLU 798  39.394   0.184 -12.647
    4    HB3  GLU 798           HB3      GLU 798  38.162  -0.616 -13.612
    5    HG2  GLU 798           HG2      GLU 798  37.569  -1.999 -11.668
    6    HG3  GLU 798           HG3      GLU 798  38.775  -1.143 -10.713

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU 799           H        GLU 799  40.150  -3.674 -11.576
    2    HA   GLU 799           HA       GLU 799  42.266  -2.388 -10.093
    3    HB2  GLU 799           HB2      GLU 799  41.879  -4.319  -8.461
    4    HB3  GLU 799           HB3      GLU 799  40.617  -3.113  -8.605
    5    HG2  GLU 799           HG2      GLU 799  40.559  -5.675 -10.123
    6    HG3  GLU 799           HG3      GLU 799  39.935  -5.558  -8.470

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLU 800           H        GLU 800  43.669  -4.440  -9.031
    2    HA   GLU 800           HA       GLU 800  45.559  -4.966 -11.024
    3    HB2  GLU 800           HB2      GLU 800  45.195  -6.366  -8.371
    4    HB3  GLU 800           HB3      GLU 800  46.634  -6.443  -9.376
    5    HG2  GLU 800           HG2      GLU 800  46.966  -4.050  -9.095
    6    HG3  GLU 800           HG3      GLU 800  45.514  -3.966  -8.098

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLY 801           H        GLY 801  43.593  -7.389  -9.296
    2    HA3  GLY 801           HA2      GLY 801  42.497  -9.198 -10.064
    3    HA2  GLY 801           HA3      GLY 801  42.757  -8.630 -11.706

  No H/Q in entry =           3
  In of MODEL    3
    1    H    PHE 802           H        PHE 802  43.836 -10.721  -9.200
    2    HA   PHE 802           HA       PHE 802  46.271 -11.483 -10.387
    3    HB2  PHE 802           HB2      PHE 802  44.556 -12.614  -8.254
    4    HB3  PHE 802           HB3      PHE 802  45.771 -13.663  -8.977
    5    HD1  PHE 802           HD1      PHE 802  45.520 -10.160  -7.696
    6    HD2  PHE 802           HD2      PHE 802  47.789 -13.747  -7.968
    7    HE1  PHE 802           HE1      PHE 802  47.266  -9.166  -6.315
    8    HE2  PHE 802           HE2      PHE 802  49.514 -12.786  -6.608
    9    HZ   PHE 802           HZ       PHE 802  49.280 -10.469  -5.751

  No H/Q in entry =           9
  In of MODEL    3
    1    H    SER 803           H        SER 803  46.767 -12.804 -11.934
    2    HA   SER 803           HA       SER 803  44.535 -13.999 -13.387
    3    HB2  SER 803           HB2      SER 803  46.273 -12.666 -14.611
    4    HB3  SER 803           HB3      SER 803  47.472 -13.897 -14.196
    5    HG   SER 803           HG       SER 803  46.866 -14.796 -15.944

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ILE 804           H        ILE 804  43.941 -15.977 -13.062
    2    HA   ILE 804           HA       ILE 804  45.786 -17.885 -11.796
    3    HB   ILE 804           HB       ILE 804  44.098 -18.723 -10.325
    4   HG12  ILE 804          HG12      ILE 804  42.071 -18.430 -11.757
    5   HG13  ILE 804          HG13      ILE 804  41.815 -17.893 -10.110
    6   HG22  ILE 804          HG21      ILE 804  44.164 -15.733 -10.151
    7   HG21  ILE 804          HG22      ILE 804  45.320 -16.874  -9.462
    8   HG23  ILE 804          HG23      ILE 804  43.661 -16.818  -8.854
    9   HD12  ILE 804          HD11      ILE 804  42.221 -16.161 -12.544
   10   HD11  ILE 804          HD12      ILE 804  42.098 -15.552 -10.897
   11   HD13  ILE 804          HD13      ILE 804  40.733 -16.393 -11.633

  No H/Q in entry =          11
  In of MODEL    3
    1    H    CYS 805           H        CYS 805  44.453 -20.150 -11.752
    2    HA   CYS 805           HA       CYS 805  43.761 -20.621 -14.559
    3    HB2  CYS 805           HB2      CYS 805  45.834 -21.669 -13.776
    4    HB3  CYS 805           HB3      CYS 805  44.928 -22.474 -12.504

  No H/Q in entry =           4
  In of MODEL    3
    1    H    VAL 806           H        VAL 806  41.737 -21.318 -14.917
    2    HA   VAL 806           HA       VAL 806  40.232 -22.386 -12.648
    3    HB   VAL 806           HB       VAL 806  39.215 -20.559 -14.807
    4   HG11  VAL 806          HG11      VAL 806  37.845 -21.633 -12.354
    5   HG13  VAL 806          HG12      VAL 806  37.509 -22.050 -14.027
    6   HG12  VAL 806          HG13      VAL 806  37.183 -20.410 -13.443
    7   HG23  VAL 806          HG21      VAL 806  38.952 -18.865 -13.038
    8   HG22  VAL 806          HG22      VAL 806  40.629 -19.291 -13.359
    9   HG21  VAL 806          HG23      VAL 806  39.819 -19.934 -11.928

  No H/Q in entry =           9
  In of MODEL    3
    1    H    GLU 807           H        GLU 807  39.168 -24.215 -13.077
    2    HA   GLU 807           HA       GLU 807  39.436 -25.401 -15.685
    3    HB2  GLU 807           HB2      GLU 807  39.825 -26.698 -13.601
    4    HB3  GLU 807           HB3      GLU 807  38.145 -26.462 -13.163
    5    HG2  GLU 807           HG2      GLU 807  37.473 -27.712 -15.169
    6    HG3  GLU 807           HG3      GLU 807  39.172 -27.973 -15.551

  No H/Q in entry =           6
  In of MODEL    3
    1    H    VAL 808           H        VAL 808  38.012 -25.217 -17.103
    2    HA   VAL 808           HA       VAL 808  35.217 -24.823 -16.476
    3    HB   VAL 808           HB       VAL 808  36.045 -22.575 -16.858
    4   HG13  VAL 808          HG11      VAL 808  38.086 -23.017 -18.065
    5   HG12  VAL 808          HG12      VAL 808  37.098 -21.862 -18.963
    6   HG11  VAL 808          HG13      VAL 808  37.170 -23.549 -19.476
    7   HG22  VAL 808          HG21      VAL 808  34.705 -21.882 -18.779
    8   HG21  VAL 808          HG22      VAL 808  33.849 -23.044 -17.753
    9   HG23  VAL 808          HG23      VAL 808  34.573 -23.568 -19.279

  No H/Q in entry =           9
  In of MODEL    3
    1    H    ASN 809           H        ASN 809  34.107 -26.282 -17.521
    2    HA   ASN 809           HA       ASN 809  33.370 -27.698 -19.150
    3    HB2  ASN 809           HB2      ASN 809  35.254 -25.992 -20.675
    4    HB3  ASN 809           HB3      ASN 809  34.604 -27.423 -21.500
    5   HD21  ASN 809          HD21      ASN 809  32.893 -25.379 -19.179
    6   HD22  ASN 809          HD22      ASN 809  31.777 -24.691 -20.293

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLY 810           H        GLY 810  35.879 -28.031 -17.453
    2    HA3  GLY 810           HA2      GLY 810  36.982 -30.046 -16.973
    3    HA2  GLY 810           HA3      GLY 810  36.689 -30.570 -18.641

  No H/Q in entry =           3
  In of MODEL    3
    1    H    LYS 811           H        LYS 811  37.663 -27.595 -19.071
    2    HA   LYS 811           HA       LYS 811  40.460 -28.351 -19.558
    3    HB2  LYS 811           HB2      LYS 811  38.744 -26.074 -20.540
    4    HB3  LYS 811           HB3      LYS 811  40.408 -26.381 -21.015
    5    HG2  LYS 811           HG2      LYS 811  39.809 -28.339 -22.194
    6    HG3  LYS 811           HG3      LYS 811  38.189 -28.350 -21.488
    7    HD2  LYS 811           HD2      LYS 811  38.248 -27.529 -23.833
    8    HD3  LYS 811           HD3      LYS 811  37.590 -26.368 -22.680
    9    HE2  LYS 811           HE2      LYS 811  39.715 -25.199 -22.605
   10    HE3  LYS 811           HE3      LYS 811  40.436 -26.367 -23.696
   11    HZ1  LYS 811           HZ1      LYS 811  38.839 -25.628 -25.405
   12    HZ3  LYS 811           HZ2      LYS 811  39.810 -24.357 -24.839
   13    HZ2  LYS 811           HZ3      LYS 811  38.224 -24.478 -24.325

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLU 812           H        GLU 812  42.070 -26.785 -18.904
    2    HA   GLU 812           HA       GLU 812  41.067 -25.005 -16.811
    3    HB2  GLU 812           HB2      GLU 812  43.711 -26.456 -16.920
    4    HB3  GLU 812           HB3      GLU 812  43.426 -25.109 -15.828
    5    HG2  GLU 812           HG2      GLU 812  41.578 -26.331 -14.805
    6    HG3  GLU 812           HG3      GLU 812  41.871 -27.713 -15.843

  No H/Q in entry =           6
  In of MODEL    3
    1    H    GLN 813           H        GLN 813  40.916 -23.071 -17.434
    2    HA   GLN 813           HA       GLN 813  42.883 -22.037 -19.341
    3    HB2  GLN 813           HB2      GLN 813  40.722 -22.168 -20.338
    4    HB3  GLN 813           HB3      GLN 813  39.959 -21.372 -18.966
    5    HG2  GLN 813           HG2      GLN 813  41.039 -19.318 -19.515
    6    HG3  GLN 813           HG3      GLN 813  41.953 -20.081 -20.827
    7   HE21  GLN 813          HE21      GLN 813  38.924 -18.795 -19.798
    8   HE22  GLN 813          HE22      GLN 813  38.129 -18.868 -21.326

  No H/Q in entry =           8
  In of MODEL    3
    1    H    THR 814           H        THR 814  43.883 -20.148 -18.900
    2    HA   THR 814           HA       THR 814  43.889 -19.229 -16.207
    3    HB   THR 814           HB       THR 814  45.224 -18.143 -18.681
    4    HG1  THR 814           HG1      THR 814  46.976 -19.481 -18.009
    5   HG23  THR 814          HG21      THR 814  46.857 -17.179 -17.103
    6   HG22  THR 814          HG22      THR 814  45.911 -17.797 -15.752
    7   HG21  THR 814          HG23      THR 814  45.236 -16.555 -16.805

  No H/Q in entry =           7
  In of MODEL    3
    1    H    MET 815           H        MET 815  42.809 -17.543 -15.418
    2    HA   MET 815           HA       MET 815  41.455 -15.711 -17.271
    3    HB2  MET 815           HB2      MET 815  40.257 -16.700 -14.694
    4    HB3  MET 815           HB3      MET 815  39.479 -15.696 -15.909
    5    HG2  MET 815           HG2      MET 815  39.844 -17.779 -17.444
    6    HG3  MET 815           HG3      MET 815  40.121 -18.539 -15.880
    7    HE3  MET 815           HE1      MET 815  37.897 -19.302 -18.058
    8    HE2  MET 815           HE2      MET 815  36.600 -19.809 -16.962
    9    HE1  MET 815           HE3      MET 815  38.283 -20.239 -16.621

  No H/Q in entry =           9
  In of MODEL    3
    1    H    SER 816           H        SER 816  40.998 -13.719 -16.279
    2    HA   SER 816           HA       SER 816  42.944 -12.955 -14.291
    3    HB2  SER 816           HB2      SER 816  40.683 -11.357 -15.515
    4    HB3  SER 816           HB3      SER 816  42.084 -10.715 -14.650
    5    HG   SER 816           HG       SER 816  42.929 -12.341 -16.554

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLU 817           H        GLU 817  42.320 -12.177 -12.227
    2    HA   GLU 817           HA       GLU 817  40.639 -13.607 -10.645
    3    HB2  GLU 817           HB2      GLU 817  42.424 -11.968 -10.121
    4    HB3  GLU 817           HB3      GLU 817  41.240 -10.718 -10.440
    5    HG2  GLU 817           HG2      GLU 817  39.869 -11.837  -8.584
    6    HG3  GLU 817           HG3      GLU 817  41.368 -12.659  -8.224

  No H/Q in entry =           6
  In of MODEL    3
    1    H    CYS 818           H        CYS 818  40.062 -10.344 -11.833
    2    HA   CYS 818           HA       CYS 818  37.447 -10.009 -11.046
    3    HB2  CYS 818           HB2      CYS 818  37.662  -8.298 -13.062
    4    HB3  CYS 818           HB3      CYS 818  38.550  -8.068 -11.552

  No H/Q in entry =           4
  In of MODEL    3
    1    H    GLU 819           H        GLU 819  38.794 -11.567 -13.869
    2    HA   GLU 819           HA       GLU 819  36.362 -11.754 -15.346
    3    HB2  GLU 819           HB2      GLU 819  38.465 -11.799 -16.510
    4    HB3  GLU 819           HB3      GLU 819  39.019 -13.147 -15.534
    5    HG2  GLU 819           HG2      GLU 819  37.468 -14.621 -16.596
    6    HG3  GLU 819           HG3      GLU 819  36.752 -13.286 -17.499

  No H/Q in entry =           6
  In of MODEL    3
    1    H    ALA 820           H        ALA 820  38.378 -14.289 -13.802
    2    HA   ALA 820           HA       ALA 820  36.655 -16.366 -13.925
    3    HB2  ALA 820           HB1      ALA 820  37.874 -17.315 -12.010
    4    HB3  ALA 820           HB2      ALA 820  38.588 -15.729 -11.712
    5    HB1  ALA 820           HB3      ALA 820  38.942 -16.588 -13.210

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLY 821           H        GLY 821  36.926 -13.873 -11.427
    2    HA3  GLY 821           HA2      GLY 821  34.980 -14.928  -9.680
    3    HA2  GLY 821           HA3      GLY 821  35.578 -13.302  -9.628

  No H/Q in entry =           3
  In of MODEL    3
    1    H    ALA 822           H        ALA 822  34.843 -12.582 -12.335
    2    HA   ALA 822           HA       ALA 822  32.204 -11.767 -11.928
    3    HB3  ALA 822           HB1      ALA 822  32.246 -11.043 -14.269
    4    HB1  ALA 822           HB2      ALA 822  33.707 -11.991 -14.540
    5    HB2  ALA 822           HB3      ALA 822  33.752 -10.601 -13.465

  No H/Q in entry =           5
  In of MODEL    3
    1    H    LEU 823           H        LEU 823  33.590 -14.377 -13.853
    2    HA   LEU 823           HA       LEU 823  31.156 -15.318 -14.843
    3    HB2  LEU 823           HB2      LEU 823  33.824 -16.645 -14.521
    4    HB3  LEU 823           HB3      LEU 823  32.462 -17.611 -15.010
    5    HG   LEU 823           HG       LEU 823  33.685 -17.067 -16.965
    6   HD11  LEU 823          HD11      LEU 823  31.325 -16.998 -17.322
    7   HD13  LEU 823          HD12      LEU 823  32.136 -15.823 -18.351
    8   HD12  LEU 823          HD13      LEU 823  31.273 -15.279 -16.916
    9   HD21  LEU 823          HD21      LEU 823  33.537 -14.158 -16.195
   10   HD23  LEU 823          HD22      LEU 823  34.188 -14.788 -17.710
   11   HD22  LEU 823          HD23      LEU 823  34.983 -15.164 -16.186

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ARG 824           H        ARG 824  32.799 -16.208 -11.792
    2    HA   ARG 824           HA       ARG 824  30.779 -18.140 -11.173
    3    HB2  ARG 824           HB2      ARG 824  31.795 -18.083  -8.841
    4    HB3  ARG 824           HB3      ARG 824  32.849 -18.705 -10.106
    5    HG2  ARG 824           HG2      ARG 824  33.692 -16.292 -10.108
    6    HG3  ARG 824           HG3      ARG 824  32.913 -16.201  -8.521
    7    HD2  ARG 824           HD2      ARG 824  34.976 -18.220  -9.394
    8    HD3  ARG 824           HD3      ARG 824  35.284 -16.871  -8.329
    9    HE   ARG 824           HE       ARG 824  33.285 -18.875  -7.582
   10   HH11  ARG 824          HH11      ARG 824  36.425 -17.415  -6.857
   11   HH12  ARG 824          HH12      ARG 824  36.680 -18.277  -5.402
   12   HH21  ARG 824          HH21      ARG 824  33.684 -20.141  -5.681
   13   HH22  ARG 824          HH22      ARG 824  35.055 -19.886  -4.700

  No H/Q in entry =          13
  In of MODEL    3
    1    H    CYS 825           H        CYS 825  30.816 -14.870 -10.983
    2    HA   CYS 825           HA       CYS 825  28.929 -14.700  -8.768
    3    HB2  CYS 825           HB2      CYS 825  30.800 -13.102  -9.125
    4    HB3  CYS 825           HB3      CYS 825  30.043 -12.573 -10.612

  No H/Q in entry =           4
  In of MODEL    3
    1    H    ARG 826           H        ARG 826  29.234 -14.194 -12.233
    2    HA   ARG 826           HA       ARG 826  26.662 -13.383 -12.829
    3    HB2  ARG 826           HB2      ARG 826  28.318 -12.849 -14.336
    4    HB3  ARG 826           HB3      ARG 826  29.025 -14.447 -14.283
    5    HG2  ARG 826           HG2      ARG 826  27.300 -15.333 -15.561
    6    HG3  ARG 826           HG3      ARG 826  26.402 -13.799 -15.559
    7    HD2  ARG 826           HD2      ARG 826  28.104 -12.734 -16.853
    8    HD3  ARG 826           HD3      ARG 826  29.206 -14.097 -16.645
    9    HE   ARG 826           HE       ARG 826  27.338 -15.316 -17.900
   10   HH11  ARG 826          HH11      ARG 826  28.399 -11.908 -18.583
   11   HH12  ARG 826          HH12      ARG 826  28.113 -12.035 -20.230
   12   HH21  ARG 826          HH21      ARG 826  27.016 -15.414 -20.249
   13   HH22  ARG 826          HH22      ARG 826  27.307 -14.058 -21.214

  No H/Q in entry =          13
  In of MODEL    3
    1    H    GLY 827           H        GLY 827  28.165 -16.635 -12.887
    2    HA3  GLY 827           HA2      GLY 827  26.347 -18.323 -12.150
    3    HA2  GLY 827           HA3      GLY 827  25.490 -17.599 -13.511

  No H/Q in entry =           3
  In of MODEL    3
    1    H    GLN 828           H        GLN 828  28.710 -17.796 -14.277
    2    HA   GLN 828           HA       GLN 828  28.265 -19.952 -16.122
    3    HB2  GLN 828           HB2      GLN 828  29.690 -18.070 -16.715
    4    HB3  GLN 828           HB3      GLN 828  30.720 -18.386 -15.329
    5    HG2  GLN 828           HG2      GLN 828  31.989 -19.237 -17.067
    6    HG3  GLN 828           HG3      GLN 828  31.155 -20.669 -16.494
    7   HE21  GLN 828          HE21      GLN 828  28.615 -19.750 -17.866
    8   HE22  GLN 828          HE22      GLN 828  28.899 -20.094 -19.518

  No H/Q in entry =           8
  In of MODEL    3
    1    H    SER 829           H        SER 829  29.263 -22.008 -15.981
    2    HA   SER 829           HA       SER 829  29.899 -22.820 -13.282
    3    HB2  SER 829           HB2      SER 829  29.645 -24.464 -15.814
    4    HB3  SER 829           HB3      SER 829  29.774 -25.101 -14.172
    5    HG   SER 829           HG       SER 829  27.720 -23.319 -14.948

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ILE 830           H        ILE 830  31.883 -22.462 -12.637
    2    HA   ILE 830           HA       ILE 830  34.074 -23.477 -14.232
    3    HB   ILE 830           HB       ILE 830  35.521 -21.586 -13.814
    4   HG12  ILE 830          HG12      ILE 830  34.447 -20.751 -11.685
    5   HG13  ILE 830          HG13      ILE 830  34.866 -19.456 -12.761
    6   HG21  ILE 830          HG21      ILE 830  32.987 -20.741 -15.135
    7   HG23  ILE 830          HG22      ILE 830  34.380 -21.510 -15.900
    8   HG22  ILE 830          HG23      ILE 830  34.510 -19.856 -15.277
    9   HD11  ILE 830          HD11      ILE 830  32.487 -19.512 -13.577
   10   HD13  ILE 830          HD12      ILE 830  32.767 -18.919 -11.965
   11   HD12  ILE 830          HD13      ILE 830  32.138 -20.559 -12.197

  No H/Q in entry =          11
  In of MODEL    3
    1    H    SER 831           H        SER 831  35.944 -23.864 -12.956
    2    HA   SER 831           HA       SER 831  35.439 -23.976 -10.083
    3    HB2  SER 831           HB2      SER 831  36.798 -25.942 -11.892
    4    HB3  SER 831           HB3      SER 831  36.714 -26.052 -10.140
    5    HG   SER 831           HG       SER 831  34.322 -25.944 -10.564

  No H/Q in entry =           5
  In of MODEL    3
    1    H    VAL 832           H        VAL 832  36.840 -22.349  -9.380
    2    HA   VAL 832           HA       VAL 832  39.353 -21.901 -10.663
    3    HB   VAL 832           HB       VAL 832  38.465 -21.143  -7.861
    4   HG13  VAL 832          HG11      VAL 832  40.351 -19.519  -7.909
    5   HG12  VAL 832          HG12      VAL 832  40.792 -20.098  -9.515
    6   HG11  VAL 832          HG13      VAL 832  40.944 -21.169  -8.139
    7   HG21  VAL 832          HG21      VAL 832  37.055 -20.105  -9.554
    8   HG23  VAL 832          HG22      VAL 832  38.476 -19.487 -10.392
    9   HG22  VAL 832          HG23      VAL 832  38.073 -18.891  -8.782

  No H/Q in entry =           9
  In of MODEL    3
    1    H    THR 833           H        THR 833  40.677 -23.556 -10.756
    2    HA   THR 833           HA       THR 833  40.712 -25.483  -8.634
    3    HB   THR 833           HB       THR 833  42.273 -26.640 -10.276
    4    HG1  THR 833           HG1      THR 833  42.386 -25.794 -12.303
    5   HG22  THR 833          HG21      THR 833  40.374 -27.297 -11.705
    6   HG21  THR 833          HG22      THR 833  39.465 -25.919 -11.079
    7   HG23  THR 833          HG23      THR 833  39.923 -27.237  -9.997

  No H/Q in entry =           7
  In of MODEL    3
    1    H    SER 834           H        SER 834  42.615 -22.873  -9.832
    2    HA   SER 834           HA       SER 834  44.397 -23.275  -7.630
    3    HB2  SER 834           HB2      SER 834  46.387 -23.181  -9.141
    4    HB3  SER 834           HB3      SER 834  45.459 -24.697  -9.107
    5    HG   SER 834           HG       SER 834  44.405 -23.956 -10.999

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ILE 835           H        ILE 835  45.665 -21.540  -7.165
    2    HA   ILE 835           HA       ILE 835  44.725 -19.017  -8.238
    3    HB   ILE 835           HB       ILE 835  45.996 -18.012  -6.314
    4   HG12  ILE 835          HG12      ILE 835  46.555 -19.596  -4.415
    5   HG13  ILE 835          HG13      ILE 835  46.455 -20.917  -5.556
    6   HG21  ILE 835          HG21      ILE 835  43.661 -18.454  -6.159
    7   HG23  ILE 835          HG22      ILE 835  44.505 -18.741  -4.622
    8   HG22  ILE 835          HG23      ILE 835  44.017 -20.108  -5.623
    9   HD12  ILE 835          HD11      ILE 835  48.733 -20.308  -5.070
   10   HD11  ILE 835          HD12      ILE 835  48.411 -18.653  -5.607
   11   HD13  ILE 835          HD13      ILE 835  48.350 -19.983  -6.768

  No H/Q in entry =          11
  In of MODEL    3
    1    H    ARG 836           H        ARG 836  46.775 -21.038  -9.415
    2    HA   ARG 836           HA       ARG 836  48.969 -19.145  -9.979
    3    HB2  ARG 836           HB2      ARG 836  48.874 -22.060 -10.714
    4    HB3  ARG 836           HB3      ARG 836  50.275 -21.017 -10.592
    5    HG2  ARG 836           HG2      ARG 836  50.005 -20.991  -8.150
    6    HG3  ARG 836           HG3      ARG 836  48.640 -22.103  -8.314
    7    HD2  ARG 836           HD2      ARG 836  50.235 -23.547  -9.654
    8    HD3  ARG 836           HD3      ARG 836  51.521 -22.566  -8.965
    9    HE   ARG 836           HE       ARG 836  49.597 -23.831  -7.188
   10   HH11  ARG 836          HH11      ARG 836  52.926 -23.703  -8.419
   11   HH12  ARG 836          HH12      ARG 836  53.541 -24.781  -7.267
   12   HH21  ARG 836          HH21      ARG 836  50.446 -25.367  -5.609
   13   HH22  ARG 836          HH22      ARG 836  52.101 -25.735  -5.620

  No H/Q in entry =          13
  In of MODEL    3
    1    HA   PRO 837           HA       PRO 837  46.983 -19.073 -14.020
    2    HB2  PRO 837           HB2      PRO 837  49.010 -18.091 -15.540
    3    HB3  PRO 837           HB3      PRO 837  48.083 -17.076 -14.431
    4    HG2  PRO 837           HG2      PRO 837  50.785 -18.293 -14.081
    5    HG3  PRO 837           HG3      PRO 837  50.205 -16.692 -13.592
    6    HD2  PRO 837           HD2      PRO 837  50.458 -18.813 -11.874
    7    HD3  PRO 837           HD3      PRO 837  49.311 -17.482 -11.635

  No H/Q in entry =           7
  In of MODEL    3
    1    H    CYS 838           H        CYS 838  46.828 -20.474 -15.767
    2    HA   CYS 838           HA       CYS 838  48.793 -22.588 -15.836
    3    HB2  CYS 838           HB2      CYS 838  45.956 -22.415 -16.812
    4    HB3  CYS 838           HB3      CYS 838  47.040 -23.653 -17.432

  No H/Q in entry =           4
  In of MODEL    3
    1    H    ALA 839           H        ALA 839  48.734 -23.520 -18.383
    2    HA   ALA 839           HA       ALA 839  50.282 -21.577 -19.745
    3    HB2  ALA 839           HB1      ALA 839  49.316 -24.256 -20.731
    4    HB1  ALA 839           HB2      ALA 839  50.803 -23.972 -19.825
    5    HB3  ALA 839           HB3      ALA 839  50.608 -23.286 -21.438

  No H/Q in entry =           5
  In of MODEL    3
    1    H    ALA 840           H        ALA 840  46.985 -22.467 -19.894
    2    HA   ALA 840           HA       ALA 840  46.472 -21.384 -22.497
    3    HB3  ALA 840           HB1      ALA 840  44.106 -21.607 -21.886
    4    HB2  ALA 840           HB2      ALA 840  44.605 -22.003 -20.240
    5    HB1  ALA 840           HB3      ALA 840  45.017 -23.092 -21.570

  No H/Q in entry =           5
  In of MODEL    3
    1    H    GLU 841           H        GLU 841  47.733 -19.395 -21.914
    2    HA   GLU 841           HA       GLU 841  46.210 -17.401 -20.439
    3    HB2  GLU 841           HB2      GLU 841  48.959 -17.166 -21.661
    4    HB3  GLU 841           HB3      GLU 841  48.220 -16.045 -20.529
    5    HG2  GLU 841           HG2      GLU 841  48.280 -17.713 -18.790
    6    HG3  GLU 841           HG3      GLU 841  48.930 -18.898 -19.923

  No H/Q in entry =           6
  In of MODEL    3
    1    H    THR 842           H        THR 842  44.636 -17.530 -22.277
    2    HA   THR 842           HA       THR 842  43.586 -16.647 -24.074
    3    HB   THR 842           HB       THR 842  45.717 -14.531 -24.100
    4    HG1  THR 842           HG1      THR 842  43.354 -14.456 -22.502
    5   HG22  THR 842          HG21      THR 842  42.734 -14.409 -24.649
    6   HG21  THR 842          HG22      THR 842  44.003 -14.414 -25.872
    7   HG23  THR 842          HG23      THR 842  43.849 -13.046 -24.773

  No H/Q in entry =           7
  In of MODEL    3
    1    H    GLN 843           H        GLN 843  45.111 -18.681 -24.695
    2    HA   GLN 843           HA       GLN 843  46.412 -17.910 -27.215
    3    HB2  GLN 843           HB2      GLN 843  47.211 -20.279 -25.502
    4    HB3  GLN 843           HB3      GLN 843  47.966 -19.778 -27.004
    5    HG2  GLN 843           HG2      GLN 843  48.615 -17.647 -25.863
    6    HG3  GLN 843           HG3      GLN 843  48.031 -18.353 -24.358
    7   HE21  GLN 843          HE21      GLN 843  49.165 -20.184 -23.496
    8   HE22  GLN 843          HE22      GLN 843  50.768 -20.492 -23.974

  No H/Q in entry =           8
  In of MODEL    4
    1    H1   GLY 689           H2       GLY 689  38.220   9.740 -21.978
    2    H2   GLY 689           H1       GLY 689  37.755   8.280 -21.265
    3    H3   GLY 689           H3       GLY 689  39.367   8.786 -21.202
    4    HA2  GLY 689           HA2      GLY 689  37.860   8.032 -23.618
    5    HA3  GLY 689           HA3      GLY 689  39.090   7.059 -22.822

  No H/Q in entry =           5
  In of MODEL    4
    1    H    SER 690           H        SER 690  41.258   7.941 -22.711
    2    HA   SER 690           HA       SER 690  41.765   9.592 -25.044
    3    HB2  SER 690           HB2      SER 690  43.237   9.644 -22.410
    4    HB3  SER 690           HB3      SER 690  43.726  10.537 -23.850
    5    HG   SER 690           HG       SER 690  41.582  11.498 -23.783

  No H/Q in entry =           5
  In of MODEL    4
    1    H    HIS 691           H        HIS 691  42.377   8.167 -26.478
    2    HA   HIS 691           HA       HIS 691  44.761   6.637 -25.992
    3    HB2  HIS 691           HB2      HIS 691  43.721   4.525 -26.952
    4    HB3  HIS 691           HB3      HIS 691  43.195   4.952 -25.338
    5    HD1  HIS 691           HD1      HIS 691  40.716   4.783 -24.987
    6    HD2  HIS 691           HD2      HIS 691  41.688   5.330 -29.003
    7    HE1  HIS 691           HE1      HIS 691  38.571   4.645 -26.220
    8    HE2  HIS 691           HE2      HIS 691  39.202   4.742 -28.641

  No H/Q in entry =           8
  In of MODEL    4
    1    H    MET 692           H        MET 692  44.017   8.937 -27.532
    2    HA   MET 692           HA       MET 692  43.781   8.371 -30.306
    3    HB2  MET 692           HB2      MET 692  43.311  10.580 -29.402
    4    HB3  MET 692           HB3      MET 692  44.973  10.745 -28.853
    5    HG2  MET 692           HG2      MET 692  45.699  10.708 -31.220
    6    HG3  MET 692           HG3      MET 692  44.010  10.655 -31.715
    7    HE3  MET 692           HE1      MET 692  44.978  14.318 -32.644
    8    HE2  MET 692           HE2      MET 692  44.208  12.832 -33.198
    9    HE1  MET 692           HE3      MET 692  45.934  12.847 -32.836

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ASN 693           H        ASN 693  46.468   8.983 -28.161
    2    HA   ASN 693           HA       ASN 693  48.268   7.990 -30.237
    3    HB2  ASN 693           HB2      ASN 693  50.133   9.019 -28.994
    4    HB3  ASN 693           HB3      ASN 693  48.909  10.224 -29.359
    5   HD21  ASN 693          HD21      ASN 693  47.760  11.154 -27.662
    6   HD22  ASN 693          HD22      ASN 693  48.236  10.964 -26.021

  No H/Q in entry =           6
  In of MODEL    4
    1    HA   PRO 694           HA       PRO 694  48.637   4.196 -27.896
    2    HB2  PRO 694           HB2      PRO 694  51.427   4.188 -28.929
    3    HB3  PRO 694           HB3      PRO 694  50.184   2.942 -29.076
    4    HG2  PRO 694           HG2      PRO 694  50.865   4.443 -31.172
    5    HG3  PRO 694           HG3      PRO 694  49.179   3.971 -30.892
    6    HD2  PRO 694           HD2      PRO 694  50.511   6.606 -30.401
    7    HD3  PRO 694           HD3      PRO 694  48.881   6.245 -31.003

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LEU 695           H        LEU 695  48.790   4.599 -25.768
    2    HA   LEU 695           HA       LEU 695  50.836   6.298 -24.727
    3    HB2  LEU 695           HB2      LEU 695  48.550   6.376 -23.852
    4    HB3  LEU 695           HB3      LEU 695  48.697   4.715 -23.312
    5    HG   LEU 695           HG       LEU 695  50.460   5.399 -21.727
    6   HD11  LEU 695          HD11      LEU 695  49.827   8.198 -22.661
    7   HD13  LEU 695          HD12      LEU 695  51.338   7.321 -22.918
    8   HD12  LEU 695          HD13      LEU 695  50.847   7.769 -21.287
    9   HD21  LEU 695          HD21      LEU 695  48.139   5.299 -20.998
   10   HD23  LEU 695          HD22      LEU 695  47.900   6.977 -21.486
   11   HD22  LEU 695          HD23      LEU 695  49.004   6.589 -20.167

  No H/Q in entry =          11
  In of MODEL    4
    1    H    THR 696           H        THR 696  52.745   5.682 -24.057
    2    HA   THR 696           HA       THR 696  53.415   2.934 -23.914
    3    HB   THR 696           HB       THR 696  55.661   4.103 -23.243
    4    HG1  THR 696           HG1      THR 696  55.667   6.273 -24.026
    5   HG22  THR 696          HG21      THR 696  56.121   4.557 -25.618
    6   HG21  THR 696          HG22      THR 696  54.389   4.514 -25.960
    7   HG23  THR 696          HG23      THR 696  55.219   3.053 -25.425

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLN 697           H        GLN 697  52.409   2.069 -22.137
    2    HA   GLN 697           HA       GLN 697  52.819   3.353 -19.568
    3    HB2  GLN 697           HB2      GLN 697  50.538   2.561 -20.054
    4    HB3  GLN 697           HB3      GLN 697  51.148   0.934 -20.302
    5    HG2  GLN 697           HG2      GLN 697  50.133   1.073 -18.120
    6    HG3  GLN 697           HG3      GLN 697  51.873   0.864 -17.946
    7   HE21  GLN 697          HE21      GLN 697  50.264   3.883 -18.749
    8   HE22  GLN 697          HE22      GLN 697  50.654   4.685 -17.274

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ALA 698           H        ALA 698  54.693   2.893 -18.681
    2    HA   ALA 698           HA       ALA 698  55.939   0.327 -19.151
    3    HB1  ALA 698           HB1      ALA 698  57.367   2.283 -19.296
    4    HB2  ALA 698           HB2      ALA 698  57.860   1.296 -17.919
    5    HB3  ALA 698           HB3      ALA 698  56.918   2.765 -17.662

  No H/Q in entry =           5
  In of MODEL    4
    1    H    VAL 699           H        VAL 699  54.912  -1.133 -18.040
    2    HA   VAL 699           HA       VAL 699  54.018  -0.677 -15.339
    3    HB   VAL 699           HB       VAL 699  54.026  -3.242 -16.969
    4   HG13  VAL 699          HG11      VAL 699  53.796  -3.656 -14.588
    5   HG12  VAL 699          HG12      VAL 699  52.275  -3.995 -15.412
    6   HG11  VAL 699          HG13      VAL 699  52.468  -2.500 -14.494
    7   HG23  VAL 699          HG21      VAL 699  51.809  -1.215 -16.645
    8   HG22  VAL 699          HG22      VAL 699  51.660  -2.776 -17.452
    9   HG21  VAL 699          HG23      VAL 699  52.723  -1.538 -18.120

  No H/Q in entry =           9
  In of MODEL    4
    1    HA   PRO 700           HA       PRO 700  58.016  -1.931 -13.625
    2    HB2  PRO 700           HB2      PRO 700  56.195  -2.714 -11.398
    3    HB3  PRO 700           HB3      PRO 700  57.685  -1.768 -11.334
    4    HG2  PRO 700           HG2      PRO 700  55.357  -0.539 -11.111
    5    HG3  PRO 700           HG3      PRO 700  56.648   0.171 -12.100
    6    HD2  PRO 700           HD2      PRO 700  54.185  -1.291 -12.958
    7    HD3  PRO 700           HD3      PRO 700  54.980   0.123 -13.685

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LYS 701           H        LYS 701  59.008  -3.954 -13.587
    2    HA   LYS 701           HA       LYS 701  57.232  -6.034 -14.441
    3    HB2  LYS 701           HB2      LYS 701  60.242  -6.013 -14.394
    4    HB3  LYS 701           HB3      LYS 701  59.256  -7.334 -15.012
    5    HG2  LYS 701           HG2      LYS 701  59.367  -4.514 -16.064
    6    HG3  LYS 701           HG3      LYS 701  60.017  -5.956 -16.857
    7    HD2  LYS 701           HD2      LYS 701  57.728  -6.857 -17.017
    8    HD3  LYS 701           HD3      LYS 701  57.102  -5.397 -16.259
    9    HE2  LYS 701           HE2      LYS 701  56.766  -5.205 -18.597
   10    HE3  LYS 701           HE3      LYS 701  58.044  -4.088 -18.139
   11    HZ2  LYS 701           HZ1      LYS 701  58.516  -5.319 -20.181
   12    HZ1  LYS 701           HZ2      LYS 701  58.508  -6.769 -19.337
   13    HZ3  LYS 701           HZ3      LYS 701  59.678  -5.597 -19.000

  No H/Q in entry =          13
  In of MODEL    4
    1    H    CYS 702           H        CYS 702  56.178  -6.182 -12.676
    2    HA   CYS 702           HA       CYS 702  57.203  -8.166 -10.816
    3    HB2  CYS 702           HB2      CYS 702  55.692  -5.634 -10.048
    4    HB3  CYS 702           HB3      CYS 702  55.953  -6.999  -9.009

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLN 703           H        GLN 703  55.599  -9.528 -10.072
    2    HA   GLN 703           HA       GLN 703  53.260  -9.604 -11.788
    3    HB2  GLN 703           HB2      GLN 703  54.095 -11.448  -9.542
    4    HB3  GLN 703           HB3      GLN 703  52.818 -11.748 -10.712
    5    HG2  GLN 703           HG2      GLN 703  55.767 -11.555 -11.300
    6    HG3  GLN 703           HG3      GLN 703  54.795 -13.025 -11.279
    7   HE21  GLN 703          HE21      GLN 703  53.376 -13.392 -12.971
    8   HE22  GLN 703          HE22      GLN 703  53.479 -12.583 -14.477

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ARG 704           H        ARG 704  51.301 -10.459 -10.321
    2    HA   ARG 704           HA       ARG 704  50.200  -8.075  -9.406
    3    HB2  ARG 704           HB2      ARG 704  49.329 -10.884  -8.950
    4    HB3  ARG 704           HB3      ARG 704  48.329  -9.461  -8.699
    5    HG2  ARG 704           HG2      ARG 704  49.633  -9.862 -11.317
    6    HG3  ARG 704           HG3      ARG 704  48.235 -10.843 -10.919
    7    HD2  ARG 704           HD2      ARG 704  47.512  -8.966 -12.137
    8    HD3  ARG 704           HD3      ARG 704  47.000  -8.717 -10.467
    9    HE   ARG 704           HE       ARG 704  49.108  -7.203 -10.450
   10   HH11  ARG 704          HH11      ARG 704  46.997  -7.726 -13.248
   11   HH12  ARG 704          HH12      ARG 704  47.050  -6.156 -13.832
   12   HH21  ARG 704          HH21      ARG 704  49.268  -5.003 -11.232
   13   HH22  ARG 704          HH22      ARG 704  48.439  -4.549 -12.665

  No H/Q in entry =          13
  In of MODEL    4
    1    H    TRP 705           H        TRP 705  51.908 -10.512  -7.627
    2    HA   TRP 705           HA       TRP 705  51.076  -9.457  -5.024
    3    HB2  TRP 705           HB2      TRP 705  52.260 -11.503  -4.158
    4    HB3  TRP 705           HB3      TRP 705  50.848 -11.828  -5.149
    5    HD1  TRP 705           HD1      TRP 705  54.566 -12.530  -4.920
    6    HE1  TRP 705           HE1      TRP 705  55.271 -14.006  -6.864
    7    HE3  TRP 705           HE3      TRP 705  50.269 -12.374  -7.721
    8    HZ2  TRP 705           HZ2      TRP 705  54.189 -15.029  -9.255
    9    HZ3  TRP 705           HZ3      TRP 705  50.194 -13.652  -9.820
   10    HH2  TRP 705           HH2      TRP 705  52.116 -14.952 -10.571

  No H/Q in entry =          10
  In of MODEL    4
    1    H    GLU 706           H        GLU 706  53.248  -8.611  -7.224
    2    HA   GLU 706           HA       GLU 706  55.343  -8.121  -5.253
    3    HB2  GLU 706           HB2      GLU 706  55.686  -8.677  -8.210
    4    HB3  GLU 706           HB3      GLU 706  56.965  -8.261  -7.076
    5    HG2  GLU 706           HG2      GLU 706  56.557 -10.334  -5.887
    6    HG3  GLU 706           HG3      GLU 706  55.243 -10.717  -6.999

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS 707           H        LYS 707  56.601  -6.241  -5.667
    2    HA   LYS 707           HA       LYS 707  55.338  -4.192  -7.270
    3    HB2  LYS 707           HB2      LYS 707  55.344  -2.558  -5.424
    4    HB3  LYS 707           HB3      LYS 707  54.192  -3.863  -5.181
    5    HG2  LYS 707           HG2      LYS 707  55.471  -4.816  -3.466
    6    HG3  LYS 707           HG3      LYS 707  56.915  -3.918  -3.928
    7    HD2  LYS 707           HD2      LYS 707  55.823  -3.040  -1.873
    8    HD3  LYS 707           HD3      LYS 707  55.948  -1.851  -3.163
    9    HE2  LYS 707           HE2      LYS 707  53.593  -2.312  -3.769
   10    HE3  LYS 707           HE3      LYS 707  53.493  -3.441  -2.420
   11    HZ3  LYS 707           HZ1      LYS 707  53.874  -1.666  -0.902
   12    HZ2  LYS 707           HZ2      LYS 707  52.622  -1.176  -1.942
   13    HZ1  LYS 707           HZ3      LYS 707  54.181  -0.584  -2.144

  No H/Q in entry =          13
  In of MODEL    4
    1    H    LEU 708           H        LEU 708  56.641  -2.293  -7.425
    2    HA   LEU 708           HA       LEU 708  59.468  -3.006  -7.417
    3    HB2  LEU 708           HB2      LEU 708  58.445  -2.354  -9.526
    4    HB3  LEU 708           HB3      LEU 708  57.945  -0.823  -8.838
    5    HG   LEU 708           HG       LEU 708  60.376  -0.249  -8.557
    6   HD11  LEU 708          HD11      LEU 708  60.758  -2.728 -10.203
    7   HD13  LEU 708          HD12      LEU 708  61.294  -2.476  -8.541
    8   HD12  LEU 708          HD13      LEU 708  61.996  -1.526  -9.847
    9   HD21  LEU 708          HD21      LEU 708  59.052   0.570 -10.462
   10   HD23  LEU 708          HD22      LEU 708  59.525  -0.861 -11.386
   11   HD22  LEU 708          HD23      LEU 708  60.741   0.305 -10.880

  No H/Q in entry =          11
  In of MODEL    4
    1    H    GLN 709           H        GLN 709  60.542  -2.292  -5.676
    2    HA   GLN 709           HA       GLN 709  60.246   0.517  -4.937
    3    HB2  GLN 709           HB2      GLN 709  60.351   0.081  -2.554
    4    HB3  GLN 709           HB3      GLN 709  58.995  -0.836  -3.186
    5    HG2  GLN 709           HG2      GLN 709  60.336  -2.886  -3.126
    6    HG3  GLN 709           HG3      GLN 709  61.723  -1.938  -2.616
    7   HE21  GLN 709          HE21      GLN 709  61.963  -1.366  -0.522
    8   HE22  GLN 709          HE22      GLN 709  60.919  -1.908   0.734

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ASN 710           H        ASN 710  62.229   1.384  -4.327
    2    HA   ASN 710           HA       ASN 710  64.530   1.551  -4.095
    3    HB2  ASN 710           HB2      ASN 710  63.893  -0.415  -2.452
    4    HB3  ASN 710           HB3      ASN 710  64.606  -1.431  -3.671
    5   HD21  ASN 710          HD21      ASN 710  65.139   0.775  -1.197
    6   HD22  ASN 710          HD22      ASN 710  66.865   0.677  -1.139

  No H/Q in entry =           6
  In of MODEL    4
    1    H    SER 711           H        SER 711  63.079   0.683  -6.554
    2    HA   SER 711           HA       SER 711  63.371   0.127  -8.688
    3    HB2  SER 711           HB2      SER 711  66.257   0.618  -7.998
    4    HB3  SER 711           HB3      SER 711  65.652   0.464  -9.662
    5    HG   SER 711           HG       SER 711  64.320   2.199  -7.973

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ARG 712           H        ARG 712  63.453  -1.991  -6.597
    2    HA   ARG 712           HA       ARG 712  64.341  -4.116  -8.393
    3    HB2  ARG 712           HB2      ARG 712  65.017  -5.489  -6.471
    4    HB3  ARG 712           HB3      ARG 712  65.955  -4.006  -6.511
    5    HG2  ARG 712           HG2      ARG 712  64.668  -3.066  -4.745
    6    HG3  ARG 712           HG3      ARG 712  63.537  -4.418  -4.763
    7    HD2  ARG 712           HD2      ARG 712  65.416  -5.920  -4.136
    8    HD3  ARG 712           HD3      ARG 712  66.471  -4.512  -4.026
    9    HE   ARG 712           HE       ARG 712  64.780  -3.730  -2.283
   10   HH11  ARG 712          HH11      ARG 712  65.567  -7.179  -2.761
   11   HH12  ARG 712          HH12      ARG 712  65.236  -7.579  -1.143
   12   HH21  ARG 712          HH21      ARG 712  64.316  -4.366  -0.099
   13   HH22  ARG 712          HH22      ARG 712  64.511  -5.981   0.389

  No H/Q in entry =          13
  In of MODEL    4
    1    H    CYS 713           H        CYS 713  63.059  -6.139  -7.968
    2    HA   CYS 713           HA       CYS 713  60.376  -5.310  -7.226
    3    HB2  CYS 713           HB2      CYS 713  60.734  -6.347  -9.474
    4    HB3  CYS 713           HB3      CYS 713  61.192  -7.851  -8.661

  No H/Q in entry =           4
  In of MODEL    4
    1    H    VAL 714           H        VAL 714  59.371  -6.090  -5.554
    2    HA   VAL 714           HA       VAL 714  60.422  -8.376  -4.058
    3    HB   VAL 714           HB       VAL 714  60.085  -7.185  -1.923
    4   HG11  VAL 714          HG11      VAL 714  61.957  -5.708  -3.758
    5   HG13  VAL 714          HG12      VAL 714  62.332  -7.161  -2.830
    6   HG12  VAL 714          HG13      VAL 714  61.992  -5.644  -1.998
    7   HG23  VAL 714          HG21      VAL 714  59.755  -4.740  -1.894
    8   HG22  VAL 714          HG22      VAL 714  58.390  -5.608  -2.598
    9   HG21  VAL 714          HG23      VAL 714  59.538  -4.776  -3.646

  No H/Q in entry =           9
  In of MODEL    4
    1    H    CYS 715           H        CYS 715  58.656  -8.775  -2.239
    2    HA   CYS 715           HA       CYS 715  56.142  -8.834  -3.670
    3    HB2  CYS 715           HB2      CYS 715  56.969 -10.078  -1.040
    4    HB3  CYS 715           HB3      CYS 715  55.368 -10.235  -1.750

  No H/Q in entry =           4
  In of MODEL    4
    1    H    LYS 716           H        LYS 716  54.252  -7.986  -2.882
    2    HA   LYS 716           HA       LYS 716  54.532  -5.532  -1.396
    3    HB2  LYS 716           HB2      LYS 716  52.150  -5.225  -1.889
    4    HB3  LYS 716           HB3      LYS 716  52.965  -5.779  -3.341
    5    HG2  LYS 716           HG2      LYS 716  52.202  -8.134  -2.502
    6    HG3  LYS 716           HG3      LYS 716  51.016  -7.206  -1.593
    7    HD2  LYS 716           HD2      LYS 716  51.414  -7.139  -4.592
    8    HD3  LYS 716           HD3      LYS 716  50.136  -7.993  -3.742
    9    HE2  LYS 716           HE2      LYS 716  49.233  -5.865  -2.965
   10    HE3  LYS 716           HE3      LYS 716  50.550  -5.007  -3.772
   11    HZ2  LYS 716           HZ1      LYS 716  48.457  -6.648  -5.151
   12    HZ1  LYS 716           HZ2      LYS 716  49.792  -5.940  -5.878
   13    HZ3  LYS 716           HZ3      LYS 716  48.633  -4.958  -5.184

  No H/Q in entry =          13
  In of MODEL    4
    1    H    MET 717           H        MET 717  52.617  -5.288   0.377
    2    HA   MET 717           HA       MET 717  53.063  -7.549   2.162
    3    HB2  MET 717           HB2      MET 717  52.269  -4.702   2.741
    4    HB3  MET 717           HB3      MET 717  52.306  -5.960   3.969
    5    HG2  MET 717           HG2      MET 717  54.663  -5.047   2.330
    6    HG3  MET 717           HG3      MET 717  54.330  -4.583   3.998
    7    HE1  MET 717           HE1      MET 717  53.401  -7.200   5.450
    8    HE3  MET 717           HE2      MET 717  54.704  -6.201   6.098
    9    HE2  MET 717           HE3      MET 717  54.925  -7.939   5.937

  No H/Q in entry =           9
  In of MODEL    4
    1    HA   PRO 718           HA       PRO 718  48.997  -9.052   1.674
    2    HB2  PRO 718           HB2      PRO 718  48.519 -10.174   4.120
    3    HB3  PRO 718           HB3      PRO 718  49.573 -10.902   2.903
    4    HG2  PRO 718           HG2      PRO 718  50.300  -9.237   5.281
    5    HG3  PRO 718           HG3      PRO 718  51.064 -10.722   4.685
    6    HD2  PRO 718           HD2      PRO 718  52.125  -8.306   4.209
    7    HD3  PRO 718           HD3      PRO 718  52.203  -9.605   3.001

  No H/Q in entry =           7
  In of MODEL    4
    1    H    TYR 719           H        TYR 719  49.621  -6.692   4.048
    2    HA   TYR 719           HA       TYR 719  46.806  -6.397   4.668
    3    HB2  TYR 719           HB2      TYR 719  47.477  -4.645   6.251
    4    HB3  TYR 719           HB3      TYR 719  48.319  -6.156   6.550
    5    HD1  TYR 719           HD1      TYR 719  48.635  -2.662   5.572
    6    HD2  TYR 719           HD2      TYR 719  50.756  -6.316   6.109
    7    HE1  TYR 719           HE1      TYR 719  50.742  -1.419   5.607
    8    HE2  TYR 719           HE2      TYR 719  52.870  -5.073   6.166
    9    HH   TYR 719           HH       TYR 719  53.812  -3.007   5.474

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLU 720           H        GLU 720  48.822  -5.493   2.292
    2    HA   GLU 720           HA       GLU 720  47.335  -3.053   1.711
    3    HB2  GLU 720           HB2      GLU 720  49.965  -4.127   0.764
    4    HB3  GLU 720           HB3      GLU 720  49.170  -2.751  -0.019
    5    HG2  GLU 720           HG2      GLU 720  49.255  -1.534   2.099
    6    HG3  GLU 720           HG3      GLU 720  50.053  -2.915   2.854

  No H/Q in entry =           6
  In of MODEL    4
    1    H    CYS 721           H        CYS 721  46.789  -5.976   1.460
    2    HA   CYS 721           HA       CYS 721  46.352  -6.352  -1.390
    3    HB2  CYS 721           HB2      CYS 721  47.328  -8.200  -0.198
    4    HB3  CYS 721           HB3      CYS 721  46.083  -8.137   1.041

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLY 722           H        GLY 722  44.233  -6.637  -2.203
    2    HA3  GLY 722           HA2      GLY 722  42.006  -6.225  -0.380
    3    HA2  GLY 722           HA3      GLY 722  42.261  -4.984  -1.602

  No H/Q in entry =           3
  In of MODEL    4
    1    HA   PRO 723           HA       PRO 723  39.872  -7.319  -4.490
    2    HB2  PRO 723           HB2      PRO 723  41.260  -6.850  -6.820
    3    HB3  PRO 723           HB3      PRO 723  40.147  -5.694  -6.083
    4    HG2  PRO 723           HG2      PRO 723  43.132  -5.815  -5.929
    5    HG3  PRO 723           HG3      PRO 723  42.083  -4.403  -6.127
    6    HD2  PRO 723           HD2      PRO 723  43.180  -5.024  -3.759
    7    HD3  PRO 723           HD3      PRO 723  41.553  -4.322  -3.873

  No H/Q in entry =           7
  In of MODEL    4
    1    H    SER 724           H        SER 724  39.895  -9.513  -4.477
    2    HA   SER 724           HA       SER 724  41.714 -11.211  -5.928
    3    HB2  SER 724           HB2      SER 724  43.062 -10.324  -3.953
    4    HB3  SER 724           HB3      SER 724  41.991 -11.283  -2.945
    5    HG   SER 724           HG       SER 724  43.162 -12.239  -5.247

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU 725           H        LEU 725  41.120 -13.264  -5.980
    2    HA   LEU 725           HA       LEU 725  38.394 -13.856  -5.162
    3    HB2  LEU 725           HB2      LEU 725  40.454 -15.361  -6.705
    4    HB3  LEU 725           HB3      LEU 725  39.248 -16.300  -5.863
    5    HG   LEU 725           HG       LEU 725  37.483 -15.054  -7.190
    6   HD13  LEU 725          HD11      LEU 725  38.023 -13.754  -8.964
    7   HD12  LEU 725          HD12      LEU 725  39.696 -14.233  -8.882
    8   HD11  LEU 725          HD13      LEU 725  39.030 -13.154  -7.628
    9   HD22  LEU 725          HD21      LEU 725  37.858 -16.246  -9.222
   10   HD21  LEU 725          HD22      LEU 725  38.332 -17.283  -7.861
   11   HD23  LEU 725          HD23      LEU 725  39.558 -16.436  -8.827

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ASP 726           H        ASP 726  37.792 -14.713  -3.316
    2    HA   ASP 726           HA       ASP 726  39.780 -15.584  -1.464
    3    HB2  ASP 726           HB2      ASP 726  36.778 -15.389  -1.259
    4    HB3  ASP 726           HB3      ASP 726  37.725 -16.188  -0.011

  No H/Q in entry =           4
  In of MODEL    4
    1    H    VAL 727           H        VAL 727  40.261 -17.532  -0.796
    2    HA   VAL 727           HA       VAL 727  39.039 -19.853  -2.092
    3    HB   VAL 727           HB       VAL 727  41.307 -20.797  -2.610
    4   HG12  VAL 727          HG11      VAL 727  41.766 -19.471  -4.652
    5   HG11  VAL 727          HG12      VAL 727  40.710 -18.204  -4.041
    6   HG13  VAL 727          HG13      VAL 727  40.045 -19.789  -4.433
    7   HG21  VAL 727          HG21      VAL 727  42.646 -19.458  -1.067
    8   HG23  VAL 727          HG22      VAL 727  42.301 -18.005  -2.005
    9   HG22  VAL 727          HG23      VAL 727  43.261 -19.303  -2.713

  No H/Q in entry =           9
  In of MODEL    4
    1    H    CYS 728           H        CYS 728  39.666 -21.868  -0.977
    2    HA   CYS 728           HA       CYS 728  40.233 -21.349   1.848
    3    HB2  CYS 728           HB2      CYS 728  39.253 -23.880   0.505
    4    HB3  CYS 728           HB3      CYS 728  39.372 -23.601   2.235

  No H/Q in entry =           4
  In of MODEL    4
    1    H    ALA 729           H        ALA 729  42.290 -21.893   2.673
    2    HA   ALA 729           HA       ALA 729  43.766 -23.737   0.961
    3    HB2  ALA 729           HB1      ALA 729  45.797 -22.492   1.443
    4    HB1  ALA 729           HB2      ALA 729  44.874 -21.363   2.428
    5    HB3  ALA 729           HB3      ALA 729  44.597 -21.443   0.685

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLN 730           H        GLN 730  45.280 -24.981   2.042
    2    HA   GLN 730           HA       GLN 730  44.562 -25.472   4.821
    3    HB2  GLN 730           HB2      GLN 730  44.410 -27.412   3.296
    4    HB3  GLN 730           HB3      GLN 730  46.110 -27.221   2.920
    5    HG2  GLN 730           HG2      GLN 730  46.755 -27.678   5.154
    6    HG3  GLN 730           HG3      GLN 730  45.093 -27.720   5.707
    7   HE21  GLN 730          HE21      GLN 730  45.167 -29.839   6.425
    8   HE22  GLN 730          HE22      GLN 730  45.365 -31.174   5.363

  No H/Q in entry =           8
  In of MODEL    4
    1    H    ASP 731           H        ASP 731  45.884 -24.845   6.271
    2    HA   ASP 731           HA       ASP 731  48.426 -23.626   5.791
    3    HB2  ASP 731           HB2      ASP 731  46.868 -23.050   7.683
    4    HB3  ASP 731           HB3      ASP 731  47.224 -24.621   8.378

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLU 732           H        GLU 732  50.379 -24.664   5.649
    2    HA   GLU 732           HA       GLU 732  50.307 -27.514   5.759
    3    HB2  GLU 732           HB2      GLU 732  52.488 -25.624   4.994
    4    HB3  GLU 732           HB3      GLU 732  52.690 -27.380   4.979
    5    HG2  GLU 732           HG2      GLU 732  50.698 -27.462   3.430
    6    HG3  GLU 732           HG3      GLU 732  50.809 -25.702   3.394

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ARG 733           H        ARG 733  50.887 -25.374   8.228
    2    HA   ARG 733           HA       ARG 733  52.618 -27.418   9.427
    3    HB2  ARG 733           HB2      ARG 733  53.526 -25.025   9.246
    4    HB3  ARG 733           HB3      ARG 733  52.355 -24.601  10.482
    5    HG2  ARG 733           HG2      ARG 733  54.552 -24.986  11.468
    6    HG3  ARG 733           HG3      ARG 733  53.403 -26.207  12.023
    7    HD2  ARG 733           HD2      ARG 733  54.285 -27.822  10.450
    8    HD3  ARG 733           HD3      ARG 733  55.329 -26.602   9.727
    9    HE   ARG 733           HE       ARG 733  55.931 -26.862  12.458
   10   HH11  ARG 733          HH11      ARG 733  56.206 -28.758   9.449
   11   HH12  ARG 733          HH12      ARG 733  57.632 -29.555   9.941
   12   HH21  ARG 733          HH21      ARG 733  57.872 -28.007  13.103
   13   HH22  ARG 733          HH22      ARG 733  58.592 -29.126  12.027

  No H/Q in entry =          13
  In of MODEL    4
    1    H    SER 734           H        SER 734  49.841 -25.386   9.894
    2    HA   SER 734           HA       SER 734  49.193 -26.601  12.447
    3    HB2  SER 734           HB2      SER 734  47.433 -24.760  10.863
    4    HB3  SER 734           HB3      SER 734  47.597 -24.892  12.617
    5    HG   SER 734           HG       SER 734  49.432 -23.797  10.746

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LYS 735           H        LYS 735  48.505 -27.040   9.104
    2    HA   LYS 735           HA       LYS 735  47.197 -28.337   7.845
    3    HB2  LYS 735           HB2      LYS 735  47.172 -30.155  10.266
    4    HB3  LYS 735           HB3      LYS 735  46.786 -30.629   8.617
    5    HG2  LYS 735           HG2      LYS 735  49.470 -29.741   9.678
    6    HG3  LYS 735           HG3      LYS 735  49.026 -31.349   9.121
    7    HD2  LYS 735           HD2      LYS 735  49.115 -28.871   7.376
    8    HD3  LYS 735           HD3      LYS 735  50.406 -30.046   7.502
    9    HE2  LYS 735           HE2      LYS 735  47.606 -30.670   6.552
   10    HE3  LYS 735           HE3      LYS 735  48.959 -30.321   5.489
   11    HZ3  LYS 735           HZ1      LYS 735  48.633 -32.664   5.683
   12    HZ2  LYS 735           HZ2      LYS 735  48.752 -32.608   7.366
   13    HZ1  LYS 735           HZ3      LYS 735  50.101 -32.261   6.409

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ARG 736           H        ARG 736  45.873 -26.365   8.579
    2    HA   ARG 736           HA       ARG 736  43.112 -27.245   9.239
    3    HB2  ARG 736           HB2      ARG 736  42.839 -25.008  10.284
    4    HB3  ARG 736           HB3      ARG 736  44.108 -25.904  11.120
    5    HG2  ARG 736           HG2      ARG 736  45.796 -24.761   9.823
    6    HG3  ARG 736           HG3      ARG 736  44.562 -23.875   8.961
    7    HD2  ARG 736           HD2      ARG 736  43.940 -22.717  11.011
    8    HD3  ARG 736           HD3      ARG 736  45.137 -23.662  11.914
    9    HE   ARG 736           HE       ARG 736  46.857 -22.667  10.508
   10   HH11  ARG 736          HH11      ARG 736  43.817 -20.896  10.803
   11   HH12  ARG 736          HH12      ARG 736  44.476 -19.439  10.210
   12   HH21  ARG 736          HH21      ARG 736  47.708 -20.746   9.620
   13   HH22  ARG 736          HH22      ARG 736  46.750 -19.331   9.535

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ILE 737           H        ILE 737  41.488 -26.054   7.999
    2    HA   ILE 737           HA       ILE 737  42.737 -24.782   5.765
    3    HB   ILE 737           HB       ILE 737  40.159 -26.317   6.010
    4   HG12  ILE 737          HG12      ILE 737  42.546 -26.724   4.256
    5   HG13  ILE 737          HG13      ILE 737  42.495 -27.331   5.900
    6   HG21  ILE 737          HG21      ILE 737  39.902 -24.314   4.533
    7   HG23  ILE 737          HG22      ILE 737  39.852 -25.828   3.629
    8   HG22  ILE 737          HG23      ILE 737  41.313 -24.839   3.618
    9   HD11  ILE 737          HD11      ILE 737  40.605 -28.002   3.709
   10   HD13  ILE 737          HD12      ILE 737  40.628 -28.612   5.404
   11   HD12  ILE 737          HD13      ILE 737  41.982 -28.962   4.312

  No H/Q in entry =          11
  In of MODEL    4
    1    H    LEU 738           H        LEU 738  42.292 -22.885   5.263
    2    HA   LEU 738           HA       LEU 738  40.462 -21.343   6.916
    3    HB2  LEU 738           HB2      LEU 738  42.103 -19.476   6.747
    4    HB3  LEU 738           HB3      LEU 738  42.389 -20.752   7.891
    5    HG   LEU 738           HG       LEU 738  44.196 -19.701   6.663
    6   HD11  LEU 738          HD11      LEU 738  43.849 -22.651   6.729
    7   HD13  LEU 738          HD12      LEU 738  44.590 -21.618   7.968
    8   HD12  LEU 738          HD13      LEU 738  45.432 -21.924   6.413
    9   HD21  LEU 738          HD21      LEU 738  43.330 -19.873   4.393
   10   HD23  LEU 738          HD22      LEU 738  43.579 -21.616   4.453
   11   HD22  LEU 738          HD23      LEU 738  44.961 -20.521   4.549

  No H/Q in entry =          11
  In of MODEL    4
    1    HA   PRO 739           HA       PRO 739  39.486 -19.260   3.133
    2    HB2  PRO 739           HB2      PRO 739  38.381 -17.031   4.132
    3    HB3  PRO 739           HB3      PRO 739  37.524 -18.578   4.203
    4    HG2  PRO 739           HG2      PRO 739  38.996 -17.129   6.365
    5    HG3  PRO 739           HG3      PRO 739  37.528 -18.113   6.469
    6    HD2  PRO 739           HD2      PRO 739  40.115 -19.063   7.132
    7    HD3  PRO 739           HD3      PRO 739  38.702 -20.051   6.712

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LEU 740           H        LEU 740  41.144 -18.561   2.097
    2    HA   LEU 740           HA       LEU 740  42.560 -16.158   2.999
    3    HB2  LEU 740           HB2      LEU 740  43.579 -18.625   1.667
    4    HB3  LEU 740           HB3      LEU 740  44.308 -17.095   1.243
    5    HG   LEU 740           HG       LEU 740  44.209 -18.260   4.025
    6   HD12  LEU 740          HD11      LEU 740  46.610 -18.628   3.675
    7   HD11  LEU 740          HD12      LEU 740  46.425 -18.107   1.979
    8   HD13  LEU 740          HD13      LEU 740  45.598 -19.548   2.573
    9   HD22  LEU 740          HD21      LEU 740  44.287 -15.818   4.051
   10   HD21  LEU 740          HD22      LEU 740  45.643 -15.844   2.924
   11   HD23  LEU 740          HD23      LEU 740  45.836 -16.500   4.547

  No H/Q in entry =          11
  In of MODEL    4
    1    H    THR 741           H        THR 741  43.688 -15.398   0.772
    2    HA   THR 741           HA       THR 741  41.642 -15.454  -1.277
    3    HB   THR 741           HB       THR 741  43.028 -12.855  -0.643
    4    HG1  THR 741           HG1      THR 741  40.650 -13.714   0.726
    5   HG21  THR 741          HG21      THR 741  41.453 -13.147  -2.526
    6   HG23  THR 741          HG22      THR 741  40.907 -11.936  -1.348
    7   HG22  THR 741          HG23      THR 741  40.195 -13.538  -1.362

  No H/Q in entry =           7
  In of MODEL    4
    1    H    VAL 742           H        VAL 742  42.620 -15.214  -3.386
    2    HA   VAL 742           HA       VAL 742  45.067 -16.449  -3.618
    3    HB   VAL 742           HB       VAL 742  43.755 -16.639  -5.654
    4   HG12  VAL 742          HG11      VAL 742  43.490 -13.777  -5.879
    5   HG11  VAL 742          HG12      VAL 742  42.292 -14.941  -5.273
    6   HG13  VAL 742          HG13      VAL 742  42.904 -15.071  -6.928
    7   HG21  VAL 742          HG21      VAL 742  46.190 -16.231  -6.137
    8   HG23  VAL 742          HG22      VAL 742  45.738 -14.555  -6.439
    9   HG22  VAL 742          HG23      VAL 742  45.063 -15.837  -7.437

  No H/Q in entry =           9
  In of MODEL    4
    1    H    CYS 743           H        CYS 743  44.570 -13.027  -3.725
    2    HA   CYS 743           HA       CYS 743  47.178 -12.227  -4.184
    3    HB2  CYS 743           HB2      CYS 743  45.548 -10.565  -4.328
    4    HB3  CYS 743           HB3      CYS 743  44.807 -11.047  -2.809

  No H/Q in entry =           4
  In of MODEL    4
    1    H    LYS 744           H        LYS 744  45.541 -12.555  -1.009
    2    HA   LYS 744           HA       LYS 744  47.665 -12.154   0.700
    3    HB2  LYS 744           HB2      LYS 744  45.436 -14.162   1.002
    4    HB3  LYS 744           HB3      LYS 744  46.548 -13.718   2.277
    5    HG2  LYS 744           HG2      LYS 744  45.683 -11.416   2.196
    6    HG3  LYS 744           HG3      LYS 744  44.539 -11.909   0.937
    7    HD2  LYS 744           HD2      LYS 744  43.565 -13.558   2.458
    8    HD3  LYS 744           HD3      LYS 744  44.712 -13.089   3.709
    9    HE2  LYS 744           HE2      LYS 744  42.529 -12.089   4.091
   10    HE3  LYS 744           HE3      LYS 744  43.729 -10.851   3.773
   11    HZ2  LYS 744           HZ1      LYS 744  41.589 -10.513   2.607
   12    HZ1  LYS 744           HZ2      LYS 744  41.862 -11.938   1.733
   13    HZ3  LYS 744           HZ3      LYS 744  42.896 -10.620   1.560

  No H/Q in entry =          13
  In of MODEL    4
    1    H    MET 745           H        MET 745  46.544 -15.268  -0.537
    2    HA   MET 745           HA       MET 745  48.493 -16.975   0.481
    3    HB2  MET 745           HB2      MET 745  46.851 -18.106  -0.414
    4    HB3  MET 745           HB3      MET 745  46.583 -17.056  -1.795
    5    HG2  MET 745           HG2      MET 745  47.392 -19.017  -2.786
    6    HG3  MET 745           HG3      MET 745  48.844 -18.073  -2.617
    7    HE1  MET 745           HE1      MET 745  46.775 -21.032  -1.383
    8    HE3  MET 745           HE2      MET 745  46.861 -20.160   0.154
    9    HE2  MET 745           HE3      MET 745  47.710 -21.694  -0.052

  No H/Q in entry =           9
  In of MODEL    4
    1    H    HIS 746           H        HIS 746  48.554 -15.215  -2.647
    2    HA   HIS 746           HA       HIS 746  51.024 -16.338  -3.454
    3    HB2  HIS 746           HB2      HIS 746  49.392 -14.097  -4.376
    4    HB3  HIS 746           HB3      HIS 746  51.105 -13.990  -4.792
    5    HD1  HIS 746           HD1      HIS 746  51.927 -16.396  -6.086
    6    HD2  HIS 746           HD2      HIS 746  47.938 -15.271  -6.170
    7    HE1  HIS 746           HE1      HIS 746  50.971 -17.518  -8.083
    8    HE2  HIS 746           HE2      HIS 746  48.478 -17.029  -7.937

  No H/Q in entry =           8
  In of MODEL    4
    1    H    VAL 747           H        VAL 747  50.288 -13.228  -1.954
    2    HA   VAL 747           HA       VAL 747  52.903 -12.242  -1.838
    3    HB   VAL 747           HB       VAL 747  50.454 -11.721  -0.140
    4   HG11  VAL 747          HG11      VAL 747  52.474 -11.229   1.235
    5   HG13  VAL 747          HG12      VAL 747  51.617  -9.761   0.820
    6   HG12  VAL 747          HG13      VAL 747  53.088 -10.201  -0.051
    7   HG22  VAL 747          HG21      VAL 747  50.329 -11.025  -2.423
    8   HG21  VAL 747          HG22      VAL 747  51.878 -10.207  -2.273
    9   HG23  VAL 747          HG23      VAL 747  50.474  -9.598  -1.380

  No H/Q in entry =           9
  In of MODEL    4
    1    H    LEU 748           H        LEU 748  51.004 -13.891   0.573
    2    HA   LEU 748           HA       LEU 748  53.013 -14.116   2.468
    3    HB2  LEU 748           HB2      LEU 748  50.997 -14.396   3.451
    4    HB3  LEU 748           HB3      LEU 748  50.270 -15.018   2.004
    5    HG   LEU 748           HG       LEU 748  51.853 -16.733   3.931
    6   HD13  LEU 748          HD11      LEU 748  49.661 -17.397   4.812
    7   HD12  LEU 748          HD12      LEU 748  48.873 -16.228   3.761
    8   HD11  LEU 748          HD13      LEU 748  49.927 -15.672   5.062
    9   HD21  LEU 748          HD21      LEU 748  51.521 -17.655   1.640
   10   HD23  LEU 748          HD22      LEU 748  49.776 -17.439   1.830
   11   HD22  LEU 748          HD23      LEU 748  50.646 -18.551   2.871

  No H/Q in entry =          11
  In of MODEL    4
    1    H    HIS 749           H        HIS 749  52.238 -16.118  -0.281
    2    HA   HIS 749           HA       HIS 749  53.846 -18.347   0.481
    3    HB2  HIS 749           HB2      HIS 749  51.942 -18.088  -1.368
    4    HB3  HIS 749           HB3      HIS 749  53.330 -17.760  -2.397
    5    HD1  HIS 749           HD1      HIS 749  54.783 -19.788  -3.083
    6    HD2  HIS 749           HD2      HIS 749  51.805 -20.646  -0.324
    7    HE1  HIS 749           HE1      HIS 749  54.694 -22.279  -2.954
    8    HE2  HIS 749           HE2      HIS 749  53.013 -22.797  -1.173

  No H/Q in entry =           8
  In of MODEL    4
    1    H    CYS 750           H        CYS 750  54.365 -15.451  -1.543
    2    HA   CYS 750           HA       CYS 750  56.996 -16.333  -2.189
    3    HB2  CYS 750           HB2      CYS 750  57.283 -14.240  -3.401
    4    HB3  CYS 750           HB3      CYS 750  55.724 -14.946  -3.787

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLN 751           H        GLN 751  55.542 -14.519   0.375
    2    HA   GLN 751           HA       GLN 751  57.991 -13.530   1.382
    3    HB2  GLN 751           HB2      GLN 751  55.401 -14.038   2.858
    4    HB3  GLN 751           HB3      GLN 751  56.775 -13.161   3.521
    5    HG2  GLN 751           HG2      GLN 751  56.548 -11.582   1.571
    6    HG3  GLN 751           HG3      GLN 751  55.043 -12.397   1.207
    7   HE21  GLN 751          HE21      GLN 751  55.590  -9.696   1.911
    8   HE22  GLN 751          HE22      GLN 751  54.650  -9.295   3.295

  No H/Q in entry =           8
  In of MODEL    4
    1    H    GLY 752           H        GLY 752  56.816 -16.621   1.132
    2    HA3  GLY 752           HA2      GLY 752  58.266 -18.453   1.545
    3    HA2  GLY 752           HA3      GLY 752  58.940 -17.585   2.907

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ARG 753           H        ARG 753  55.468 -17.950   2.382
    2    HA   ARG 753           HA       ARG 753  55.420 -19.699   4.740
    3    HB2  ARG 753           HB2      ARG 753  53.188 -18.120   3.487
    4    HB3  ARG 753           HB3      ARG 753  53.071 -19.051   4.970
    5    HG2  ARG 753           HG2      ARG 753  54.831 -16.622   4.605
    6    HG3  ARG 753           HG3      ARG 753  53.234 -16.582   5.333
    7    HD2  ARG 753           HD2      ARG 753  54.820 -16.581   7.088
    8    HD3  ARG 753           HD3      ARG 753  54.078 -18.175   7.065
    9    HE   ARG 753           HE       ARG 753  56.394 -18.366   5.564
   10   HH11  ARG 753          HH11      ARG 753  55.568 -17.545   8.898
   11   HH12  ARG 753          HH12      ARG 753  57.041 -18.119   9.539
   12   HH21  ARG 753          HH21      ARG 753  58.423 -19.132   6.451
   13   HH22  ARG 753          HH22      ARG 753  58.667 -19.030   8.137

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ASN 754           H        ASN 754  54.020 -21.545   4.707
    2    HA   ASN 754           HA       ASN 754  53.850 -22.639   1.988
    3    HB2  ASN 754           HB2      ASN 754  54.104 -24.229   4.552
    4    HB3  ASN 754           HB3      ASN 754  54.144 -24.847   2.926
    5   HD21  ASN 754          HD21      ASN 754  55.975 -23.172   5.353
    6   HD22  ASN 754          HD22      ASN 754  57.495 -23.286   4.567

  No H/Q in entry =           6
  In of MODEL    4
    1    H    TYR 755           H        TYR 755  51.904 -23.020   1.237
    2    HA   TYR 755           HA       TYR 755  49.811 -23.956   2.980
    3    HB2  TYR 755           HB2      TYR 755  49.608 -21.412   1.385
    4    HB3  TYR 755           HB3      TYR 755  48.187 -22.368   1.785
    5    HD1  TYR 755           HD1      TYR 755  50.940 -20.384   3.165
    6    HD2  TYR 755           HD2      TYR 755  47.276 -22.316   3.988
    7    HE1  TYR 755           HE1      TYR 755  50.866 -19.269   5.332
    8    HE2  TYR 755           HE2      TYR 755  47.192 -21.222   6.191
    9    HH   TYR 755           HH       TYR 755  48.874 -20.412   7.757

  No H/Q in entry =           9
  In of MODEL    4
    1    H    THR 756           H        THR 756  48.318 -25.156   1.988
    2    HA   THR 756           HA       THR 756  48.848 -25.929  -0.790
    3    HB   THR 756           HB       THR 756  47.495 -27.375   1.506
    4    HG1  THR 756           HG1      THR 756  50.085 -27.043   1.007
    5   HG22  THR 756          HG21      THR 756  47.607 -29.360   0.086
    6   HG21  THR 756          HG22      THR 756  48.303 -28.374  -1.223
    7   HG23  THR 756          HG23      THR 756  46.657 -28.064  -0.649

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LEU 757           H        LEU 757  46.882 -26.018  -2.133
    2    HA   LEU 757           HA       LEU 757  44.728 -24.556  -0.873
    3    HB2  LEU 757           HB2      LEU 757  45.264 -24.987  -3.780
    4    HB3  LEU 757           HB3      LEU 757  43.780 -24.288  -3.168
    5    HG   LEU 757           HG       LEU 757  45.559 -22.745  -1.924
    6   HD13  LEU 757          HD11      LEU 757  47.317 -22.082  -3.474
    7   HD12  LEU 757          HD12      LEU 757  46.886 -23.427  -4.530
    8   HD11  LEU 757          HD13      LEU 757  47.501 -23.740  -2.906
    9   HD23  LEU 757          HD21      LEU 757  45.067 -21.087  -3.633
   10   HD22  LEU 757          HD22      LEU 757  43.656 -22.013  -3.127
   11   HD21  LEU 757          HD23      LEU 757  44.433 -22.367  -4.677

  No H/Q in entry =          11
  In of MODEL    4
    1    H    THR 758           H        THR 758  42.667 -25.063  -0.941
    2    HA   THR 758           HA       THR 758  42.048 -27.862  -1.456
    3    HB   THR 758           HB       THR 758  40.571 -27.710   0.606
    4    HG1  THR 758           HG1      THR 758  41.454 -25.154   0.503
    5   HG23  THR 758          HG21      THR 758  42.412 -28.024   2.208
    6   HG22  THR 758          HG22      THR 758  43.546 -27.315   1.064
    7   HG21  THR 758          HG23      THR 758  42.753 -28.844   0.687

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLY 759           H        GLY 759  39.322 -27.792  -1.057
    2    HA3  GLY 759           HA2      GLY 759  38.542 -26.161  -3.322
    3    HA2  GLY 759           HA3      GLY 759  37.572 -27.394  -2.525

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ARG 760           H        ARG 760  36.515 -24.947  -3.236
    2    HA   ARG 760           HA       ARG 760  36.479 -22.987  -1.193
    3    HB2  ARG 760           HB2      ARG 760  34.695 -21.954  -2.332
    4    HB3  ARG 760           HB3      ARG 760  35.549 -22.790  -3.610
    5    HG2  ARG 760           HG2      ARG 760  33.008 -23.733  -2.265
    6    HG3  ARG 760           HG3      ARG 760  33.100 -22.973  -3.848
    7    HD2  ARG 760           HD2      ARG 760  34.405 -24.887  -4.670
    8    HD3  ARG 760           HD3      ARG 760  34.332 -25.608  -3.056
    9    HE   ARG 760           HE       ARG 760  31.742 -25.078  -3.929
   10   HH11  ARG 760          HH11      ARG 760  34.408 -27.327  -4.662
   11   HH12  ARG 760          HH12      ARG 760  33.380 -28.542  -5.261
   12   HH21  ARG 760          HH21      ARG 760  30.351 -26.825  -4.750
   13   HH22  ARG 760          HH22      ARG 760  31.084 -28.243  -5.353

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ASP 761           H        ASP 761  35.239 -26.060  -1.265
    2    HA   ASP 761           HA       ASP 761  33.040 -25.655   0.537
    3    HB2  ASP 761           HB2      ASP 761  32.765 -28.121   0.219
    4    HB3  ASP 761           HB3      ASP 761  32.704 -27.191  -1.275

  No H/Q in entry =           4
  In of MODEL    4
    1    H    SER 762           H        SER 762  36.370 -25.998   0.823
    2    HA   SER 762           HA       SER 762  36.306 -27.753   3.111
    3    HB2  SER 762           HB2      SER 762  38.615 -26.165   1.996
    4    HB3  SER 762           HB3      SER 762  38.709 -27.472   3.167
    5    HG   SER 762           HG       SER 762  37.512 -28.678   1.361

  No H/Q in entry =           5
  In of MODEL    4
    1    H    CYS 763           H        CYS 763  35.953 -24.366   2.586
    2    HA   CYS 763           HA       CYS 763  36.250 -23.972   5.461
    3    HB2  CYS 763           HB2      CYS 763  37.499 -21.962   5.243
    4    HB3  CYS 763           HB3      CYS 763  38.328 -23.142   4.240

  No H/Q in entry =           4
  In of MODEL    4
    1    H    THR 764           H        THR 764  35.361 -21.753   6.041
    2    HA   THR 764           HA       THR 764  32.853 -21.341   4.629
    3    HB   THR 764           HB       THR 764  33.892 -20.093   7.198
    4    HG1  THR 764           HG1      THR 764  33.383 -22.491   6.967
    5   HG22  THR 764          HG21      THR 764  31.097 -20.205   6.053
    6   HG21  THR 764          HG22      THR 764  32.132 -18.776   6.061
    7   HG23  THR 764          HG23      THR 764  31.558 -19.462   7.588

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LEU 765           H        LEU 765  33.202 -20.216   2.841
    2    HA   LEU 765           HA       LEU 765  35.269 -18.197   2.799
    3    HB2  LEU 765           HB2      LEU 765  34.836 -20.165   1.152
    4    HB3  LEU 765           HB3      LEU 765  33.626 -19.068   0.511
    5    HG   LEU 765           HG       LEU 765  35.378 -17.406   0.076
    6   HD13  LEU 765          HD11      LEU 765  36.973 -18.024   1.768
    7   HD12  LEU 765          HD12      LEU 765  37.755 -18.259   0.191
    8   HD11  LEU 765          HD13      LEU 765  37.107 -19.633   1.091
    9   HD22  LEU 765          HD21      LEU 765  36.374 -18.578  -1.798
   10   HD21  LEU 765          HD22      LEU 765  34.661 -18.975  -1.649
   11   HD23  LEU 765          HD23      LEU 765  35.887 -20.129  -1.113

  No H/Q in entry =          11
  In of MODEL    4
    1    HA   PRO 766           HA       PRO 766  32.107 -15.011   2.943
    2    HB2  PRO 766           HB2      PRO 766  33.723 -12.873   2.585
    3    HB3  PRO 766           HB3      PRO 766  33.656 -13.766   4.106
    4    HG2  PRO 766           HG2      PRO 766  35.675 -13.927   1.900
    5    HG3  PRO 766           HG3      PRO 766  35.934 -13.977   3.659
    6    HD2  PRO 766           HD2      PRO 766  35.906 -16.161   2.006
    7    HD3  PRO 766           HD3      PRO 766  35.526 -16.248   3.731

  No H/Q in entry =           7
  In of MODEL    4
    1    H    ALA 767           H        ALA 767  34.531 -14.833   0.344
    2    HA   ALA 767           HA       ALA 767  32.468 -13.772  -1.535
    3    HB3  ALA 767           HB1      ALA 767  34.256 -12.741  -2.750
    4    HB1  ALA 767           HB2      ALA 767  35.462 -13.472  -1.685
    5    HB2  ALA 767           HB3      ALA 767  34.373 -12.229  -1.070

  No H/Q in entry =           5
  In of MODEL    4
    1    H    SER 768           H        SER 768  33.665 -14.111  -3.797
    2    HA   SER 768           HA       SER 768  33.829 -15.560  -5.455
    3    HB2  SER 768           HB2      SER 768  34.516 -17.491  -3.250
    4    HB3  SER 768           HB3      SER 768  34.682 -17.782  -4.979
    5    HG   SER 768           HG       SER 768  36.614 -16.968  -3.717

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA 769           H        ALA 769  31.399 -15.106  -3.864
    2    HA   ALA 769           HA       ALA 769  29.721 -17.198  -4.998
    3    HB3  ALA 769           HB1      ALA 769  29.922 -17.773  -2.626
    4    HB2  ALA 769           HB2      ALA 769  28.321 -17.092  -2.921
    5    HB1  ALA 769           HB3      ALA 769  29.574 -16.109  -2.172

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLU 770           H        GLU 770  27.306 -16.120  -4.386
    2    HA   GLU 770           HA       GLU 770  27.362 -13.658  -5.830
    3    HB2  GLU 770           HB2      GLU 770  24.924 -13.753  -5.703
    4    HB3  GLU 770           HB3      GLU 770  25.570 -15.291  -6.222
    5    HG2  GLU 770           HG2      GLU 770  23.885 -15.933  -4.752
    6    HG3  GLU 770           HG3      GLU 770  25.324 -15.944  -3.730

  No H/Q in entry =           6
  In of MODEL    4
    1    H    LYS 771           H        LYS 771  26.466 -11.653  -5.029
    2    HA   LYS 771           HA       LYS 771  26.866 -11.396  -2.153
    3    HB2  LYS 771           HB2      LYS 771  28.047  -9.586  -4.270
    4    HB3  LYS 771           HB3      LYS 771  28.068  -9.268  -2.549
    5    HG2  LYS 771           HG2      LYS 771  29.283 -11.769  -3.674
    6    HG3  LYS 771           HG3      LYS 771  30.170 -10.255  -3.650
    7    HD2  LYS 771           HD2      LYS 771  30.768 -11.651  -1.742
    8    HD3  LYS 771           HD3      LYS 771  29.964 -10.178  -1.195
    9    HE2  LYS 771           HE2      LYS 771  27.994 -11.416  -0.671
   10    HE3  LYS 771           HE3      LYS 771  28.603 -12.875  -1.461
   11    HZ3  LYS 771           HZ1      LYS 771  30.284 -13.016   0.320
   12    HZ2  LYS 771           HZ2      LYS 771  28.756 -12.910   0.995
   13    HZ1  LYS 771           HZ3      LYS 771  29.745 -11.568   0.961

  No H/Q in entry =          13
  In of MODEL    4
    1    H    ALA 772           H        ALA 772  25.878  -9.416  -1.265
    2    HA   ALA 772           HA       ALA 772  23.504  -8.630  -2.769
    3    HB3  ALA 772           HB1      ALA 772  23.086  -9.607  -0.546
    4    HB1  ALA 772           HB2      ALA 772  22.614  -7.908  -0.591
    5    HB2  ALA 772           HB3      ALA 772  24.123  -8.382   0.179

  No H/Q in entry =           5
  In of MODEL    4
    1    H    CYS 773           H        CYS 773  22.854  -6.316  -2.413
    2    HA   CYS 773           HA       CYS 773  24.978  -4.663  -3.244
    3    HB2  CYS 773           HB2      CYS 773  22.632  -4.236  -3.909
    4    HB3  CYS 773           HB3      CYS 773  22.236  -3.849  -2.239

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLY 774           H        GLY 774  26.401  -3.582  -2.138
    2    HA3  GLY 774           HA2      GLY 774  26.792  -2.089  -0.200
    3    HA2  GLY 774           HA3      GLY 774  26.035  -3.346   0.776

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ALA 775           H        ALA 775  27.281  -5.441  -0.950
    2    HA   ALA 775           HA       ALA 775  30.079  -5.125  -0.161
    3    HB3  ALA 775           HB1      ALA 775  28.992  -6.724   1.368
    4    HB1  ALA 775           HB2      ALA 775  30.122  -7.557   0.302
    5    HB2  ALA 775           HB3      ALA 775  28.388  -7.638  -0.014

  No H/Q in entry =           5
  In of MODEL    4
    1    H    CYS 776           H        CYS 776  30.906  -4.691  -2.098
    2    HA   CYS 776           HA       CYS 776  30.414  -6.606  -4.210
    3    HB2  CYS 776           HB2      CYS 776  30.200  -3.601  -4.489
    4    HB3  CYS 776           HB3      CYS 776  30.259  -4.730  -5.838

  No H/Q in entry =           4
  In of MODEL    4
    1    HA   PRO 777           HA       PRO 777  34.831  -6.024  -4.207
    2    HB2  PRO 777           HB2      PRO 777  35.457  -8.337  -5.399
    3    HB3  PRO 777           HB3      PRO 777  34.840  -8.303  -3.744
    4    HG2  PRO 777           HG2      PRO 777  33.449  -9.027  -6.274
    5    HG3  PRO 777           HG3      PRO 777  33.263  -9.714  -4.655
    6    HD2  PRO 777           HD2      PRO 777  31.593  -7.802  -5.838
    7    HD3  PRO 777           HD3      PRO 777  31.652  -8.229  -4.114

  No H/Q in entry =           7
  In of MODEL    4
    1    H    LEU 778           H        LEU 778  36.451  -6.701  -6.096
    2    HA   LEU 778           HA       LEU 778  36.552  -4.952  -8.120
    3    HB2  LEU 778           HB2      LEU 778  38.056  -6.576  -9.302
    4    HB3  LEU 778           HB3      LEU 778  38.421  -6.198  -7.625
    5    HG   LEU 778           HG       LEU 778  36.819  -8.649  -8.143
    6   HD13  LEU 778          HD11      LEU 778  38.751  -9.964  -8.502
    7   HD12  LEU 778          HD12      LEU 778  39.812  -8.543  -8.546
    8   HD11  LEU 778          HD13      LEU 778  38.605  -8.811  -9.827
    9   HD21  LEU 778          HD21      LEU 778  37.391  -7.992  -5.833
   10   HD23  LEU 778          HD22      LEU 778  39.093  -8.038  -6.272
   11   HD22  LEU 778          HD23      LEU 778  38.142  -9.516  -6.298

  No H/Q in entry =          11
  In of MODEL    4
    1    H    TRP 779           H        TRP 779  34.817  -8.033  -8.348
    2    HA   TRP 779           HA       TRP 779  34.143  -7.402 -11.119
    3    HB2  TRP 779           HB2      TRP 779  33.241  -9.728 -11.244
    4    HB3  TRP 779           HB3      TRP 779  34.949  -9.676 -10.840
    5    HD1  TRP 779           HD1      TRP 779  31.508 -10.461  -9.195
    6    HE1  TRP 779           HE1      TRP 779  31.917 -11.870  -7.128
    7    HE3  TRP 779           HE3      TRP 779  36.595 -10.372  -9.166
    8    HZ2  TRP 779           HZ2      TRP 779  34.166 -12.853  -5.642
    9    HZ3  TRP 779           HZ3      TRP 779  37.779 -11.572  -7.393
   10    HH2  TRP 779           HH2      TRP 779  36.577 -12.790  -5.676

  No H/Q in entry =          10
  In of MODEL    4
    1    H    GLY 780           H        GLY 780  32.906  -6.386  -8.353
    2    HA3  GLY 780           HA2      GLY 780  30.163  -6.817  -9.323
    3    HA2  GLY 780           HA3      GLY 780  30.545  -7.100  -7.637

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LYS 781           H        LYS 781  28.652  -5.300  -8.818
    2    HA   LYS 781           HA       LYS 781  29.233  -3.006  -7.194
    3    HB2  LYS 781           HB2      LYS 781  30.285  -2.583  -9.540
    4    HB3  LYS 781           HB3      LYS 781  28.633  -2.544 -10.128
    5    HG2  LYS 781           HG2      LYS 781  29.376  -0.295  -9.780
    6    HG3  LYS 781           HG3      LYS 781  28.174  -0.677  -8.545
    7    HD2  LYS 781           HD2      LYS 781  29.964  -1.132  -6.937
    8    HD3  LYS 781           HD3      LYS 781  31.170  -0.786  -8.173
    9    HE2  LYS 781           HE2      LYS 781  30.306   1.511  -8.319
   10    HE3  LYS 781           HE3      LYS 781  29.147   1.139  -7.046
   11    HZ2  LYS 781           HZ1      LYS 781  32.091   1.047  -6.795
   12    HZ1  LYS 781           HZ2      LYS 781  31.024   0.666  -5.557
   13    HZ3  LYS 781           HZ3      LYS 781  31.104   2.246  -6.151

  No H/Q in entry =          13
  In of MODEL    4
    1    H    CYS 782           H        CYS 782  27.108  -2.105  -6.578
    2    HA   CYS 782           HA       CYS 782  25.022  -3.519  -7.959
    3    HB2  CYS 782           HB2      CYS 782  23.552  -3.012  -5.975
    4    HB3  CYS 782           HB3      CYS 782  24.843  -4.165  -5.688

  No H/Q in entry =           4
  In of MODEL    4
    1    H    ASP 783           H        ASP 783  25.005  -2.219  -9.685
    2    HA   ASP 783           HA       ASP 783  23.739   0.403  -9.266
    3    HB2  ASP 783           HB2      ASP 783  24.344   0.906 -11.581
    4    HB3  ASP 783           HB3      ASP 783  25.775   0.374 -10.710

  No H/Q in entry =           4
  In of MODEL    4
    1    H    ALA 784           H        ALA 784  23.039  -2.668  -9.649
    2    HA   ALA 784           HA       ALA 784  20.977  -2.531 -11.647
    3    HB1  ALA 784           HB1      ALA 784  22.324  -4.550 -11.429
    4    HB3  ALA 784           HB2      ALA 784  20.631  -4.900 -11.075
    5    HB2  ALA 784           HB3      ALA 784  21.792  -4.740  -9.760

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLU 785           H        GLU 785  18.784  -2.802 -11.177
    2    HA   GLU 785           HA       GLU 785  18.033  -1.772  -8.599
    3    HB2  GLU 785           HB2      GLU 785  15.721  -1.668  -9.626
    4    HB3  GLU 785           HB3      GLU 785  16.942  -0.654 -10.373
    5    HG2  GLU 785           HG2      GLU 785  17.213  -2.366 -12.142
    6    HG3  GLU 785           HG3      GLU 785  15.897  -3.280 -11.407

  No H/Q in entry =           6
  In of MODEL    4
    1    H    SER 786           H        SER 786  18.645  -3.515  -7.393
    2    HA   SER 786           HA       SER 786  16.606  -5.389  -6.823
    3    HB2  SER 786           HB2      SER 786  17.598  -6.537  -8.772
    4    HB3  SER 786           HB3      SER 786  19.203  -6.395  -8.064
    5    HG   SER 786           HG       SER 786  17.629  -8.396  -7.831

  No H/Q in entry =           5
  In of MODEL    4
    1    H    SER 787           H        SER 787  17.527  -6.867  -5.043
    2    HA   SER 787           HA       SER 787  18.993  -5.220  -3.182
    3    HB2  SER 787           HB2      SER 787  17.029  -6.539  -2.436
    4    HB3  SER 787           HB3      SER 787  17.868  -8.025  -2.865
    5    HG   SER 787           HG       SER 787  19.123  -7.854  -1.162

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LYS 788           H        LYS 788  19.728  -7.532  -5.512
    2    HA   LYS 788           HA       LYS 788  22.025  -8.660  -4.183
    3    HB2  LYS 788           HB2      LYS 788  22.455  -9.822  -6.261
    4    HB3  LYS 788           HB3      LYS 788  20.784 -10.038  -5.762
    5    HG2  LYS 788           HG2      LYS 788  20.052  -8.417  -7.408
    6    HG3  LYS 788           HG3      LYS 788  21.723  -8.079  -7.857
    7    HD2  LYS 788           HD2      LYS 788  20.458 -10.785  -8.058
    8    HD3  LYS 788           HD3      LYS 788  20.452  -9.631  -9.397
    9    HE2  LYS 788           HE2      LYS 788  22.917  -9.646  -9.383
   10    HE3  LYS 788           HE3      LYS 788  22.917 -10.791  -8.052
   11    HZ2  LYS 788           HZ1      LYS 788  21.841 -11.261 -10.774
   12    HZ1  LYS 788           HZ2      LYS 788  21.744 -12.365  -9.513
   13    HZ3  LYS 788           HZ3      LYS 788  23.252 -11.940 -10.144

  No H/Q in entry =          13
  In of MODEL    4
    1    H    CYS 789           H        CYS 789  24.145  -8.587  -5.247
    2    HA   CYS 789           HA       CYS 789  24.736  -5.976  -6.406
    3    HB2  CYS 789           HB2      CYS 789  26.070  -6.655  -4.418
    4    HB3  CYS 789           HB3      CYS 789  26.505  -8.152  -5.224

  No H/Q in entry =           4
  In of MODEL    4
    1    H    VAL 790           H        VAL 790  25.653  -5.976  -8.538
    2    HA   VAL 790           HA       VAL 790  25.209  -8.552  -9.802
    3    HB   VAL 790           HB       VAL 790  23.744  -6.737 -10.660
    4   HG13  VAL 790          HG11      VAL 790  25.153  -4.805 -10.381
    5   HG12  VAL 790          HG12      VAL 790  24.638  -4.938 -12.063
    6   HG11  VAL 790          HG13      VAL 790  26.272  -5.409 -11.601
    7   HG22  VAL 790          HG21      VAL 790  24.267  -8.572 -12.142
    8   HG21  VAL 790          HG22      VAL 790  25.731  -7.757 -12.683
    9   HG23  VAL 790          HG23      VAL 790  24.151  -7.075 -13.069

  No H/Q in entry =           9
  In of MODEL    4
    1    H    CYS 791           H        CYS 791  26.710  -9.436 -11.018
    2    HA   CYS 791           HA       CYS 791  29.309  -8.298 -10.563
    3    HB2  CYS 791           HB2      CYS 791  28.489 -11.128 -11.168
    4    HB3  CYS 791           HB3      CYS 791  30.156 -10.588 -10.945

  No H/Q in entry =           4
  In of MODEL    4
    1    H    ARG 792           H        ARG 792  30.318  -7.448 -11.969
    2    HA   ARG 792           HA       ARG 792  29.323  -7.153 -14.621
    3    HB2  ARG 792           HB2      ARG 792  31.723  -5.990 -13.196
    4    HB3  ARG 792           HB3      ARG 792  31.231  -5.544 -14.824
    5    HG2  ARG 792           HG2      ARG 792  29.156  -4.642 -14.016
    6    HG3  ARG 792           HG3      ARG 792  29.471  -5.253 -12.399
    7    HD2  ARG 792           HD2      ARG 792  29.884  -2.827 -12.605
    8    HD3  ARG 792           HD3      ARG 792  31.316  -3.724 -12.123
    9    HE   ARG 792           HE       ARG 792  31.957  -3.571 -14.560
   10   HH11  ARG 792          HH11      ARG 792  29.908  -1.067 -13.097
   11   HH12  ARG 792          HH12      ARG 792  30.508   0.176 -14.062
   12   HH21  ARG 792          HH21      ARG 792  32.806  -1.861 -15.834
   13   HH22  ARG 792          HH22      ARG 792  32.229  -0.262 -15.641

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLU 793           H        GLU 793  30.296  -7.830 -16.449
    2    HA   GLU 793           HA       GLU 793  31.722 -10.256 -16.312
    3    HB2  GLU 793           HB2      GLU 793  31.127  -8.438 -18.631
    4    HB3  GLU 793           HB3      GLU 793  31.857 -10.031 -18.788
    5    HG2  GLU 793           HG2      GLU 793  29.893 -11.053 -17.792
    6    HG3  GLU 793           HG3      GLU 793  29.163  -9.463 -17.579

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ALA 794           H        ALA 794  33.735 -10.571 -17.734
    2    HA   ALA 794           HA       ALA 794  35.821  -9.446 -16.268
    3    HB3  ALA 794           HB1      ALA 794  37.267 -10.694 -17.743
    4    HB1  ALA 794           HB2      ALA 794  35.927 -10.939 -18.860
    5    HB2  ALA 794           HB3      ALA 794  35.875 -11.665 -17.258

  No H/Q in entry =           5
  In of MODEL    4
    1    H    SER 795           H        SER 795  34.566  -8.811 -19.484
    2    HA   SER 795           HA       SER 795  36.668  -7.046 -20.093
    3    HB2  SER 795           HB2      SER 795  34.038  -7.473 -21.513
    4    HB3  SER 795           HB3      SER 795  35.413  -6.582 -22.169
    5    HG   SER 795           HG       SER 795  34.969  -9.270 -21.969

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLU 796           H        GLU 796  34.111  -6.700 -18.048
    2    HA   GLU 796           HA       GLU 796  34.063  -3.784 -18.330
    3    HB2  GLU 796           HB2      GLU 796  31.822  -5.669 -17.658
    4    HB3  GLU 796           HB3      GLU 796  31.776  -3.973 -17.206
    5    HG2  GLU 796           HG2      GLU 796  32.015  -5.052 -19.993
    6    HG3  GLU 796           HG3      GLU 796  30.553  -4.373 -19.264

  No H/Q in entry =           6
  In of MODEL    4
    1    H    CYS 797           H        CYS 797  35.589  -5.902 -16.618
    2    HA   CYS 797           HA       CYS 797  34.610  -5.194 -14.025
    3    HB2  CYS 797           HB2      CYS 797  36.347  -6.585 -13.118
    4    HB3  CYS 797           HB3      CYS 797  35.643  -7.441 -14.477

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLU 798           H        GLU 798  35.437  -3.673 -12.687
    2    HA   GLU 798           HA       GLU 798  36.860  -1.580 -14.016
    3    HB2  GLU 798           HB2      GLU 798  35.009  -1.393 -12.215
    4    HB3  GLU 798           HB3      GLU 798  36.300  -1.710 -11.064
    5    HG2  GLU 798           HG2      GLU 798  35.928   0.662 -11.243
    6    HG3  GLU 798           HG3      GLU 798  37.506   0.250 -11.910

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU 799           H        GLU 799  37.485  -3.815 -11.376
    2    HA   GLU 799           HA       GLU 799  40.329  -3.188 -11.520
    3    HB2  GLU 799           HB2      GLU 799  39.342  -2.993  -9.288
    4    HB3  GLU 799           HB3      GLU 799  38.703  -4.621  -9.402
    5    HG2  GLU 799           HG2      GLU 799  40.683  -4.508  -7.983
    6    HG3  GLU 799           HG3      GLU 799  40.946  -5.528  -9.396

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLU 800           H        GLU 800  41.710  -4.738 -12.096
    2    HA   GLU 800           HA       GLU 800  40.597  -6.878 -13.711
    3    HB2  GLU 800           HB2      GLU 800  42.918  -7.069 -14.549
    4    HB3  GLU 800           HB3      GLU 800  42.256  -5.445 -14.702
    5    HG2  GLU 800           HG2      GLU 800  43.470  -4.892 -12.551
    6    HG3  GLU 800           HG3      GLU 800  44.278  -6.443 -12.710

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLY 801           H        GLY 801  42.572  -6.490 -10.859
    2    HA3  GLY 801           HA2      GLY 801  43.312  -7.835  -9.300
    3    HA2  GLY 801           HA3      GLY 801  42.152  -9.023  -9.865

  No H/Q in entry =           3
  In of MODEL    4
    1    H    PHE 802           H        PHE 802  43.801 -10.388  -9.192
    2    HA   PHE 802           HA       PHE 802  46.316 -10.747 -10.443
    3    HB2  PHE 802           HB2      PHE 802  44.607 -12.452  -8.664
    4    HB3  PHE 802           HB3      PHE 802  46.068 -13.113  -9.376
    5    HD1  PHE 802           HD1      PHE 802  45.308  -9.758  -7.911
    6    HD2  PHE 802           HD2      PHE 802  47.645 -13.307  -7.720
    7    HE1  PHE 802           HE1      PHE 802  46.640  -8.774  -6.126
    8    HE2  PHE 802           HE2      PHE 802  48.984 -12.333  -5.927
    9    HZ   PHE 802           HZ       PHE 802  48.496 -10.058  -5.116

  No H/Q in entry =           9
  In of MODEL    4
    1    H    SER 803           H        SER 803  46.599 -13.318 -11.087
    2    HA   SER 803           HA       SER 803  44.831 -13.832 -13.312
    3    HB2  SER 803           HB2      SER 803  46.965 -14.514 -14.524
    4    HB3  SER 803           HB3      SER 803  46.762 -12.782 -14.261
    5    HG   SER 803           HG       SER 803  48.208 -14.535 -12.591

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ILE 804           H        ILE 804  44.165 -15.960 -13.208
    2    HA   ILE 804           HA       ILE 804  45.705 -17.815 -11.544
    3    HB   ILE 804           HB       ILE 804  43.745 -18.698 -10.408
    4   HG12  ILE 804          HG12      ILE 804  42.035 -18.154 -12.188
    5   HG13  ILE 804          HG13      ILE 804  41.513 -17.786 -10.551
    6   HG23  ILE 804          HG21      ILE 804  43.201 -16.818  -8.929
    7   HG22  ILE 804          HG22      ILE 804  43.922 -15.723 -10.113
    8   HG21  ILE 804          HG23      ILE 804  44.929 -16.920  -9.298
    9   HD13  ILE 804          HD11      ILE 804  40.820 -16.052 -12.083
   10   HD12  ILE 804          HD12      ILE 804  42.471 -15.820 -12.624
   11   HD11  ILE 804          HD13      ILE 804  42.022 -15.411 -10.966

  No H/Q in entry =          11
  In of MODEL    4
    1    H    CYS 805           H        CYS 805  44.833 -20.092 -11.742
    2    HA   CYS 805           HA       CYS 805  44.316 -20.665 -14.585
    3    HB2  CYS 805           HB2      CYS 805  46.538 -21.313 -13.599
    4    HB3  CYS 805           HB3      CYS 805  45.676 -22.306 -12.435

  No H/Q in entry =           4
  In of MODEL    4
    1    H    VAL 806           H        VAL 806  42.292 -21.400 -14.899
    2    HA   VAL 806           HA       VAL 806  41.111 -22.942 -12.741
    3    HB   VAL 806           HB       VAL 806  40.207 -20.707 -12.508
    4   HG12  VAL 806          HG11      VAL 806  39.047 -19.572 -14.306
    5   HG11  VAL 806          HG12      VAL 806  39.589 -20.858 -15.401
    6   HG13  VAL 806          HG13      VAL 806  40.771 -19.820 -14.610
    7   HG21  VAL 806          HG21      VAL 806  38.578 -22.561 -12.272
    8   HG23  VAL 806          HG22      VAL 806  38.155 -22.358 -13.970
    9   HG22  VAL 806          HG23      VAL 806  37.869 -21.044 -12.816

  No H/Q in entry =           9
  In of MODEL    4
    1    H    GLU 807           H        GLU 807  39.972 -24.698 -13.358
    2    HA   GLU 807           HA       GLU 807  40.159 -25.440 -16.125
    3    HB2  GLU 807           HB2      GLU 807  40.674 -27.041 -14.256
    4    HB3  GLU 807           HB3      GLU 807  38.980 -26.972 -13.801
    5    HG2  GLU 807           HG2      GLU 807  38.345 -27.862 -15.965
    6    HG3  GLU 807           HG3      GLU 807  40.052 -27.877 -16.435

  No H/Q in entry =           6
  In of MODEL    4
    1    H    VAL 808           H        VAL 808  38.731 -25.047 -17.480
    2    HA   VAL 808           HA       VAL 808  35.941 -24.776 -16.719
    3    HB   VAL 808           HB       VAL 808  36.977 -22.520 -16.795
    4   HG11  VAL 808          HG11      VAL 808  38.718 -22.833 -18.400
    5   HG13  VAL 808          HG12      VAL 808  37.669 -21.511 -18.913
    6   HG12  VAL 808          HG13      VAL 808  37.535 -23.092 -19.684
    7   HG21  VAL 808          HG21      VAL 808  34.623 -22.713 -17.284
    8   HG23  VAL 808          HG22      VAL 808  34.994 -23.028 -18.986
    9   HG22  VAL 808          HG23      VAL 808  35.365 -21.452 -18.277

  No H/Q in entry =           9
  In of MODEL    4
    1    H    ASN 809           H        ASN 809  34.642 -25.715 -18.204
    2    HA   ASN 809           HA       ASN 809  33.901 -26.747 -20.087
    3    HB2  ASN 809           HB2      ASN 809  36.237 -25.297 -21.155
    4    HB3  ASN 809           HB3      ASN 809  35.395 -26.420 -22.253
    5   HD21  ASN 809          HD21      ASN 809  35.636 -23.326 -20.920
    6   HD22  ASN 809          HD22      ASN 809  34.157 -22.664 -21.511

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLY 810           H        GLY 810  36.648 -27.523 -18.510
    2    HA3  GLY 810           HA2      GLY 810  37.061 -29.940 -18.284
    3    HA2  GLY 810           HA3      GLY 810  37.010 -29.980 -20.055

  No H/Q in entry =           3
  In of MODEL    4
    1    H    LYS 811           H        LYS 811  38.410 -27.276 -19.899
    2    HA   LYS 811           HA       LYS 811  41.110 -28.424 -19.662
    3    HB2  LYS 811           HB2      LYS 811  41.772 -26.834 -21.409
    4    HB3  LYS 811           HB3      LYS 811  40.515 -27.930 -21.966
    5    HG2  LYS 811           HG2      LYS 811  38.849 -26.110 -21.482
    6    HG3  LYS 811           HG3      LYS 811  40.216 -25.036 -21.186
    7    HD2  LYS 811           HD2      LYS 811  39.685 -26.541 -23.728
    8    HD3  LYS 811           HD3      LYS 811  39.311 -24.834 -23.482
    9    HE2  LYS 811           HE2      LYS 811  41.709 -24.388 -23.131
   10    HE3  LYS 811           HE3      LYS 811  42.055 -26.094 -23.372
   11    HZ3  LYS 811           HZ1      LYS 811  42.469 -24.860 -25.396
   12    HZ2  LYS 811           HZ2      LYS 811  40.907 -24.257 -25.404
   13    HZ1  LYS 811           HZ3      LYS 811  41.167 -25.910 -25.623

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLU 812           H        GLU 812  42.777 -26.974 -18.910
    2    HA   GLU 812           HA       GLU 812  41.737 -25.044 -17.006
    3    HB2  GLU 812           HB2      GLU 812  44.516 -26.080 -17.482
    4    HB3  GLU 812           HB3      GLU 812  44.094 -24.897 -16.251
    5    HG2  GLU 812           HG2      GLU 812  42.679 -26.517 -15.147
    6    HG3  GLU 812           HG3      GLU 812  43.026 -27.706 -16.403

  No H/Q in entry =           6
  In of MODEL    4
    1    H    GLN 813           H        GLN 813  41.567 -23.038 -17.413
    2    HA   GLN 813           HA       GLN 813  43.311 -21.894 -19.446
    3    HB2  GLN 813           HB2      GLN 813  41.066 -22.159 -20.276
    4    HB3  GLN 813           HB3      GLN 813  40.401 -21.303 -18.886
    5    HG2  GLN 813           HG2      GLN 813  41.462 -19.326 -19.555
    6    HG3  GLN 813           HG3      GLN 813  42.268 -20.101 -20.923
    7   HE21  GLN 813          HE21      GLN 813  39.388 -18.664 -19.788
    8   HE22  GLN 813          HE22      GLN 813  38.434 -18.868 -21.210

  No H/Q in entry =           8
  In of MODEL    4
    1    H    THR 814           H        THR 814  44.066 -19.844 -19.000
    2    HA   THR 814           HA       THR 814  44.046 -19.150 -16.189
    3    HB   THR 814           HB       THR 814  45.640 -18.104 -18.517
    4    HG1  THR 814           HG1      THR 814  45.607 -20.394 -17.474
    5   HG23  THR 814          HG21      THR 814  45.597 -16.554 -16.593
    6   HG22  THR 814          HG22      THR 814  47.193 -17.286 -16.764
    7   HG21  THR 814          HG23      THR 814  46.080 -17.867 -15.522

  No H/Q in entry =           7
  In of MODEL    4
    1    H    MET 815           H        MET 815  43.023 -17.415 -15.462
    2    HA   MET 815           HA       MET 815  41.870 -15.565 -17.436
    3    HB2  MET 815           HB2      MET 815  40.434 -16.434 -14.932
    4    HB3  MET 815           HB3      MET 815  39.806 -15.486 -16.268
    5    HG2  MET 815           HG2      MET 815  40.213 -17.612 -17.686
    6    HG3  MET 815           HG3      MET 815  40.412 -18.349 -16.098
    7    HE3  MET 815           HE1      MET 815  38.247 -19.145 -18.382
    8    HE2  MET 815           HE2      MET 815  37.047 -19.733 -17.211
    9    HE1  MET 815           HE3      MET 815  38.778 -19.999 -16.948

  No H/Q in entry =           9
  In of MODEL    4
    1    H    SER 816           H        SER 816  41.258 -13.563 -16.416
    2    HA   SER 816           HA       SER 816  43.136 -12.778 -14.393
    3    HB2  SER 816           HB2      SER 816  40.878 -11.239 -15.722
    4    HB3  SER 816           HB3      SER 816  42.137 -10.543 -14.698
    5    HG   SER 816           HG       SER 816  42.336 -11.652 -17.276

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLU 817           H        GLU 817  42.441 -11.942 -12.448
    2    HA   GLU 817           HA       GLU 817  40.874 -13.590 -10.947
    3    HB2  GLU 817           HB2      GLU 817  42.695 -11.973 -10.301
    4    HB3  GLU 817           HB3      GLU 817  41.473 -10.740 -10.527
    5    HG2  GLU 817           HG2      GLU 817  40.317 -11.314  -8.662
    6    HG3  GLU 817           HG3      GLU 817  41.072 -12.922  -8.593

  No H/Q in entry =           6
  In of MODEL    4
    1    H    CYS 818           H        CYS 818  40.012 -10.404 -12.329
    2    HA   CYS 818           HA       CYS 818  37.447 -10.403 -11.202
    3    HB2  CYS 818           HB2      CYS 818  36.931  -8.542 -12.571
    4    HB3  CYS 818           HB3      CYS 818  38.632  -8.396 -12.152

  No H/Q in entry =           4
  In of MODEL    4
    1    H    GLU 819           H        GLU 819  38.669 -11.990 -14.055
    2    HA   GLU 819           HA       GLU 819  36.119 -12.389 -15.307
    3    HB2  GLU 819           HB2      GLU 819  38.192 -12.364 -16.653
    4    HB3  GLU 819           HB3      GLU 819  38.765 -13.781 -15.780
    5    HG2  GLU 819           HG2      GLU 819  37.131 -15.156 -16.811
    6    HG3  GLU 819           HG3      GLU 819  36.283 -13.755 -17.472

  No H/Q in entry =           6
  In of MODEL    4
    1    H    ALA 820           H        ALA 820  38.414 -14.541 -13.704
    2    HA   ALA 820           HA       ALA 820  36.840 -16.796 -13.643
    3    HB2  ALA 820           HB1      ALA 820  38.238 -17.573 -11.792
    4    HB3  ALA 820           HB2      ALA 820  38.844 -15.932 -11.585
    5    HB1  ALA 820           HB3      ALA 820  39.179 -16.820 -13.083

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLY 821           H        GLY 821  37.048 -14.060 -11.385
    2    HA3  GLY 821           HA2      GLY 821  35.373 -15.053  -9.331
    3    HA2  GLY 821           HA3      GLY 821  35.808 -13.373  -9.596

  No H/Q in entry =           3
  In of MODEL    4
    1    H    ALA 822           H        ALA 822  34.736 -12.911 -12.119
    2    HA   ALA 822           HA       ALA 822  32.040 -12.415 -11.550
    3    HB2  ALA 822           HB1      ALA 822  33.316 -11.120 -13.209
    4    HB3  ALA 822           HB2      ALA 822  31.843 -11.783 -13.915
    5    HB1  ALA 822           HB3      ALA 822  33.400 -12.539 -14.249

  No H/Q in entry =           5
  In of MODEL    4
    1    H    LEU 823           H        LEU 823  33.660 -14.972 -13.274
    2    HA   LEU 823           HA       LEU 823  31.389 -16.262 -14.276
    3    HB2  LEU 823           HB2      LEU 823  34.083 -17.399 -13.574
    4    HB3  LEU 823           HB3      LEU 823  32.861 -18.256 -14.492
    5    HG   LEU 823           HG       LEU 823  34.225 -15.700 -15.329
    6   HD11  LEU 823          HD11      LEU 823  35.689 -17.610 -15.433
    7   HD13  LEU 823          HD12      LEU 823  35.279 -16.996 -17.020
    8   HD12  LEU 823          HD13      LEU 823  34.505 -18.479 -16.424
    9   HD21  LEU 823          HD21      LEU 823  32.158 -17.379 -16.732
   10   HD23  LEU 823          HD22      LEU 823  33.128 -16.114 -17.491
   11   HD22  LEU 823          HD23      LEU 823  32.003 -15.699 -16.200

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ARG 824           H        ARG 824  33.131 -16.727 -11.219
    2    HA   ARG 824           HA       ARG 824  31.489 -18.819 -10.236
    3    HB2  ARG 824           HB2      ARG 824  32.970 -16.698  -8.637
    4    HB3  ARG 824           HB3      ARG 824  32.202 -18.110  -7.943
    5    HG2  ARG 824           HG2      ARG 824  33.833 -19.522  -9.173
    6    HG3  ARG 824           HG3      ARG 824  34.639 -18.037  -9.729
    7    HD2  ARG 824           HD2      ARG 824  34.879 -17.395  -7.368
    8    HD3  ARG 824           HD3      ARG 824  34.179 -18.955  -6.912
    9    HE   ARG 824           HE       ARG 824  36.565 -18.909  -8.543
   10   HH11  ARG 824          HH11      ARG 824  35.068 -19.778  -5.453
   11   HH12  ARG 824          HH12      ARG 824  36.487 -20.296  -4.687
   12   HH21  ARG 824          HH21      ARG 824  38.623 -19.647  -7.425
   13   HH22  ARG 824          HH22      ARG 824  38.535 -20.233  -5.834

  No H/Q in entry =          13
  In of MODEL    4
    1    H    CYS 825           H        CYS 825  31.166 -15.335 -10.135
    2    HA   CYS 825           HA       CYS 825  28.970 -15.317  -8.345
    3    HB2  CYS 825           HB2      CYS 825  30.451 -13.361  -8.676
    4    HB3  CYS 825           HB3      CYS 825  29.795 -13.182 -10.296

  No H/Q in entry =           4
  In of MODEL    4
    1    H    ARG 826           H        ARG 826  29.182 -15.208 -11.897
    2    HA   ARG 826           HA       ARG 826  26.397 -14.778 -12.229
    3    HB2  ARG 826           HB2      ARG 826  26.748 -15.329 -14.614
    4    HB3  ARG 826           HB3      ARG 826  27.814 -14.053 -14.021
    5    HG2  ARG 826           HG2      ARG 826  29.626 -15.580 -13.959
    6    HG3  ARG 826           HG3      ARG 826  28.577 -16.939 -14.369
    7    HD2  ARG 826           HD2      ARG 826  29.106 -14.542 -16.138
    8    HD3  ARG 826           HD3      ARG 826  29.862 -16.126 -16.307
    9    HE   ARG 826           HE       ARG 826  26.998 -16.216 -16.310
   10   HH11  ARG 826          HH11      ARG 826  29.804 -15.673 -18.481
   11   HH12  ARG 826          HH12      ARG 826  28.957 -16.211 -19.837
   12   HH21  ARG 826          HH21      ARG 826  25.928 -16.963 -18.197
   13   HH22  ARG 826          HH22      ARG 826  26.729 -16.964 -19.691

  No H/Q in entry =          13
  In of MODEL    4
    1    H    GLY 827           H        GLY 827  28.296 -17.692 -11.957
    2    HA3  GLY 827           HA2      GLY 827  26.992 -19.641 -11.220
    3    HA2  GLY 827           HA3      GLY 827  25.771 -19.167 -12.390

  No H/Q in entry =           3
  In of MODEL    4
    1    H    GLN 828           H        GLN 828  28.847 -18.682 -13.585
    2    HA   GLN 828           HA       GLN 828  28.660 -20.819 -15.481
    3    HB2  GLN 828           HB2      GLN 828  29.799 -18.667 -15.966
    4    HB3  GLN 828           HB3      GLN 828  30.990 -19.033 -14.733
    5    HG2  GLN 828           HG2      GLN 828  31.914 -19.451 -16.928
    6    HG3  GLN 828           HG3      GLN 828  31.745 -20.959 -16.045
    7   HE21  GLN 828          HE21      GLN 828  29.006 -19.339 -17.578
    8   HE22  GLN 828          HE22      GLN 828  28.805 -20.513 -18.809

  No H/Q in entry =           8
  In of MODEL    4
    1    H    SER 829           H        SER 829  29.910 -22.828 -15.431
    2    HA   SER 829           HA       SER 829  30.683 -23.526 -12.730
    3    HB2  SER 829           HB2      SER 829  30.476 -25.290 -15.188
    4    HB3  SER 829           HB3      SER 829  30.674 -25.827 -13.525
    5    HG   SER 829           HG       SER 829  28.593 -24.156 -13.677

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ILE 830           H        ILE 830  32.663 -23.271 -12.105
    2    HA   ILE 830           HA       ILE 830  34.868 -23.759 -13.944
    3    HB   ILE 830           HB       ILE 830  36.124 -21.830 -13.155
    4   HG12  ILE 830          HG12      ILE 830  34.902 -21.587 -10.950
    5   HG13  ILE 830          HG13      ILE 830  35.262 -20.048 -11.689
    6   HG23  ILE 830          HG21      ILE 830  34.976 -21.545 -15.222
    7   HG22  ILE 830          HG22      ILE 830  34.936 -20.017 -14.331
    8   HG21  ILE 830          HG23      ILE 830  33.509 -21.049 -14.378
    9   HD13  ILE 830          HD11      ILE 830  32.937 -19.986 -12.534
   10   HD12  ILE 830          HD12      ILE 830  33.034 -20.029 -10.777
   11   HD11  ILE 830          HD13      ILE 830  32.622 -21.487 -11.676

  No H/Q in entry =          11
  In of MODEL    4
    1    H    SER 831           H        SER 831  36.650 -24.588 -13.012
    2    HA   SER 831           HA       SER 831  36.504 -25.077 -10.143
    3    HB2  SER 831           HB2      SER 831  37.644 -26.734 -12.369
    4    HB3  SER 831           HB3      SER 831  37.765 -27.130 -10.661
    5    HG   SER 831           HG       SER 831  35.608 -27.173 -12.416

  No H/Q in entry =           5
  In of MODEL    4
    1    H    VAL 832           H        VAL 832  37.898 -23.452  -9.428
    2    HA   VAL 832           HA       VAL 832  40.266 -22.795 -10.895
    3    HB   VAL 832           HB       VAL 832  39.508 -21.987  -8.060
    4   HG11  VAL 832          HG11      VAL 832  41.925 -21.801  -8.447
    5   HG13  VAL 832          HG12      VAL 832  41.183 -20.207  -8.320
    6   HG12  VAL 832          HG13      VAL 832  41.624 -20.849  -9.902
    7   HG22  VAL 832          HG21      VAL 832  37.896 -21.159  -9.677
    8   HG21  VAL 832          HG22      VAL 832  39.194 -20.546 -10.692
    9   HG23  VAL 832          HG23      VAL 832  38.900 -19.815  -9.119

  No H/Q in entry =           9
  In of MODEL    4
    1    H    THR 833           H        THR 833  41.728 -24.300 -11.116
    2    HA   THR 833           HA       THR 833  42.152 -26.302  -9.182
    3    HB   THR 833           HB       THR 833  43.988 -26.976 -10.778
    4    HG1  THR 833           HG1      THR 833  44.010 -25.875 -12.786
    5   HG23  THR 833          HG21      THR 833  41.723 -27.904 -11.015
    6   HG22  THR 833          HG22      THR 833  42.430 -27.625 -12.609
    7   HG21  THR 833          HG23      THR 833  41.238 -26.506 -11.970

  No H/Q in entry =           7
  In of MODEL    4
    1    H    SER 834           H        SER 834  43.852 -23.401 -10.254
    2    HA   SER 834           HA       SER 834  45.248 -23.419  -7.759
    3    HB2  SER 834           HB2      SER 834  47.451 -23.052  -8.990
    4    HB3  SER 834           HB3      SER 834  46.810 -24.695  -8.894
    5    HG   SER 834           HG       SER 834  45.893 -24.307 -10.984

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ILE 835           H        ILE 835  45.924 -21.502  -7.101
    2    HA   ILE 835           HA       ILE 835  44.718 -19.209  -8.316
    3    HB   ILE 835           HB       ILE 835  45.688 -18.014  -6.343
    4   HG12  ILE 835          HG12      ILE 835  46.263 -19.508  -4.384
    5   HG13  ILE 835          HG13      ILE 835  46.472 -20.825  -5.518
    6   HG21  ILE 835          HG21      ILE 835  43.931 -20.373  -5.918
    7   HG23  ILE 835          HG22      ILE 835  43.428 -18.752  -6.433
    8   HG22  ILE 835          HG23      ILE 835  44.090 -19.015  -4.804
    9   HD11  ILE 835          HD11      ILE 835  48.048 -18.286  -5.411
   10   HD13  ILE 835          HD12      ILE 835  48.300 -19.611  -6.563
   11   HD12  ILE 835          HD13      ILE 835  48.561 -19.870  -4.824

  No H/Q in entry =          11
  In of MODEL    4
    1    H    ARG 836           H        ARG 836  47.316 -20.690  -9.301
    2    HA   ARG 836           HA       ARG 836  49.058 -18.365  -9.600
    3    HB2  ARG 836           HB2      ARG 836  49.464 -21.231 -10.412
    4    HB3  ARG 836           HB3      ARG 836  50.633 -19.942 -10.612
    5    HG2  ARG 836           HG2      ARG 836  50.564 -19.656  -8.130
    6    HG3  ARG 836           HG3      ARG 836  49.632 -21.157  -8.073
    7    HD2  ARG 836           HD2      ARG 836  52.397 -20.770  -9.178
    8    HD3  ARG 836           HD3      ARG 836  51.887 -21.616  -7.711
    9    HE   ARG 836           HE       ARG 836  50.537 -22.855  -9.765
   10   HH11  ARG 836          HH11      ARG 836  53.986 -22.367  -9.082
   11   HH12  ARG 836          HH12      ARG 836  54.457 -23.777  -9.927
   12   HH21  ARG 836          HH21      ARG 836  51.222 -24.725 -10.919
   13   HH22  ARG 836          HH22      ARG 836  52.867 -25.135 -10.990

  No H/Q in entry =          13
  In of MODEL    4
    1    HA   PRO 837           HA       PRO 837  47.443 -18.208 -13.806
    2    HB2  PRO 837           HB2      PRO 837  49.515 -17.014 -15.109
    3    HB3  PRO 837           HB3      PRO 837  48.355 -16.121 -14.130
    4    HG2  PRO 837           HG2      PRO 837  51.145 -16.951 -13.496
    5    HG3  PRO 837           HG3      PRO 837  50.265 -15.506 -12.978
    6    HD2  PRO 837           HD2      PRO 837  50.703 -17.730 -11.404
    7    HD3  PRO 837           HD3      PRO 837  49.402 -16.553 -11.148

  No H/Q in entry =           7
  In of MODEL    4
    1    H    CYS 838           H        CYS 838  47.467 -19.730 -15.448
    2    HA   CYS 838           HA       CYS 838  49.773 -21.418 -15.499
    3    HB2  CYS 838           HB2      CYS 838  46.982 -21.747 -16.562
    4    HB3  CYS 838           HB3      CYS 838  48.276 -22.709 -17.251

  No H/Q in entry =           4
  In of MODEL    4
    1    H    ALA 839           H        ALA 839  50.370 -22.101 -17.891
    2    HA   ALA 839           HA       ALA 839  50.654 -19.723 -19.516
    3    HB3  ALA 839           HB1      ALA 839  52.020 -21.213 -20.952
    4    HB1  ALA 839           HB2      ALA 839  51.578 -22.583 -19.932
    5    HB2  ALA 839           HB3      ALA 839  52.544 -21.263 -19.271

  No H/Q in entry =           5
  In of MODEL    4
    1    H    ALA 840           H        ALA 840  48.084 -20.152 -19.250
    2    HA   ALA 840           HA       ALA 840  47.188 -21.357 -21.760
    3    HB3  ALA 840           HB1      ALA 840  46.686 -22.929 -19.978
    4    HB1  ALA 840           HB2      ALA 840  45.201 -22.228 -20.615
    5    HB2  ALA 840           HB3      ALA 840  45.850 -21.667 -19.074

  No H/Q in entry =           5
  In of MODEL    4
    1    H    GLU 841           H        GLU 841  47.723 -18.712 -21.568
    2    HA   GLU 841           HA       GLU 841  45.136 -17.466 -21.223
    3    HB2  GLU 841           HB2      GLU 841  46.393 -15.354 -21.956
    4    HB3  GLU 841           HB3      GLU 841  46.877 -16.049 -20.419
    5    HG2  GLU 841           HG2      GLU 841  48.790 -17.130 -21.570
    6    HG3  GLU 841           HG3      GLU 841  48.321 -16.288 -23.048

  No H/Q in entry =           6
  In of MODEL    4
    1    H    THR 842           H        THR 842  44.222 -18.833 -22.662
    2    HA   THR 842           HA       THR 842  45.115 -19.270 -25.272
    3    HB   THR 842           HB       THR 842  42.794 -20.414 -25.213
    4    HG1  THR 842           HG1      THR 842  41.780 -20.207 -23.311
    5   HG22  THR 842          HG21      THR 842  43.808 -22.304 -23.979
    6   HG21  THR 842          HG22      THR 842  45.064 -21.227 -23.369
    7   HG23  THR 842          HG23      THR 842  44.972 -21.587 -25.093

  No H/Q in entry =           7
  In of MODEL    4
    1    H    GLN 843           H        GLN 843  43.672 -19.112 -27.111
    2    HA   GLN 843           HA       GLN 843  42.153 -16.626 -27.133
    3    HB2  GLN 843           HB2      GLN 843  43.674 -17.985 -29.382
    4    HB3  GLN 843           HB3      GLN 843  42.650 -16.580 -29.591
    5    HG2  GLN 843           HG2      GLN 843  44.885 -15.803 -29.600
    6    HG3  GLN 843           HG3      GLN 843  44.222 -15.353 -28.037
    7   HE21  GLN 843          HE21      GLN 843  46.243 -15.197 -27.134
    8   HE22  GLN 843          HE22      GLN 843  47.226 -16.539 -26.734

  No H/Q in entry =           8
  In of MODEL    5
    1    H1   GLY 689           H2       GLY 689  78.178   7.851  -9.270
    2    H2   GLY 689           H1       GLY 689  78.385   7.287  -7.673
    3    H3   GLY 689           H3       GLY 689  79.344   6.708  -8.927
    4    HA2  GLY 689           HA2      GLY 689  76.448   6.250  -8.605
    5    HA3  GLY 689           HA3      GLY 689  77.727   5.055  -8.408

  No H/Q in entry =           5
  In of MODEL    5
    1    H    SER 690           H        SER 690  79.307   5.095 -10.403
    2    HA   SER 690           HA       SER 690  77.622   5.051 -12.769
    3    HB2  SER 690           HB2      SER 690  80.461   6.061 -12.605
    4    HB3  SER 690           HB3      SER 690  79.441   6.014 -14.043
    5    HG   SER 690           HG       SER 690  77.963   7.295 -12.530

  No H/Q in entry =           5
  In of MODEL    5
    1    H    HIS 691           H        HIS 691  78.095   3.424 -14.166
    2    HA   HIS 691           HA       HIS 691  79.950   1.349 -13.243
    3    HB2  HIS 691           HB2      HIS 691  77.860   1.279 -15.461
    4    HB3  HIS 691           HB3      HIS 691  78.850  -0.080 -14.955
    5    HD1  HIS 691           HD1      HIS 691  78.069  -1.389 -12.900
    6    HD2  HIS 691           HD2      HIS 691  75.764   1.975 -13.681
    7    HE1  HIS 691           HE1      HIS 691  76.026  -1.620 -11.464
    8    HE2  HIS 691           HE2      HIS 691  74.580   0.343 -12.080

  No H/Q in entry =           8
  In of MODEL    5
    1    H    MET 692           H        MET 692  81.247   0.356 -15.120
    2    HA   MET 692           HA       MET 692  82.583   2.468 -16.496
    3    HB2  MET 692           HB2      MET 692  83.703   0.392 -15.715
    4    HB3  MET 692           HB3      MET 692  82.811  -0.512 -16.928
    5    HG2  MET 692           HG2      MET 692  83.914   0.734 -18.693
    6    HG3  MET 692           HG3      MET 692  84.791   1.684 -17.498
    7    HE2  MET 692           HE1      MET 692  85.356  -0.618 -15.277
    8    HE1  MET 692           HE2      MET 692  86.497   0.635 -15.752
    9    HE3  MET 692           HE3      MET 692  86.992  -1.057 -15.759

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ASN 693           H        ASN 693  80.528  -0.224 -17.515
    2    HA   ASN 693           HA       ASN 693  79.631   1.534 -19.686
    3    HB2  ASN 693           HB2      ASN 693  80.944  -0.425 -20.538
    4    HB3  ASN 693           HB3      ASN 693  79.828  -1.505 -19.719
    5   HD21  ASN 693          HD21      ASN 693  80.535  -1.329 -22.511
    6   HD22  ASN 693          HD22      ASN 693  79.081  -1.058 -23.387

  No H/Q in entry =           6
  In of MODEL    5
    1    HA   PRO 694           HA       PRO 694  75.934   0.309 -17.408
    2    HB2  PRO 694           HB2      PRO 694  74.648   2.714 -17.781
    3    HB3  PRO 694           HB3      PRO 694  75.775   2.361 -16.470
    4    HG2  PRO 694           HG2      PRO 694  76.140   4.203 -18.629
    5    HG3  PRO 694           HG3      PRO 694  77.298   3.794 -17.359
    6    HD2  PRO 694           HD2      PRO 694  77.109   2.754 -20.143
    7    HD3  PRO 694           HD3      PRO 694  78.522   2.929 -19.069

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LEU 695           H        LEU 695  74.044  -0.531 -18.084
    2    HA   LEU 695           HA       LEU 695  73.341  -0.262 -20.894
    3    HB2  LEU 695           HB2      LEU 695  72.205  -2.072 -18.736
    4    HB3  LEU 695           HB3      LEU 695  71.690  -2.071 -20.403
    5    HG   LEU 695           HG       LEU 695  73.032  -3.969 -20.128
    6   HD13  LEU 695          HD11      LEU 695  74.907  -3.641 -21.626
    7   HD12  LEU 695          HD12      LEU 695  74.750  -1.900 -21.434
    8   HD11  LEU 695          HD13      LEU 695  73.449  -2.826 -22.189
    9   HD22  LEU 695          HD21      LEU 695  74.143  -3.421 -18.032
   10   HD21  LEU 695          HD22      LEU 695  75.158  -2.238 -18.855
   11   HD23  LEU 695          HD23      LEU 695  75.330  -3.953 -19.224

  No H/Q in entry =          11
  In of MODEL    5
    1    H    THR 696           H        THR 696  70.759  -0.245 -21.111
    2    HA   THR 696           HA       THR 696  70.015   2.165 -19.756
    3    HB   THR 696           HB       THR 696  69.471   1.858 -22.165
    4    HG1  THR 696           HG1      THR 696  68.088   3.307 -21.530
    5   HG21  THR 696          HG21      THR 696  67.494  -0.207 -21.170
    6   HG23  THR 696          HG22      THR 696  68.920  -0.534 -22.154
    7   HG22  THR 696          HG23      THR 696  67.583   0.406 -22.819

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLN 697           H        GLN 697  67.453   2.062 -19.145
    2    HA   GLN 697           HA       GLN 697  67.417   0.503 -16.756
    3    HB2  GLN 697           HB2      GLN 697  65.266   2.184 -18.036
    4    HB3  GLN 697           HB3      GLN 697  65.154   1.467 -16.437
    5    HG2  GLN 697           HG2      GLN 697  67.202   3.501 -17.297
    6    HG3  GLN 697           HG3      GLN 697  65.755   3.836 -16.346
    7   HE21  GLN 697          HE21      GLN 697  65.649   3.098 -14.230
    8   HE22  GLN 697          HE22      GLN 697  67.053   2.661 -13.345

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ALA 698           H        ALA 698  67.083  -1.587 -16.825
    2    HA   ALA 698           HA       ALA 698  65.361  -2.746 -18.867
    3    HB3  ALA 698           HB1      ALA 698  66.178  -4.901 -18.004
    4    HB2  ALA 698           HB2      ALA 698  67.074  -4.056 -16.744
    5    HB1  ALA 698           HB3      ALA 698  67.516  -3.840 -18.437

  No H/Q in entry =           5
  In of MODEL    5
    1    H    VAL 699           H        VAL 699  63.273  -2.657 -18.378
    2    HA   VAL 699           HA       VAL 699  62.305  -2.563 -15.702
    3    HB   VAL 699           HB       VAL 699  60.754  -3.104 -18.258
    4   HG11  VAL 699          HG11      VAL 699  59.503  -3.720 -16.258
    5   HG13  VAL 699          HG12      VAL 699  58.804  -2.292 -17.017
    6   HG12  VAL 699          HG13      VAL 699  59.794  -2.121 -15.568
    7   HG23  VAL 699          HG21      VAL 699  60.221  -0.696 -18.228
    8   HG22  VAL 699          HG22      VAL 699  61.950  -0.989 -18.418
    9   HG21  VAL 699          HG23      VAL 699  61.309  -0.489 -16.857

  No H/Q in entry =           9
  In of MODEL    5
    1    HA   PRO 700           HA       PRO 700  62.321  -7.046 -15.413
    2    HB2  PRO 700           HB2      PRO 700  61.987  -7.169 -12.731
    3    HB3  PRO 700           HB3      PRO 700  63.556  -6.831 -13.478
    4    HG2  PRO 700           HG2      PRO 700  61.666  -5.004 -12.104
    5    HG3  PRO 700           HG3      PRO 700  63.428  -4.911 -12.231
    6    HD2  PRO 700           HD2      PRO 700  61.569  -3.441 -13.741
    7    HD3  PRO 700           HD3      PRO 700  63.301  -3.603 -14.076

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LYS 701           H        LYS 701  60.676  -8.547 -15.196
    2    HA   LYS 701           HA       LYS 701  58.039  -7.436 -14.916
    3    HB2  LYS 701           HB2      LYS 701  59.020 -10.185 -15.645
    4    HB3  LYS 701           HB3      LYS 701  57.325  -9.848 -15.357
    5    HG2  LYS 701           HG2      LYS 701  59.015  -8.516 -17.473
    6    HG3  LYS 701           HG3      LYS 701  57.905  -9.859 -17.752
    7    HD2  LYS 701           HD2      LYS 701  56.059  -8.432 -16.882
    8    HD3  LYS 701           HD3      LYS 701  57.196  -7.087 -16.785
    9    HE2  LYS 701           HE2      LYS 701  57.566  -7.221 -19.187
   10    HE3  LYS 701           HE3      LYS 701  56.461  -8.594 -19.290
   11    HZ2  LYS 701           HZ1      LYS 701  55.756  -5.826 -18.481
   12    HZ1  LYS 701           HZ2      LYS 701  54.697  -7.131 -18.447
   13    HZ3  LYS 701           HZ3      LYS 701  55.317  -6.595 -19.918

  No H/Q in entry =          13
  In of MODEL    5
    1    H    CYS 702           H        CYS 702  57.040  -7.327 -13.109
    2    HA   CYS 702           HA       CYS 702  57.983  -8.985 -10.902
    3    HB2  CYS 702           HB2      CYS 702  56.092  -6.618 -10.687
    4    HB3  CYS 702           HB3      CYS 702  57.056  -7.367  -9.441

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLN 703           H        GLN 703  56.579 -10.311  -9.919
    2    HA   GLN 703           HA       GLN 703  54.450 -11.238 -11.566
    3    HB2  GLN 703           HB2      GLN 703  55.269 -12.038  -8.784
    4    HB3  GLN 703           HB3      GLN 703  54.192 -12.943  -9.824
    5    HG2  GLN 703           HG2      GLN 703  57.123 -12.423 -10.278
    6    HG3  GLN 703           HG3      GLN 703  56.388 -13.952  -9.811
    7   HE21  GLN 703          HE21      GLN 703  57.090 -11.798 -12.420
    8   HE22  GLN 703          HE22      GLN 703  56.547 -12.821 -13.692

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ARG 704           H        ARG 704  52.385 -11.880 -10.131
    2    HA   ARG 704           HA       ARG 704  50.967  -9.452  -9.959
    3    HB2  ARG 704           HB2      ARG 704  50.222 -12.205  -9.041
    4    HB3  ARG 704           HB3      ARG 704  49.122 -10.844  -8.986
    5    HG2  ARG 704           HG2      ARG 704  50.410 -11.957 -11.463
    6    HG3  ARG 704           HG3      ARG 704  48.747 -12.232 -10.942
    7    HD2  ARG 704           HD2      ARG 704  48.358  -9.797 -11.064
    8    HD3  ARG 704           HD3      ARG 704  49.991  -9.596 -11.680
    9    HE   ARG 704           HE       ARG 704  48.539 -11.478 -13.235
   10   HH11  ARG 704          HH11      ARG 704  49.098  -8.011 -12.765
   11   HH12  ARG 704          HH12      ARG 704  48.620  -7.551 -14.322
   12   HH21  ARG 704          HH21      ARG 704  47.852 -10.853 -15.413
   13   HH22  ARG 704          HH22      ARG 704  47.843  -9.215 -15.848

  No H/Q in entry =          13
  In of MODEL    5
    1    H    TRP 705           H        TRP 705  52.506 -11.300  -7.478
    2    HA   TRP 705           HA       TRP 705  51.242  -9.788  -5.336
    3    HB2  TRP 705           HB2      TRP 705  52.635 -11.279  -3.884
    4    HB3  TRP 705           HB3      TRP 705  51.487 -12.111  -4.922
    5    HD1  TRP 705           HD1      TRP 705  55.202 -11.750  -4.247
    6    HE1  TRP 705           HE1      TRP 705  56.490 -13.472  -5.623
    7    HE3  TRP 705           HE3      TRP 705  51.401 -13.429  -7.203
    8    HZ2  TRP 705           HZ2      TRP 705  55.975 -15.323  -7.691
    9    HZ3  TRP 705           HZ3      TRP 705  51.884 -15.180  -8.855
   10    HH2  TRP 705           HH2      TRP 705  54.127 -16.108  -9.091

  No H/Q in entry =          10
  In of MODEL    5
    1    H    GLU 706           H        GLU 706  53.620  -9.208  -7.439
    2    HA   GLU 706           HA       GLU 706  55.346  -7.879  -5.505
    3    HB2  GLU 706           HB2      GLU 706  55.909  -8.700  -8.335
    4    HB3  GLU 706           HB3      GLU 706  57.040  -7.907  -7.239
    5    HG2  GLU 706           HG2      GLU 706  56.900  -9.900  -5.787
    6    HG3  GLU 706           HG3      GLU 706  55.884 -10.666  -7.010

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS 707           H        LYS 707  55.695  -5.813  -5.714
    2    HA   LYS 707           HA       LYS 707  54.278  -4.403  -7.859
    3    HB2  LYS 707           HB2      LYS 707  54.866  -3.328  -5.088
    4    HB3  LYS 707           HB3      LYS 707  53.917  -2.545  -6.334
    5    HG2  LYS 707           HG2      LYS 707  53.168  -4.993  -4.733
    6    HG3  LYS 707           HG3      LYS 707  52.440  -3.399  -4.641
    7    HD2  LYS 707           HD2      LYS 707  52.317  -5.291  -7.000
    8    HD3  LYS 707           HD3      LYS 707  51.008  -4.959  -5.870
    9    HE2  LYS 707           HE2      LYS 707  50.993  -2.599  -6.641
   10    HE3  LYS 707           HE3      LYS 707  52.277  -2.995  -7.772
   11    HZ3  LYS 707           HZ1      LYS 707  50.108  -3.025  -8.821
   12    HZ2  LYS 707           HZ2      LYS 707  49.574  -4.194  -7.739
   13    HZ1  LYS 707           HZ3      LYS 707  50.809  -4.568  -8.851

  No H/Q in entry =          13
  In of MODEL    5
    1    H    LEU 708           H        LEU 708  55.529  -2.954  -8.979
    2    HA   LEU 708           HA       LEU 708  58.314  -3.077  -8.320
    3    HB2  LEU 708           HB2      LEU 708  57.545  -3.546 -10.644
    4    HB3  LEU 708           HB3      LEU 708  56.970  -1.899 -10.756
    5    HG   LEU 708           HG       LEU 708  59.837  -2.401 -10.119
    6   HD13  LEU 708          HD11      LEU 708  59.462  -3.817 -12.026
    7   HD12  LEU 708          HD12      LEU 708  60.332  -2.374 -12.546
    8   HD11  LEU 708          HD13      LEU 708  58.601  -2.526 -12.876
    9   HD22  LEU 708          HD21      LEU 708  59.052  -0.104 -10.048
   10   HD21  LEU 708          HD22      LEU 708  58.412  -0.246 -11.686
   11   HD23  LEU 708          HD23      LEU 708  60.152  -0.312 -11.413

  No H/Q in entry =          11
  In of MODEL    5
    1    H    GLN 709           H        GLN 709  59.192  -1.642  -7.186
    2    HA   GLN 709           HA       GLN 709  58.550   1.153  -7.519
    3    HB2  GLN 709           HB2      GLN 709  58.386   1.604  -5.165
    4    HB3  GLN 709           HB3      GLN 709  57.265   0.289  -5.473
    5    HG2  GLN 709           HG2      GLN 709  58.864  -1.317  -4.569
    6    HG3  GLN 709           HG3      GLN 709  60.036  -0.013  -4.347
    7   HE21  GLN 709          HE21      GLN 709  60.163  -0.406  -2.145
    8   HE22  GLN 709          HE22      GLN 709  58.898   0.051  -1.066

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ASN 710           H        ASN 710  60.460   2.380  -7.037
    2    HA   ASN 710           HA       ASN 710  62.760   2.730  -6.747
    3    HB2  ASN 710           HB2      ASN 710  62.077   1.589  -4.539
    4    HB3  ASN 710           HB3      ASN 710  62.646   0.092  -5.232
    5   HD21  ASN 710          HD21      ASN 710  63.458   3.033  -3.836
    6   HD22  ASN 710          HD22      ASN 710  65.160   2.789  -3.634

  No H/Q in entry =           6
  In of MODEL    5
    1    H    SER 711           H        SER 711  61.666   1.328  -8.954
    2    HA   SER 711           HA       SER 711  62.086   0.139 -10.768
    3    HB2  SER 711           HB2      SER 711  64.365   0.350 -11.737
    4    HB3  SER 711           HB3      SER 711  63.796   1.834 -10.957
    5    HG   SER 711           HG       SER 711  65.075   0.601  -9.092

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ARG 712           H        ARG 712  61.998  -1.385  -8.213
    2    HA   ARG 712           HA       ARG 712  63.230  -3.850  -9.202
    3    HB2  ARG 712           HB2      ARG 712  63.911  -4.468  -6.959
    4    HB3  ARG 712           HB3      ARG 712  64.587  -2.884  -7.307
    5    HG2  ARG 712           HG2      ARG 712  62.846  -1.821  -6.000
    6    HG3  ARG 712           HG3      ARG 712  62.086  -3.383  -5.712
    7    HD2  ARG 712           HD2      ARG 712  63.314  -2.834  -3.755
    8    HD3  ARG 712           HD3      ARG 712  64.209  -4.095  -4.591
    9    HE   ARG 712           HE       ARG 712  65.014  -1.369  -5.145
   10   HH11  ARG 712          HH11      ARG 712  65.623  -4.337  -3.278
   11   HH12  ARG 712          HH12      ARG 712  67.178  -3.861  -2.794
   12   HH21  ARG 712          HH21      ARG 712  67.150  -0.716  -4.424
   13   HH22  ARG 712          HH22      ARG 712  68.086  -1.764  -3.485

  No H/Q in entry =          13
  In of MODEL    5
    1    H    CYS 713           H        CYS 713  62.148  -5.745  -8.153
    2    HA   CYS 713           HA       CYS 713  59.275  -5.243  -7.852
    3    HB2  CYS 713           HB2      CYS 713  60.749  -7.861  -8.223
    4    HB3  CYS 713           HB3      CYS 713  59.008  -7.633  -8.284

  No H/Q in entry =           4
  In of MODEL    5
    1    H    VAL 714           H        VAL 714  58.544  -5.099  -5.810
    2    HA   VAL 714           HA       VAL 714  59.816  -6.800  -3.774
    3    HB   VAL 714           HB       VAL 714  59.041  -5.166  -2.058
    4   HG13  VAL 714          HG11      VAL 714  61.319  -4.994  -2.873
    5   HG12  VAL 714          HG12      VAL 714  60.667  -3.389  -2.519
    6   HG11  VAL 714          HG13      VAL 714  60.780  -3.949  -4.186
    7   HG23  VAL 714          HG21      VAL 714  58.281  -2.916  -2.735
    8   HG22  VAL 714          HG22      VAL 714  57.159  -4.163  -3.272
    9   HG21  VAL 714          HG23      VAL 714  58.276  -3.429  -4.421

  No H/Q in entry =           9
  In of MODEL    5
    1    H    CYS 715           H        CYS 715  58.216  -7.451  -2.048
    2    HA   CYS 715           HA       CYS 715  55.774  -8.258  -3.380
    3    HB2  CYS 715           HB2      CYS 715  56.985  -9.005  -0.696
    4    HB3  CYS 715           HB3      CYS 715  55.374  -9.485  -1.162

  No H/Q in entry =           4
  In of MODEL    5
    1    H    LYS 716           H        LYS 716  53.767  -7.713  -2.733
    2    HA   LYS 716           HA       LYS 716  53.296  -5.245  -1.385
    3    HB2  LYS 716           HB2      LYS 716  51.788  -6.259  -3.109
    4    HB3  LYS 716           HB3      LYS 716  51.403  -7.555  -2.001
    5    HG2  LYS 716           HG2      LYS 716  50.408  -5.798  -0.457
    6    HG3  LYS 716           HG3      LYS 716  50.624  -4.643  -1.776
    7    HD2  LYS 716           HD2      LYS 716  49.019  -7.200  -1.946
    8    HD3  LYS 716           HD3      LYS 716  48.330  -5.617  -1.607
    9    HE2  LYS 716           HE2      LYS 716  50.027  -6.047  -3.963
   10    HE3  LYS 716           HE3      LYS 716  48.334  -6.575  -4.052
   11    HZ2  LYS 716           HZ1      LYS 716  49.351  -3.754  -3.652
   12    HZ1  LYS 716           HZ2      LYS 716  47.754  -4.221  -3.484
   13    HZ3  LYS 716           HZ3      LYS 716  48.469  -4.366  -4.962

  No H/Q in entry =          13
  In of MODEL    5
    1    H    MET 717           H        MET 717  51.659  -5.404   0.582
    2    HA   MET 717           HA       MET 717  52.849  -7.350   2.419
    3    HB2  MET 717           HB2      MET 717  51.476  -4.740   3.065
    4    HB3  MET 717           HB3      MET 717  52.023  -5.885   4.282
    5    HG2  MET 717           HG2      MET 717  53.759  -4.399   2.309
    6    HG3  MET 717           HG3      MET 717  53.608  -4.074   4.032
    7    HE3  MET 717           HE1      MET 717  54.636  -5.615   5.937
    8    HE2  MET 717           HE2      MET 717  55.344  -7.200   5.634
    9    HE1  MET 717           HE3      MET 717  53.622  -6.938   5.368

  No H/Q in entry =           9
  In of MODEL    5
    1    HA   PRO 718           HA       PRO 718  49.243  -9.755   2.330
    2    HB2  PRO 718           HB2      PRO 718  49.266 -10.822   4.871
    3    HB3  PRO 718           HB3      PRO 718  50.272 -11.393   3.538
    4    HG2  PRO 718           HG2      PRO 718  50.969  -9.527   5.770
    5    HG3  PRO 718           HG3      PRO 718  51.931 -10.845   5.074
    6    HD2  PRO 718           HD2      PRO 718  52.403  -8.282   4.454
    7    HD3  PRO 718           HD3      PRO 718  52.571  -9.570   3.242

  No H/Q in entry =           7
  In of MODEL    5
    1    H    TYR 719           H        TYR 719  49.556  -7.334   4.764
    2    HA   TYR 719           HA       TYR 719  46.771  -7.645   5.541
    3    HB2  TYR 719           HB2      TYR 719  47.198  -6.067   7.346
    4    HB3  TYR 719           HB3      TYR 719  48.410  -7.332   7.363
    5    HD1  TYR 719           HD1      TYR 719  47.794  -3.811   7.293
    6    HD2  TYR 719           HD2      TYR 719  50.741  -6.756   6.407
    7    HE1  TYR 719           HE1      TYR 719  49.538  -2.085   7.394
    8    HE2  TYR 719           HE2      TYR 719  52.494  -5.024   6.504
    9    HH   TYR 719           HH       TYR 719  52.619  -2.509   6.210

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLU 720           H        GLU 720  48.493  -6.096   3.212
    2    HA   GLU 720           HA       GLU 720  46.681  -3.801   3.042
    3    HB2  GLU 720           HB2      GLU 720  49.187  -4.567   1.603
    4    HB3  GLU 720           HB3      GLU 720  48.234  -3.147   1.157
    5    HG2  GLU 720           HG2      GLU 720  48.665  -2.322   3.487
    6    HG3  GLU 720           HG3      GLU 720  49.785  -3.671   3.684

  No H/Q in entry =           6
  In of MODEL    5
    1    H    CYS 721           H        CYS 721  46.584  -6.859   2.323
    2    HA   CYS 721           HA       CYS 721  46.042  -6.855  -0.472
    3    HB2  CYS 721           HB2      CYS 721  46.951  -8.805   0.720
    4    HB3  CYS 721           HB3      CYS 721  45.421  -8.981   1.600

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLY 722           H        GLY 722  43.857  -7.745  -1.260
    2    HA3  GLY 722           HA2      GLY 722  41.529  -7.416   0.247
    3    HA2  GLY 722           HA3      GLY 722  41.835  -5.928  -0.633

  No H/Q in entry =           3
  In of MODEL    5
    1    HA   PRO 723           HA       PRO 723  40.072  -7.823  -4.143
    2    HB2  PRO 723           HB2      PRO 723  41.541  -6.688  -6.206
    3    HB3  PRO 723           HB3      PRO 723  40.215  -5.921  -5.329
    4    HG2  PRO 723           HG2      PRO 723  42.997  -5.225  -5.279
    5    HG3  PRO 723           HG3      PRO 723  41.657  -4.462  -4.418
    6    HD2  PRO 723           HD2      PRO 723  43.654  -6.384  -3.441
    7    HD3  PRO 723           HD3      PRO 723  42.625  -5.262  -2.532

  No H/Q in entry =           7
  In of MODEL    5
    1    H    SER 724           H        SER 724  40.321  -9.942  -4.331
    2    HA   SER 724           HA       SER 724  41.917 -11.193  -6.341
    3    HB2  SER 724           HB2      SER 724  42.891 -11.222  -3.550
    4    HB3  SER 724           HB3      SER 724  42.994 -12.689  -4.527
    5    HG   SER 724           HG       SER 724  43.759 -10.573  -5.961

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU 725           H        LEU 725  41.551 -13.326  -6.579
    2    HA   LEU 725           HA       LEU 725  38.982 -14.309  -5.989
    3    HB2  LEU 725           HB2      LEU 725  41.441 -15.390  -7.067
    4    HB3  LEU 725           HB3      LEU 725  40.348 -16.569  -6.415
    5    HG   LEU 725           HG       LEU 725  39.710 -16.538  -8.534
    6   HD12  LEU 725          HD11      LEU 725  37.951 -14.366  -7.613
    7   HD11  LEU 725          HD12      LEU 725  37.786 -16.097  -7.312
    8   HD13  LEU 725          HD13      LEU 725  37.693 -15.475  -8.960
    9   HD21  LEU 725          HD21      LEU 725  41.272 -14.941  -9.330
   10   HD23  LEU 725          HD22      LEU 725  40.225 -13.643  -8.726
   11   HD22  LEU 725          HD23      LEU 725  39.680 -14.673 -10.047

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ASP 726           H        ASP 726  38.173 -15.064  -4.185
    2    HA   ASP 726           HA       ASP 726  39.756 -15.773  -1.946
    3    HB2  ASP 726           HB2      ASP 726  37.468 -16.570  -1.090
    4    HB3  ASP 726           HB3      ASP 726  37.689 -14.855  -1.379

  No H/Q in entry =           4
  In of MODEL    5
    1    H    VAL 727           H        VAL 727  40.432 -17.679  -1.340
    2    HA   VAL 727           HA       VAL 727  39.436 -20.004  -2.724
    3    HB   VAL 727           HB       VAL 727  41.781 -20.902  -3.068
    4   HG12  VAL 727          HG11      VAL 727  41.113 -18.389  -4.597
    5   HG11  VAL 727          HG12      VAL 727  40.517 -20.009  -4.955
    6   HG13  VAL 727          HG13      VAL 727  42.234 -19.642  -5.127
    7   HG23  VAL 727          HG21      VAL 727  42.581 -18.044  -2.512
    8   HG22  VAL 727          HG22      VAL 727  43.647 -19.299  -3.138
    9   HG21  VAL 727          HG23      VAL 727  42.973 -19.447  -1.517

  No H/Q in entry =           9
  In of MODEL    5
    1    H    CYS 728           H        CYS 728  40.294 -22.102  -1.647
    2    HA   CYS 728           HA       CYS 728  40.510 -21.656   1.234
    3    HB2  CYS 728           HB2      CYS 728  39.912 -24.176  -0.327
    4    HB3  CYS 728           HB3      CYS 728  40.001 -24.078   1.421

  No H/Q in entry =           4
  In of MODEL    5
    1    H    ALA 729           H        ALA 729  42.344 -22.109   2.286
    2    HA   ALA 729           HA       ALA 729  44.393 -23.601   0.825
    3    HB2  ALA 729           HB1      ALA 729  46.051 -22.017   1.587
    4    HB1  ALA 729           HB2      ALA 729  44.779 -21.076   2.368
    5    HB3  ALA 729           HB3      ALA 729  44.813 -21.215   0.609

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLN 730           H        GLN 730  45.913 -24.554   2.169
    2    HA   GLN 730           HA       GLN 730  44.941 -25.016   4.891
    3    HB2  GLN 730           HB2      GLN 730  45.128 -27.006   3.429
    4    HB3  GLN 730           HB3      GLN 730  46.840 -26.663   3.247
    5    HG2  GLN 730           HG2      GLN 730  47.208 -26.934   5.590
    6    HG3  GLN 730           HG3      GLN 730  45.503 -27.221   5.878
    7   HE21  GLN 730          HE21      GLN 730  45.727 -29.290   6.646
    8   HE22  GLN 730          HE22      GLN 730  46.298 -30.587   5.680

  No H/Q in entry =           8
  In of MODEL    5
    1    H    ASP 731           H        ASP 731  46.070 -24.331   6.475
    2    HA   ASP 731           HA       ASP 731  48.538 -22.904   6.142
    3    HB2  ASP 731           HB2      ASP 731  46.809 -22.320   7.873
    4    HB3  ASP 731           HB3      ASP 731  47.166 -23.834   8.687

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLU 732           H        GLU 732  50.561 -23.806   6.189
    2    HA   GLU 732           HA       GLU 732  50.836 -26.608   6.334
    3    HB2  GLU 732           HB2      GLU 732  52.878 -24.412   6.144
    4    HB3  GLU 732           HB3      GLU 732  53.327 -26.105   6.255
    5    HG2  GLU 732           HG2      GLU 732  51.559 -24.924   4.140
    6    HG3  GLU 732           HG3      GLU 732  53.276 -25.278   3.954

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ARG 733           H        ARG 733  50.801 -24.373   8.895
    2    HA   ARG 733           HA       ARG 733  52.413 -26.196  10.492
    3    HB2  ARG 733           HB2      ARG 733  53.060 -23.785  10.411
    4    HB3  ARG 733           HB3      ARG 733  51.523 -23.392  11.164
    5    HG2  ARG 733           HG2      ARG 733  53.311 -23.394  12.797
    6    HG3  ARG 733           HG3      ARG 733  52.165 -24.695  13.139
    7    HD2  ARG 733           HD2      ARG 733  54.475 -25.463  13.381
    8    HD3  ARG 733           HD3      ARG 733  53.644 -26.293  12.064
    9    HE   ARG 733           HE       ARG 733  55.113 -23.996  11.186
   10   HH11  ARG 733          HH11      ARG 733  55.371 -27.453  11.906
   11   HH12  ARG 733          HH12      ARG 733  56.770 -27.689  10.970
   12   HH21  ARG 733          HH21      ARG 733  57.035 -24.346   9.876
   13   HH22  ARG 733          HH22      ARG 733  57.734 -25.899   9.803

  No H/Q in entry =          13
  In of MODEL    5
    1    H    SER 734           H        SER 734  49.362 -24.430  10.439
    2    HA   SER 734           HA       SER 734  48.410 -25.778  12.803
    3    HB2  SER 734           HB2      SER 734  47.808 -23.428  12.399
    4    HB3  SER 734           HB3      SER 734  46.998 -23.887  10.908
    5    HG   SER 734           HG       SER 734  46.315 -24.746  13.518

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LYS 735           H        LYS 735  48.258 -26.261   9.387
    2    HA   LYS 735           HA       LYS 735  47.479 -27.857   8.048
    3    HB2  LYS 735           HB2      LYS 735  46.632 -29.412  10.508
    4    HB3  LYS 735           HB3      LYS 735  46.903 -30.061   8.899
    5    HG2  LYS 735           HG2      LYS 735  49.001 -28.935  10.761
    6    HG3  LYS 735           HG3      LYS 735  48.740 -30.630  10.367
    7    HD2  LYS 735           HD2      LYS 735  49.510 -28.528   8.334
    8    HD3  LYS 735           HD3      LYS 735  50.669 -29.538   9.188
    9    HE2  LYS 735           HE2      LYS 735  48.449 -30.557   7.410
   10    HE3  LYS 735           HE3      LYS 735  50.130 -30.376   6.932
   11    HZ1  LYS 735           HZ1      LYS 735  50.701 -31.970   8.756
   12    HZ3  LYS 735           HZ2      LYS 735  49.772 -32.605   7.512
   13    HZ2  LYS 735           HZ3      LYS 735  49.041 -32.247   8.973

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ARG 736           H        ARG 736  45.707 -25.845   9.508
    2    HA   ARG 736           HA       ARG 736  43.084 -26.976   9.132
    3    HB2  ARG 736           HB2      ARG 736  42.256 -24.942  10.152
    4    HB3  ARG 736           HB3      ARG 736  43.634 -25.546  11.073
    5    HG2  ARG 736           HG2      ARG 736  45.079 -23.943   9.925
    6    HG3  ARG 736           HG3      ARG 736  43.648 -23.269   9.144
    7    HD2  ARG 736           HD2      ARG 736  44.053 -23.461  12.122
    8    HD3  ARG 736           HD3      ARG 736  44.406 -22.068  11.102
    9    HE   ARG 736           HE       ARG 736  41.827 -22.536  10.555
   10   HH11  ARG 736          HH11      ARG 736  43.438 -22.398  13.699
   11   HH12  ARG 736          HH12      ARG 736  42.196 -21.562  14.487
   12   HH21  ARG 736          HH21      ARG 736  40.090 -21.360  11.627
   13   HH22  ARG 736          HH22      ARG 736  40.231 -20.958  13.274

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ILE 737           H        ILE 737  41.631 -26.344   7.539
    2    HA   ILE 737           HA       ILE 737  42.754 -24.950   5.256
    3    HB   ILE 737           HB       ILE 737  39.892 -25.887   5.583
    4   HG12  ILE 737          HG12      ILE 737  41.456 -27.821   5.927
    5   HG13  ILE 737          HG13      ILE 737  40.455 -27.993   4.495
    6   HG23  ILE 737          HG21      ILE 737  39.858 -25.831   3.157
    7   HG22  ILE 737          HG22      ILE 737  41.574 -25.494   3.110
    8   HG21  ILE 737          HG23      ILE 737  40.472 -24.283   3.759
    9   HD12  ILE 737          HD11      ILE 737  43.328 -27.147   4.598
   10   HD11  ILE 737          HD12      ILE 737  42.319 -27.225   3.146
   11   HD13  ILE 737          HD13      ILE 737  42.698 -28.709   4.037

  No H/Q in entry =          11
  In of MODEL    5
    1    H    LEU 738           H        LEU 738  42.491 -22.826   5.071
    2    HA   LEU 738           HA       LEU 738  40.224 -21.598   6.441
    3    HB2  LEU 738           HB2      LEU 738  41.483 -19.736   7.223
    4    HB3  LEU 738           HB3      LEU 738  42.337 -21.166   7.755
    5    HG   LEU 738           HG       LEU 738  43.132 -19.366   5.453
    6   HD13  LEU 738          HD11      LEU 738  44.953 -18.653   6.908
    7   HD12  LEU 738          HD12      LEU 738  44.292 -19.638   8.212
    8   HD11  LEU 738          HD13      LEU 738  43.377 -18.259   7.599
    9   HD21  LEU 738          HD21      LEU 738  44.590 -21.654   6.740
   10   HD23  LEU 738          HD22      LEU 738  45.229 -20.577   5.476
   11   HD22  LEU 738          HD23      LEU 738  43.850 -21.628   5.136

  No H/Q in entry =          11
  In of MODEL    5
    1    HA   PRO 739           HA       PRO 739  39.564 -19.512   2.572
    2    HB2  PRO 739           HB2      PRO 739  38.290 -17.301   3.454
    3    HB3  PRO 739           HB3      PRO 739  37.513 -18.895   3.473
    4    HG2  PRO 739           HG2      PRO 739  38.809 -17.401   5.718
    5    HG3  PRO 739           HG3      PRO 739  37.291 -18.319   5.715
    6    HD2  PRO 739           HD2      PRO 739  39.666 -19.346   6.650
    7    HD3  PRO 739           HD3      PRO 739  38.376 -20.347   5.932

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LEU 740           H        LEU 740  41.200 -18.733   1.592
    2    HA   LEU 740           HA       LEU 740  42.430 -16.296   2.611
    3    HB2  LEU 740           HB2      LEU 740  43.735 -18.585   1.146
    4    HB3  LEU 740           HB3      LEU 740  44.468 -17.007   1.248
    5    HG   LEU 740           HG       LEU 740  43.947 -18.919   3.515
    6   HD13  LEU 740          HD11      LEU 740  46.377 -18.912   3.659
    7   HD12  LEU 740          HD12      LEU 740  46.448 -17.794   2.280
    8   HD11  LEU 740          HD13      LEU 740  45.823 -19.419   2.059
    9   HD22  LEU 740          HD21      LEU 740  43.560 -16.619   4.284
   10   HD21  LEU 740          HD22      LEU 740  45.089 -16.127   3.561
   11   HD23  LEU 740          HD23      LEU 740  45.083 -17.246   4.924

  No H/Q in entry =          11
  In of MODEL    5
    1    H    THR 741           H        THR 741  43.771 -15.568   0.453
    2    HA   THR 741           HA       THR 741  41.814 -15.533  -1.683
    3    HB   THR 741           HB       THR 741  43.254 -13.041  -0.831
    4    HG1  THR 741           HG1      THR 741  40.838 -14.107   0.300
    5   HG21  THR 741          HG21      THR 741  42.021 -13.232  -2.908
    6   HG23  THR 741          HG22      THR 741  41.346 -11.986  -1.843
    7   HG22  THR 741          HG23      THR 741  40.548 -13.564  -2.009

  No H/Q in entry =           7
  In of MODEL    5
    1    H    VAL 742           H        VAL 742  42.936 -14.910  -3.729
    2    HA   VAL 742           HA       VAL 742  45.407 -16.141  -3.834
    3    HB   VAL 742           HB       VAL 742  45.670 -15.452  -6.141
    4   HG13  VAL 742          HG11      VAL 742  43.793 -16.681  -6.993
    5   HG12  VAL 742          HG12      VAL 742  42.959 -16.419  -5.446
    6   HG11  VAL 742          HG13      VAL 742  44.458 -17.378  -5.502
    7   HG22  VAL 742          HG21      VAL 742  43.997 -14.409  -7.341
    8   HG21  VAL 742          HG22      VAL 742  44.665 -13.314  -6.101
    9   HG23  VAL 742          HG23      VAL 742  43.064 -14.089  -5.873

  No H/Q in entry =           9
  In of MODEL    5
    1    H    CYS 743           H        CYS 743  44.936 -12.603  -4.046
    2    HA   CYS 743           HA       CYS 743  47.616 -12.007  -4.042
    3    HB2  CYS 743           HB2      CYS 743  46.422 -10.042  -4.283
    4    HB3  CYS 743           HB3      CYS 743  45.132 -10.630  -3.237

  No H/Q in entry =           4
  In of MODEL    5
    1    H    LYS 744           H        LYS 744  45.465 -12.715  -1.329
    2    HA   LYS 744           HA       LYS 744  47.091 -12.136   0.833
    3    HB2  LYS 744           HB2      LYS 744  44.698 -12.760   0.837
    4    HB3  LYS 744           HB3      LYS 744  45.159 -14.404   0.525
    5    HG2  LYS 744           HG2      LYS 744  44.682 -14.240   2.860
    6    HG3  LYS 744           HG3      LYS 744  46.419 -14.472   2.662
    7    HD2  LYS 744           HD2      LYS 744  45.952 -12.822   4.392
    8    HD3  LYS 744           HD3      LYS 744  46.746 -12.048   3.023
    9    HE2  LYS 744           HE2      LYS 744  44.683 -11.139   2.247
   10    HE3  LYS 744           HE3      LYS 744  43.755 -12.084   3.407
   11    HZ3  LYS 744           HZ1      LYS 744  44.704 -10.827   5.175
   12    HZ2  LYS 744           HZ2      LYS 744  44.034  -9.746   4.070
   13    HZ1  LYS 744           HZ3      LYS 744  45.713  -9.969   4.146

  No H/Q in entry =          13
  In of MODEL    5
    1    H    MET 745           H        MET 745  46.474 -15.328  -0.548
    2    HA   MET 745           HA       MET 745  48.501 -16.732   0.729
    3    HB2  MET 745           HB2      MET 745  46.950 -18.064  -0.216
    4    HB3  MET 745           HB3      MET 745  46.851 -17.161  -1.719
    5    HG2  MET 745           HG2      MET 745  47.918 -19.099  -2.373
    6    HG3  MET 745           HG3      MET 745  49.256 -18.016  -2.104
    7    HE1  MET 745           HE1      MET 745  47.456 -21.158  -1.239
    8    HE3  MET 745           HE2      MET 745  46.975 -20.256   0.204
    9    HE2  MET 745           HE3      MET 745  48.053 -21.649   0.339

  No H/Q in entry =           9
  In of MODEL    5
    1    H    HIS 746           H        HIS 746  48.461 -15.213  -2.521
    2    HA   HIS 746           HA       HIS 746  50.880 -16.233  -3.238
    3    HB2  HIS 746           HB2      HIS 746  49.264 -14.086  -4.325
    4    HB3  HIS 746           HB3      HIS 746  50.977 -13.980  -4.768
    5    HD1  HIS 746           HD1      HIS 746  51.787 -16.671  -5.612
    6    HD2  HIS 746           HD2      HIS 746  47.900 -15.323  -6.234
    7    HE1  HIS 746           HE1      HIS 746  50.922 -17.996  -7.529
    8    HE2  HIS 746           HE2      HIS 746  48.629 -17.057  -8.000

  No H/Q in entry =           8
  In of MODEL    5
    1    H    VAL 747           H        VAL 747  50.163 -13.037  -1.844
    2    HA   VAL 747           HA       VAL 747  52.780 -11.993  -1.755
    3    HB   VAL 747           HB       VAL 747  50.219 -11.341  -0.283
    4   HG11  VAL 747          HG11      VAL 747  52.092 -10.829   1.232
    5   HG13  VAL 747          HG12      VAL 747  51.319  -9.364   0.642
    6   HG12  VAL 747          HG13      VAL 747  52.857  -9.886  -0.045
    7   HG23  VAL 747          HG21      VAL 747  51.870  -9.847  -2.270
    8   HG22  VAL 747          HG22      VAL 747  50.309  -9.322  -1.591
    9   HG21  VAL 747          HG23      VAL 747  50.398 -10.752  -2.633

  No H/Q in entry =           9
  In of MODEL    5
    1    H    LEU 748           H        LEU 748  50.755 -13.499   0.678
    2    HA   LEU 748           HA       LEU 748  52.558 -13.517   2.766
    3    HB2  LEU 748           HB2      LEU 748  50.443 -13.935   3.470
    4    HB3  LEU 748           HB3      LEU 748  50.014 -14.767   2.014
    5    HG   LEU 748           HG       LEU 748  51.507 -16.114   4.272
    6   HD13  LEU 748          HD11      LEU 748  49.306 -16.931   4.958
    7   HD12  LEU 748          HD12      LEU 748  48.539 -15.972   3.695
    8   HD11  LEU 748          HD13      LEU 748  49.341 -15.169   5.045
    9   HD22  LEU 748          HD21      LEU 748  50.648 -18.112   3.246
   10   HD21  LEU 748          HD22      LEU 748  51.520 -17.192   2.012
   11   HD23  LEU 748          HD23      LEU 748  49.757 -17.179   2.057

  No H/Q in entry =          11
  In of MODEL    5
    1    H    HIS 749           H        HIS 749  52.162 -15.708   0.114
    2    HA   HIS 749           HA       HIS 749  53.876 -17.775   0.908
    3    HB2  HIS 749           HB2      HIS 749  52.202 -17.797  -0.987
    4    HB3  HIS 749           HB3      HIS 749  53.354 -16.862  -1.921
    5    HD1  HIS 749           HD1      HIS 749  55.323 -18.150  -2.965
    6    HD2  HIS 749           HD2      HIS 749  52.881 -20.430  -0.530
    7    HE1  HIS 749           HE1      HIS 749  56.020 -20.504  -3.373
    8    HE2  HIS 749           HE2      HIS 749  54.315 -21.862  -2.138

  No H/Q in entry =           8
  In of MODEL    5
    1    H    CYS 750           H        CYS 750  54.506 -14.788  -1.005
    2    HA   CYS 750           HA       CYS 750  57.257 -15.561  -1.340
    3    HB2  CYS 750           HB2      CYS 750  57.618 -13.437  -2.474
    4    HB3  CYS 750           HB3      CYS 750  56.138 -14.173  -3.074

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLN 751           H        GLN 751  55.424 -13.804   1.030
    2    HA   GLN 751           HA       GLN 751  57.652 -12.502   2.107
    3    HB2  GLN 751           HB2      GLN 751  54.974 -13.149   3.338
    4    HB3  GLN 751           HB3      GLN 751  56.180 -12.105   4.080
    5    HG2  GLN 751           HG2      GLN 751  54.915 -11.619   1.393
    6    HG3  GLN 751           HG3      GLN 751  54.384 -10.873   2.890
    7   HE21  GLN 751          HE21      GLN 751  54.792  -8.846   1.956
    8   HE22  GLN 751          HE22      GLN 751  56.370  -8.196   1.848

  No H/Q in entry =           8
  In of MODEL    5
    1    H    GLY 752           H        GLY 752  56.882 -15.754   2.033
    2    HA3  GLY 752           HA2      GLY 752  58.757 -17.130   2.889
    3    HA2  GLY 752           HA3      GLY 752  58.565 -16.268   4.405

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ARG 753           H        ARG 753  55.522 -16.586   3.574
    2    HA   ARG 753           HA       ARG 753  55.131 -18.769   5.412
    3    HB2  ARG 753           HB2      ARG 753  53.177 -17.148   3.822
    4    HB3  ARG 753           HB3      ARG 753  52.769 -18.246   5.135
    5    HG2  ARG 753           HG2      ARG 753  54.547 -15.861   5.466
    6    HG3  ARG 753           HG3      ARG 753  52.817 -15.760   5.673
    7    HD2  ARG 753           HD2      ARG 753  54.608 -17.627   7.237
    8    HD3  ARG 753           HD3      ARG 753  53.963 -16.097   7.845
    9    HE   ARG 753           HE       ARG 753  51.763 -17.464   7.048
   10   HH11  ARG 753          HH11      ARG 753  54.339 -18.143   9.386
   11   HH12  ARG 753          HH12      ARG 753  53.385 -19.216  10.312
   12   HH21  ARG 753          HH21      ARG 753  50.462 -18.954   8.354
   13   HH22  ARG 753          HH22      ARG 753  51.182 -19.694   9.708

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ASN 754           H        ASN 754  54.538 -20.836   4.922
    2    HA   ASN 754           HA       ASN 754  54.059 -21.489   2.107
    3    HB2  ASN 754           HB2      ASN 754  54.801 -23.290   4.418
    4    HB3  ASN 754           HB3      ASN 754  54.532 -23.810   2.767
    5   HD21  ASN 754          HD21      ASN 754  56.839 -24.012   4.465
    6   HD22  ASN 754          HD22      ASN 754  58.133 -23.244   3.594

  No H/Q in entry =           6
  In of MODEL    5
    1    H    TYR 755           H        TYR 755  52.113 -22.145   1.511
    2    HA   TYR 755           HA       TYR 755  50.317 -23.370   3.422
    3    HB2  TYR 755           HB2      TYR 755  49.696 -20.920   1.767
    4    HB3  TYR 755           HB3      TYR 755  48.440 -22.046   2.263
    5    HD1  TYR 755           HD1      TYR 755  51.179 -19.977   3.703
    6    HD2  TYR 755           HD2      TYR 755  47.315 -21.616   4.231
    7    HE1  TYR 755           HE1      TYR 755  50.952 -18.740   5.790
    8    HE2  TYR 755           HE2      TYR 755  47.085 -20.391   6.343
    9    HH   TYR 755           HH       TYR 755  48.569 -19.520   8.025

  No H/Q in entry =           9
  In of MODEL    5
    1    H    THR 756           H        THR 756  48.732 -24.627   2.340
    2    HA   THR 756           HA       THR 756  49.601 -25.415  -0.348
    3    HB   THR 756           HB       THR 756  48.193 -27.003   1.820
    4    HG1  THR 756           HG1      THR 756  50.247 -27.112   2.409
    5   HG21  THR 756          HG21      THR 756  47.471 -27.703  -0.413
    6   HG23  THR 756          HG22      THR 756  48.475 -28.943   0.346
    7   HG22  THR 756          HG23      THR 756  49.154 -27.891  -0.907

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LEU 757           H        LEU 757  48.084 -25.468  -1.997
    2    HA   LEU 757           HA       LEU 757  45.598 -24.130  -1.494
    3    HB2  LEU 757           HB2      LEU 757  46.850 -25.202  -4.014
    4    HB3  LEU 757           HB3      LEU 757  45.201 -24.627  -3.986
    5    HG   LEU 757           HG       LEU 757  46.547 -22.902  -4.868
    6   HD12  LEU 757          HD11      LEU 757  45.850 -22.230  -2.021
    7   HD11  LEU 757          HD12      LEU 757  44.785 -22.175  -3.421
    8   HD13  LEU 757          HD13      LEU 757  46.151 -21.075  -3.315
    9   HD22  LEU 757          HD21      LEU 757  48.741 -23.597  -4.055
   10   HD21  LEU 757          HD22      LEU 757  48.301 -23.128  -2.414
   11   HD23  LEU 757          HD23      LEU 757  48.456 -21.899  -3.669

  No H/Q in entry =          11
  In of MODEL    5
    1    H    THR 758           H        THR 758  43.599 -24.918  -1.565
    2    HA   THR 758           HA       THR 758  43.269 -27.756  -1.981
    3    HB   THR 758           HB       THR 758  41.664 -27.714   0.042
    4    HG1  THR 758           HG1      THR 758  42.685 -25.211   0.130
    5   HG23  THR 758          HG21      THR 758  43.465 -28.204   1.651
    6   HG22  THR 758          HG22      THR 758  44.635 -27.451   0.572
    7   HG21  THR 758          HG23      THR 758  43.811 -28.928   0.080

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLY 759           H        GLY 759  40.751 -28.149  -1.890
    2    HA3  GLY 759           HA2      GLY 759  39.779 -26.525  -4.037
    3    HA2  GLY 759           HA3      GLY 759  38.985 -27.922  -3.327

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ARG 760           H        ARG 760  37.719 -25.588  -4.088
    2    HA   ARG 760           HA       ARG 760  37.189 -23.663  -2.156
    3    HB2  ARG 760           HB2      ARG 760  35.291 -23.061  -3.409
    4    HB3  ARG 760           HB3      ARG 760  36.392 -23.744  -4.585
    5    HG2  ARG 760           HG2      ARG 760  33.984 -25.112  -3.381
    6    HG3  ARG 760           HG3      ARG 760  34.085 -24.430  -5.000
    7    HD2  ARG 760           HD2      ARG 760  35.777 -26.121  -5.593
    8    HD3  ARG 760           HD3      ARG 760  35.701 -26.772  -3.953
    9    HE   ARG 760           HE       ARG 760  33.200 -26.648  -5.324
   10   HH11  ARG 760          HH11      ARG 760  35.928 -28.792  -4.442
   11   HH12  ARG 760          HH12      ARG 760  35.202 -30.189  -5.049
   12   HH21  ARG 760          HH21      ARG 760  32.207 -28.638  -6.124
   13   HH22  ARG 760          HH22      ARG 760  33.039 -30.113  -6.008

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ASP 761           H        ASP 761  36.273 -26.939  -2.179
    2    HA   ASP 761           HA       ASP 761  33.925 -26.738  -0.588
    3    HB2  ASP 761           HB2      ASP 761  34.031 -29.210  -0.669
    4    HB3  ASP 761           HB3      ASP 761  34.138 -28.452  -2.261

  No H/Q in entry =           4
  In of MODEL    5
    1    H    SER 762           H        SER 762  37.293 -26.785  -0.004
    2    HA   SER 762           HA       SER 762  37.232 -28.400   2.354
    3    HB2  SER 762           HB2      SER 762  39.414 -26.615   1.280
    4    HB3  SER 762           HB3      SER 762  39.603 -27.861   2.516
    5    HG   SER 762           HG       SER 762  38.402 -28.657   0.153

  No H/Q in entry =           5
  In of MODEL    5
    1    H    CYS 763           H        CYS 763  36.889 -25.015   1.666
    2    HA   CYS 763           HA       CYS 763  36.487 -24.623   4.534
    3    HB2  CYS 763           HB2      CYS 763  37.472 -22.448   4.486
    4    HB3  CYS 763           HB3      CYS 763  38.639 -23.539   3.753

  No H/Q in entry =           4
  In of MODEL    5
    1    H    THR 764           H        THR 764  35.275 -22.343   4.747
    2    HA   THR 764           HA       THR 764  32.983 -22.532   2.985
    3    HB   THR 764           HB       THR 764  33.387 -20.914   5.529
    4    HG1  THR 764           HG1      THR 764  33.423 -23.273   5.751
    5   HG23  THR 764          HG21      THR 764  31.631 -20.036   4.044
    6   HG22  THR 764          HG22      THR 764  30.934 -20.742   5.507
    7   HG21  THR 764          HG23      THR 764  30.887 -21.635   3.985

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LEU 765           H        LEU 765  33.491 -21.480   1.161
    2    HA   LEU 765           HA       LEU 765  35.196 -19.167   1.258
    3    HB2  LEU 765           HB2      LEU 765  35.005 -21.216  -0.460
    4    HB3  LEU 765           HB3      LEU 765  33.926 -20.072  -1.239
    5    HG   LEU 765           HG       LEU 765  35.787 -18.444  -1.398
    6   HD11  LEU 765          HD11      LEU 765  37.389 -20.624  -0.122
    7   HD13  LEU 765          HD12      LEU 765  37.037 -19.033   0.562
    8   HD12  LEU 765          HD13      LEU 765  38.040 -19.179  -0.875
    9   HD22  LEU 765          HD21      LEU 765  37.084 -19.651  -3.055
   10   HD21  LEU 765          HD22      LEU 765  35.373 -20.041  -3.223
   11   HD23  LEU 765          HD23      LEU 765  36.471 -21.188  -2.449

  No H/Q in entry =          11
  In of MODEL    5
    1    HA   PRO 766           HA       PRO 766  31.963 -16.159   1.487
    2    HB2  PRO 766           HB2      PRO 766  33.246 -14.113   0.155
    3    HB3  PRO 766           HB3      PRO 766  33.424 -14.500   1.860
    4    HG2  PRO 766           HG2      PRO 766  35.193 -15.172  -0.431
    5    HG3  PRO 766           HG3      PRO 766  35.620 -14.776   1.241
    6    HD2  PRO 766           HD2      PRO 766  35.674 -17.288   0.274
    7    HD3  PRO 766           HD3      PRO 766  35.287 -16.947   1.963

  No H/Q in entry =           7
  In of MODEL    5
    1    H    ALA 767           H        ALA 767  33.411 -16.644  -1.704
    2    HA   ALA 767           HA       ALA 767  30.951 -15.528  -2.792
    3    HB2  ALA 767           HB1      ALA 767  32.961 -14.484  -3.593
    4    HB3  ALA 767           HB2      ALA 767  32.120 -15.301  -4.917
    5    HB1  ALA 767           HB3      ALA 767  33.557 -16.030  -4.188

  No H/Q in entry =           5
  In of MODEL    5
    1    H    SER 768           H        SER 768  29.473 -16.762  -3.463
    2    HA   SER 768           HA       SER 768  30.087 -19.040  -5.101
    3    HB2  SER 768           HB2      SER 768  29.816 -19.927  -2.739
    4    HB3  SER 768           HB3      SER 768  28.192 -19.244  -2.722
    5    HG   SER 768           HG       SER 768  29.178 -21.250  -4.462

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA 769           H        ALA 769  27.491 -17.174  -3.462
    2    HA   ALA 769           HA       ALA 769  26.480 -16.040  -5.827
    3    HB1  ALA 769           HB1      ALA 769  25.584 -18.298  -6.206
    4    HB2  ALA 769           HB2      ALA 769  24.277 -17.175  -5.816
    5    HB3  ALA 769           HB3      ALA 769  24.881 -18.291  -4.590

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLU 770           H        GLU 770  24.031 -15.295  -5.083
    2    HA   GLU 770           HA       GLU 770  22.752 -14.027  -3.773
    3    HB2  GLU 770           HB2      GLU 770  24.151 -15.368  -1.493
    4    HB3  GLU 770           HB3      GLU 770  22.613 -14.508  -1.407
    5    HG2  GLU 770           HG2      GLU 770  21.728 -16.205  -3.015
    6    HG3  GLU 770           HG3      GLU 770  23.265 -17.054  -2.790

  No H/Q in entry =           6
  In of MODEL    5
    1    H    LYS 771           H        LYS 771  24.990 -12.753  -4.709
    2    HA   LYS 771           HA       LYS 771  26.180 -11.386  -2.486
    3    HB2  LYS 771           HB2      LYS 771  26.329 -10.651  -5.427
    4    HB3  LYS 771           HB3      LYS 771  27.270  -9.973  -4.132
    5    HG2  LYS 771           HG2      LYS 771  27.420 -12.856  -5.005
    6    HG3  LYS 771           HG3      LYS 771  28.545 -11.587  -5.473
    7    HD2  LYS 771           HD2      LYS 771  29.691 -12.576  -3.729
    8    HD3  LYS 771           HD3      LYS 771  28.836 -11.306  -2.869
    9    HE2  LYS 771           HE2      LYS 771  27.086 -13.031  -2.226
   10    HE3  LYS 771           HE3      LYS 771  28.044 -14.223  -3.043
   11    HZ3  LYS 771           HZ1      LYS 771  28.491 -14.274  -0.720
   12    HZ2  LYS 771           HZ2      LYS 771  28.905 -12.657  -0.681
   13    HZ1  LYS 771           HZ3      LYS 771  29.895 -13.755  -1.493

  No H/Q in entry =          13
  In of MODEL    5
    1    H    ALA 772           H        ALA 772  25.475  -9.639  -1.528
    2    HA   ALA 772           HA       ALA 772  23.281  -8.148  -2.767
    3    HB2  ALA 772           HB1      ALA 772  22.406  -9.557  -0.960
    4    HB1  ALA 772           HB2      ALA 772  22.310  -7.845  -0.539
    5    HB3  ALA 772           HB3      ALA 772  23.583  -8.854   0.150

  No H/Q in entry =           5
  In of MODEL    5
    1    H    CYS 773           H        CYS 773  23.253  -5.889  -2.204
    2    HA   CYS 773           HA       CYS 773  25.906  -4.910  -2.280
    3    HB2  CYS 773           HB2      CYS 773  24.022  -3.856  -3.522
    4    HB3  CYS 773           HB3      CYS 773  23.349  -3.323  -1.984

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLY 774           H        GLY 774  27.158  -4.144  -0.751
    2    HA3  GLY 774           HA2      GLY 774  27.202  -2.882   1.410
    3    HA2  GLY 774           HA3      GLY 774  26.124  -4.152   1.999

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ALA 775           H        ALA 775  27.432  -6.093   0.241
    2    HA   ALA 775           HA       ALA 775  30.173  -6.222   1.121
    3    HB2  ALA 775           HB1      ALA 775  28.157  -8.407   1.722
    4    HB3  ALA 775           HB2      ALA 775  28.988  -7.411   2.919
    5    HB1  ALA 775           HB3      ALA 775  29.902  -8.549   1.931

  No H/Q in entry =           5
  In of MODEL    5
    1    H    CYS 776           H        CYS 776  30.906  -6.174  -0.897
    2    HA   CYS 776           HA       CYS 776  30.134  -8.315  -2.702
    3    HB2  CYS 776           HB2      CYS 776  30.174  -5.372  -3.454
    4    HB3  CYS 776           HB3      CYS 776  30.044  -6.724  -4.571

  No H/Q in entry =           4
  In of MODEL    5
    1    HA   PRO 777           HA       PRO 777  34.562  -8.091  -3.393
    2    HB2  PRO 777           HB2      PRO 777  34.696  -9.524  -5.709
    3    HB3  PRO 777           HB3      PRO 777  34.388 -10.291  -4.148
    4    HG2  PRO 777           HG2      PRO 777  32.452  -9.508  -6.285
    5    HG3  PRO 777           HG3      PRO 777  32.535 -11.012  -5.350
    6    HD2  PRO 777           HD2      PRO 777  30.803  -9.020  -4.758
    7    HD3  PRO 777           HD3      PRO 777  31.510 -10.076  -3.517

  No H/Q in entry =           7
  In of MODEL    5
    1    H    LEU 778           H        LEU 778  35.607  -8.044  -6.015
    2    HA   LEU 778           HA       LEU 778  35.068  -5.290  -6.764
    3    HB2  LEU 778           HB2      LEU 778  37.118  -5.630  -8.240
    4    HB3  LEU 778           HB3      LEU 778  37.312  -5.669  -6.492
    5    HG   LEU 778           HG       LEU 778  36.971  -8.286  -7.878
    6   HD11  LEU 778          HD11      LEU 778  38.612  -7.129  -9.283
    7   HD13  LEU 778          HD12      LEU 778  39.299  -8.447  -8.339
    8   HD12  LEU 778          HD13      LEU 778  39.583  -6.772  -7.836
    9   HD22  LEU 778          HD21      LEU 778  38.535  -9.013  -6.152
   10   HD21  LEU 778          HD22      LEU 778  37.166  -8.169  -5.426
   11   HD23  LEU 778          HD23      LEU 778  38.712  -7.350  -5.605

  No H/Q in entry =          11
  In of MODEL    5
    1    H    TRP 779           H        TRP 779  34.879  -8.489  -8.134
    2    HA   TRP 779           HA       TRP 779  34.083  -7.532 -10.719
    3    HB2  TRP 779           HB2      TRP 779  33.596 -10.040 -11.075
    4    HB3  TRP 779           HB3      TRP 779  35.262  -9.526 -10.879
    5    HD1  TRP 779           HD1      TRP 779  32.469 -11.393  -8.952
    6    HE1  TRP 779           HE1      TRP 779  33.615 -12.863  -7.158
    7    HE3  TRP 779           HE3      TRP 779  37.255  -9.715  -9.435
    8    HZ2  TRP 779           HZ2      TRP 779  36.275 -13.247  -6.121
    9    HZ3  TRP 779           HZ3      TRP 779  38.992 -10.672  -8.040
   10    HH2  TRP 779           HH2      TRP 779  38.498 -12.387  -6.416

  No H/Q in entry =          10
  In of MODEL    5
    1    H    GLY 780           H        GLY 780  32.574  -8.261  -7.830
    2    HA3  GLY 780           HA2      GLY 780  29.951  -8.129  -9.143
    3    HA2  GLY 780           HA3      GLY 780  30.229  -9.118  -7.693

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LYS 781           H        LYS 781  29.007  -6.280  -8.678
    2    HA   LYS 781           HA       LYS 781  29.544  -4.995  -6.134
    3    HB2  LYS 781           HB2      LYS 781  30.375  -3.779  -8.763
    4    HB3  LYS 781           HB3      LYS 781  30.098  -2.831  -7.308
    5    HG2  LYS 781           HG2      LYS 781  31.859  -4.025  -6.150
    6    HG3  LYS 781           HG3      LYS 781  32.087  -5.082  -7.539
    7    HD2  LYS 781           HD2      LYS 781  33.808  -3.367  -7.447
    8    HD3  LYS 781           HD3      LYS 781  32.797  -3.168  -8.874
    9    HE2  LYS 781           HE2      LYS 781  31.547  -1.428  -7.753
   10    HE3  LYS 781           HE3      LYS 781  32.531  -1.636  -6.308
   11    HZ3  LYS 781           HZ1      LYS 781  34.474  -0.957  -7.541
   12    HZ2  LYS 781           HZ2      LYS 781  33.302   0.237  -7.731
   13    HZ1  LYS 781           HZ3      LYS 781  33.613  -0.843  -8.973

  No H/Q in entry =          13
  In of MODEL    5
    1    H    CYS 782           H        CYS 782  28.428  -2.763  -6.210
    2    HA   CYS 782           HA       CYS 782  25.931  -2.894  -7.658
    3    HB2  CYS 782           HB2      CYS 782  24.877  -2.067  -5.500
    4    HB3  CYS 782           HB3      CYS 782  25.344  -3.766  -5.514

  No H/Q in entry =           4
  In of MODEL    5
    1    H    ASP 783           H        ASP 783  25.965  -1.126  -8.862
    2    HA   ASP 783           HA       ASP 783  27.196   1.296  -7.727
    3    HB2  ASP 783           HB2      ASP 783  28.667   0.366  -9.416
    4    HB3  ASP 783           HB3      ASP 783  27.343   0.321 -10.577

  No H/Q in entry =           4
  In of MODEL    5
    1    H    ALA 784           H        ALA 784  24.838   0.075 -10.052
    2    HA   ALA 784           HA       ALA 784  23.377   2.604  -9.730
    3    HB1  ALA 784           HB1      ALA 784  23.409   0.684 -12.055
    4    HB3  ALA 784           HB2      ALA 784  24.179   2.269 -12.018
    5    HB2  ALA 784           HB3      ALA 784  22.418   2.137 -11.949

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLU 785           H        GLU 785  21.248   2.460  -9.129
    2    HA   GLU 785           HA       GLU 785  19.771   1.585  -7.697
    3    HB2  GLU 785           HB2      GLU 785  18.075   0.048  -8.840
    4    HB3  GLU 785           HB3      GLU 785  18.369   1.594  -9.592
    5    HG2  GLU 785           HG2      GLU 785  19.639  -0.967 -10.553
    6    HG3  GLU 785           HG3      GLU 785  18.072  -0.404 -11.114

  No H/Q in entry =           6
  In of MODEL    5
    1    H    SER 786           H        SER 786  21.237   0.813  -6.261
    2    HA   SER 786           HA       SER 786  21.976  -1.931  -6.315
    3    HB2  SER 786           HB2      SER 786  22.504   0.224  -4.283
    4    HB3  SER 786           HB3      SER 786  23.260  -1.369  -4.311
    5    HG   SER 786           HG       SER 786  23.745   0.859  -5.842

  No H/Q in entry =           5
  In of MODEL    5
    1    H    SER 787           H        SER 787  19.969  -2.954  -6.133
    2    HA   SER 787           HA       SER 787  18.939  -3.033  -3.388
    3    HB2  SER 787           HB2      SER 787  17.600  -3.908  -5.968
    4    HB3  SER 787           HB3      SER 787  16.863  -3.924  -4.360
    5    HG   SER 787           HG       SER 787  17.486  -1.614  -4.364

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LYS 788           H        LYS 788  20.655  -4.642  -5.831
    2    HA   LYS 788           HA       LYS 788  21.112  -6.882  -4.104
    3    HB2  LYS 788           HB2      LYS 788  20.959  -8.500  -5.963
    4    HB3  LYS 788           HB3      LYS 788  19.403  -7.762  -5.640
    5    HG2  LYS 788           HG2      LYS 788  19.627  -6.358  -7.604
    6    HG3  LYS 788           HG3      LYS 788  21.254  -6.985  -7.896
    7    HD2  LYS 788           HD2      LYS 788  20.343  -9.227  -8.216
    8    HD3  LYS 788           HD3      LYS 788  18.723  -8.635  -7.874
    9    HE2  LYS 788           HE2      LYS 788  20.463  -7.795 -10.193
   10    HE3  LYS 788           HE3      LYS 788  19.120  -8.926 -10.277
   11    HZ2  LYS 788           HZ1      LYS 788  18.917  -6.041  -9.571
   12    HZ1  LYS 788           HZ2      LYS 788  17.627  -7.134  -9.590
   13    HZ3  LYS 788           HZ3      LYS 788  18.439  -6.765 -11.017

  No H/Q in entry =          13
  In of MODEL    5
    1    H    CYS 789           H        CYS 789  23.101  -8.113  -5.184
    2    HA   CYS 789           HA       CYS 789  24.804  -5.989  -6.246
    3    HB2  CYS 789           HB2      CYS 789  25.380  -7.049  -4.016
    4    HB3  CYS 789           HB3      CYS 789  25.630  -8.551  -4.890

  No H/Q in entry =           4
  In of MODEL    5
    1    H    VAL 790           H        VAL 790  25.659  -6.329  -8.247
    2    HA   VAL 790           HA       VAL 790  24.737  -8.762  -9.569
    3    HB   VAL 790           HB       VAL 790  23.667  -6.683 -10.366
    4   HG13  VAL 790          HG11      VAL 790  24.908  -4.993 -11.606
    5   HG12  VAL 790          HG12      VAL 790  26.416  -5.784 -11.155
    6   HG11  VAL 790          HG13      VAL 790  25.386  -5.075  -9.910
    7   HG22  VAL 790          HG21      VAL 790  23.894  -8.480 -11.972
    8   HG21  VAL 790          HG22      VAL 790  25.509  -7.927 -12.408
    9   HG23  VAL 790          HG23      VAL 790  24.104  -6.932 -12.792

  No H/Q in entry =           9
  In of MODEL    5
    1    H    CYS 791           H        CYS 791  26.135  -9.781 -10.989
    2    HA   CYS 791           HA       CYS 791  28.938  -9.289 -10.360
    3    HB2  CYS 791           HB2      CYS 791  27.720 -11.670 -11.774
    4    HB3  CYS 791           HB3      CYS 791  29.293 -11.538 -11.003

  No H/Q in entry =           4
  In of MODEL    5
    1    H    ARG 792           H        ARG 792  30.077  -8.245 -11.744
    2    HA   ARG 792           HA       ARG 792  28.924  -7.487 -14.268
    3    HB2  ARG 792           HB2      ARG 792  31.438  -6.645 -12.845
    4    HB3  ARG 792           HB3      ARG 792  30.848  -5.944 -14.352
    5    HG2  ARG 792           HG2      ARG 792  28.794  -5.237 -13.140
    6    HG3  ARG 792           HG3      ARG 792  29.494  -5.871 -11.655
    7    HD2  ARG 792           HD2      ARG 792  30.669  -3.666 -13.356
    8    HD3  ARG 792           HD3      ARG 792  29.788  -3.436 -11.852
    9    HE   ARG 792           HE       ARG 792  31.777  -5.079 -11.118
   10   HH11  ARG 792          HH11      ARG 792  31.900  -2.116 -13.078
   11   HH12  ARG 792          HH12      ARG 792  33.345  -1.545 -12.414
   12   HH21  ARG 792          HH21      ARG 792  33.863  -4.285 -10.212
   13   HH22  ARG 792          HH22      ARG 792  34.428  -2.756 -10.735

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLU 793           H        GLU 793  30.593  -7.314 -16.123
    2    HA   GLU 793           HA       GLU 793  31.655  -9.989 -16.488
    3    HB2  GLU 793           HB2      GLU 793  31.452  -7.681 -18.439
    4    HB3  GLU 793           HB3      GLU 793  31.965  -9.313 -18.844
    5    HG2  GLU 793           HG2      GLU 793  29.745 -10.150 -18.163
    6    HG3  GLU 793           HG3      GLU 793  29.241  -8.490 -17.853

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ALA 794           H        ALA 794  33.829  -9.948 -17.891
    2    HA   ALA 794           HA       ALA 794  35.810  -9.215 -16.034
    3    HB2  ALA 794           HB1      ALA 794  36.012 -11.128 -17.538
    4    HB3  ALA 794           HB2      ALA 794  37.397 -10.043 -17.663
    5    HB1  ALA 794           HB3      ALA 794  36.150 -10.026 -18.908

  No H/Q in entry =           5
  In of MODEL    5
    1    H    SER 795           H        SER 795  34.408  -7.524 -18.664
    2    HA   SER 795           HA       SER 795  36.394  -5.758 -19.368
    3    HB2  SER 795           HB2      SER 795  33.443  -5.173 -19.207
    4    HB3  SER 795           HB3      SER 795  34.614  -4.517 -20.356
    5    HG   SER 795           HG       SER 795  33.734  -6.095 -21.470

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLU 796           H        GLU 796  34.348  -5.953 -16.593
    2    HA   GLU 796           HA       GLU 796  34.704  -3.216 -15.730
    3    HB2  GLU 796           HB2      GLU 796  33.137  -5.578 -14.745
    4    HB3  GLU 796           HB3      GLU 796  33.221  -4.059 -13.866
    5    HG2  GLU 796           HG2      GLU 796  32.298  -4.251 -16.721
    6    HG3  GLU 796           HG3      GLU 796  31.194  -4.332 -15.349

  No H/Q in entry =           6
  In of MODEL    5
    1    H    CYS 797           H        CYS 797  36.967  -5.152 -15.852
    2    HA   CYS 797           HA       CYS 797  37.611  -5.617 -13.086
    3    HB2  CYS 797           HB2      CYS 797  38.260  -7.177 -14.888
    4    HB3  CYS 797           HB3      CYS 797  39.367  -5.952 -15.525

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLU 798           H        GLU 798  37.794  -3.775 -12.120
    2    HA   GLU 798           HA       GLU 798  39.188  -1.474 -13.226
    3    HB2  GLU 798           HB2      GLU 798  37.964  -1.847 -10.501
    4    HB3  GLU 798           HB3      GLU 798  38.433  -0.324 -11.245
    5    HG2  GLU 798           HG2      GLU 798  36.713  -0.596 -12.933
    6    HG3  GLU 798           HG3      GLU 798  36.288  -2.168 -12.264

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU 799           H        GLU 799  39.716  -3.936 -10.867
    2    HA   GLU 799           HA       GLU 799  41.769  -2.568  -9.432
    3    HB2  GLU 799           HB2      GLU 799  40.218  -4.969  -9.159
    4    HB3  GLU 799           HB3      GLU 799  41.899  -5.201  -8.701
    5    HG2  GLU 799           HG2      GLU 799  40.488  -4.584  -6.857
    6    HG3  GLU 799           HG3      GLU 799  41.800  -3.455  -7.163

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLU 800           H        GLU 800  43.674  -4.073  -8.788
    2    HA   GLU 800           HA       GLU 800  45.595  -4.167 -10.775
    3    HB2  GLU 800           HB2      GLU 800  45.408  -5.840  -8.235
    4    HB3  GLU 800           HB3      GLU 800  46.864  -5.619  -9.190
    5    HG2  GLU 800           HG2      GLU 800  46.890  -3.249  -8.651
    6    HG3  GLU 800           HG3      GLU 800  45.374  -3.412  -7.772

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLY 801           H        GLY 801  43.704  -6.771  -9.318
    2    HA3  GLY 801           HA2      GLY 801  42.892  -8.720 -10.138
    3    HA2  GLY 801           HA3      GLY 801  43.112  -8.048 -11.741

  No H/Q in entry =           3
  In of MODEL    5
    1    H    PHE 802           H        PHE 802  44.183 -10.319  -9.478
    2    HA   PHE 802           HA       PHE 802  46.687 -10.921 -10.644
    3    HB2  PHE 802           HB2      PHE 802  44.818 -12.409  -8.825
    4    HB3  PHE 802           HB3      PHE 802  46.216 -13.222  -9.519
    5    HD1  PHE 802           HD1      PHE 802  47.514 -13.590  -7.611
    6    HD2  PHE 802           HD2      PHE 802  46.039  -9.688  -8.422
    7    HE1  PHE 802           HE1      PHE 802  48.984 -12.689  -5.907
    8    HE2  PHE 802           HE2      PHE 802  47.495  -8.768  -6.715
    9    HZ   PHE 802           HZ       PHE 802  48.984 -10.263  -5.421

  No H/Q in entry =           9
  In of MODEL    5
    1    H    SER 803           H        SER 803  47.021 -13.268 -11.519
    2    HA   SER 803           HA       SER 803  44.979 -13.872 -13.467
    3    HB2  SER 803           HB2      SER 803  47.072 -14.581 -14.876
    4    HB3  SER 803           HB3      SER 803  46.619 -12.879 -14.805
    5    HG   SER 803           HG       SER 803  48.903 -13.884 -14.253

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ILE 804           H        ILE 804  44.339 -15.916 -13.394
    2    HA   ILE 804           HA       ILE 804  45.913 -17.782 -11.778
    3    HB   ILE 804           HB       ILE 804  44.031 -18.513 -10.464
    4   HG12  ILE 804          HG12      ILE 804  42.211 -18.209 -12.149
    5   HG13  ILE 804          HG13      ILE 804  41.777 -17.597 -10.563
    6   HG21  ILE 804          HG21      ILE 804  44.172 -15.518 -10.432
    7   HG23  ILE 804          HG22      ILE 804  45.201 -16.633  -9.527
    8   HG22  ILE 804          HG23      ILE 804  43.478 -16.504  -9.146
    9   HD11  ILE 804          HD11      ILE 804  42.242 -15.310 -11.370
   10   HD13  ILE 804          HD12      ILE 804  40.972 -16.128 -12.276
   11   HD12  ILE 804          HD13      ILE 804  42.579 -15.971 -12.972

  No H/Q in entry =          11
  In of MODEL    5
    1    H    CYS 805           H        CYS 805  44.495 -20.001 -11.823
    2    HA   CYS 805           HA       CYS 805  43.932 -20.474 -14.661
    3    HB2  CYS 805           HB2      CYS 805  46.096 -21.410 -13.935
    4    HB3  CYS 805           HB3      CYS 805  45.245 -22.309 -12.686

  No H/Q in entry =           4
  In of MODEL    5
    1    H    VAL 806           H        VAL 806  41.991 -21.303 -15.028
    2    HA   VAL 806           HA       VAL 806  40.504 -22.443 -12.775
    3    HB   VAL 806           HB       VAL 806  39.385 -20.723 -14.967
    4   HG11  VAL 806          HG11      VAL 806  38.191 -21.642 -12.373
    5   HG13  VAL 806          HG12      VAL 806  37.758 -22.173 -13.992
    6   HG12  VAL 806          HG13      VAL 806  37.445 -20.504 -13.493
    7   HG21  VAL 806          HG21      VAL 806  40.868 -19.336 -13.686
    8   HG23  VAL 806          HG22      VAL 806  40.091 -19.838 -12.177
    9   HG22  VAL 806          HG23      VAL 806  39.196 -18.892 -13.373

  No H/Q in entry =           9
  In of MODEL    5
    1    H    GLU 807           H        GLU 807  39.661 -24.370 -13.254
    2    HA   GLU 807           HA       GLU 807  39.933 -25.506 -15.887
    3    HB2  GLU 807           HB2      GLU 807  40.456 -26.803 -13.877
    4    HB3  GLU 807           HB3      GLU 807  38.811 -26.594 -13.306
    5    HG2  GLU 807           HG2      GLU 807  38.028 -27.837 -15.302
    6    HG3  GLU 807           HG3      GLU 807  39.717 -28.135 -15.717

  No H/Q in entry =           6
  In of MODEL    5
    1    H    VAL 808           H        VAL 808  38.487 -25.025 -17.282
    2    HA   VAL 808           HA       VAL 808  35.635 -24.974 -16.599
    3    HB   VAL 808           HB       VAL 808  37.066 -23.044 -18.410
    4   HG11  VAL 808          HG11      VAL 808  34.861 -23.476 -19.172
    5   HG13  VAL 808          HG12      VAL 808  35.061 -21.823 -18.591
    6   HG12  VAL 808          HG13      VAL 808  34.198 -23.010 -17.590
    7   HG23  VAL 808          HG21      VAL 808  36.470 -21.317 -16.813
    8   HG22  VAL 808          HG22      VAL 808  37.667 -22.475 -16.236
    9   HG21  VAL 808          HG23      VAL 808  35.994 -22.584 -15.681

  No H/Q in entry =           9
  In of MODEL    5
    1    H    ASN 809           H        ASN 809  34.503 -26.132 -18.098
    2    HA   ASN 809           HA       ASN 809  33.967 -27.360 -19.883
    3    HB2  ASN 809           HB2      ASN 809  36.202 -25.820 -21.149
    4    HB3  ASN 809           HB3      ASN 809  35.269 -26.999 -22.048
    5   HD21  ASN 809          HD21      ASN 809  35.540 -24.115 -22.305
    6   HD22  ASN 809          HD22      ASN 809  33.926 -23.486 -22.200

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLY 810           H        GLY 810  36.369 -27.916 -17.996
    2    HA3  GLY 810           HA2      GLY 810  37.384 -30.059 -17.647
    3    HA2  GLY 810           HA3      GLY 810  37.261 -30.320 -19.392

  No H/Q in entry =           3
  In of MODEL    5
    1    H    LYS 811           H        LYS 811  38.221 -27.372 -19.487
    2    HA   LYS 811           HA       LYS 811  41.051 -28.118 -19.699
    3    HB2  LYS 811           HB2      LYS 811  39.460 -25.885 -20.901
    4    HB3  LYS 811           HB3      LYS 811  41.188 -26.130 -21.089
    5    HG2  LYS 811           HG2      LYS 811  40.837 -28.174 -22.264
    6    HG3  LYS 811           HG3      LYS 811  39.099 -28.107 -21.946
    7    HD2  LYS 811           HD2      LYS 811  39.670 -27.357 -24.214
    8    HD3  LYS 811           HD3      LYS 811  38.894 -26.100 -23.244
    9    HE2  LYS 811           HE2      LYS 811  41.081 -25.113 -22.764
   10    HE3  LYS 811           HE3      LYS 811  41.882 -26.346 -23.726
   11    HZ3  LYS 811           HZ1      LYS 811  41.626 -24.363 -25.043
   12    HZ2  LYS 811           HZ2      LYS 811  40.021 -24.222 -24.629
   13    HZ1  LYS 811           HZ3      LYS 811  40.492 -25.473 -25.638

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLU 812           H        GLU 812  42.584 -26.940 -18.725
    2    HA   GLU 812           HA       GLU 812  41.723 -25.030 -16.690
    3    HB2  GLU 812           HB2      GLU 812  44.556 -25.926 -17.194
    4    HB3  GLU 812           HB3      GLU 812  43.870 -25.280 -15.713
    5    HG2  GLU 812           HG2      GLU 812  43.904 -27.434 -15.085
    6    HG3  GLU 812           HG3      GLU 812  42.386 -27.500 -15.976

  No H/Q in entry =           6
  In of MODEL    5
    1    H    GLN 813           H        GLN 813  41.297 -23.209 -17.497
    2    HA   GLN 813           HA       GLN 813  43.015 -21.985 -19.535
    3    HB2  GLN 813           HB2      GLN 813  40.813 -22.207 -20.242
    4    HB3  GLN 813           HB3      GLN 813  40.144 -21.724 -18.693
    5    HG2  GLN 813           HG2      GLN 813  40.859 -19.425 -19.149
    6    HG3  GLN 813           HG3      GLN 813  41.499 -19.926 -20.715
    7   HE21  GLN 813          HE21      GLN 813  39.269 -18.063 -20.034
    8   HE22  GLN 813          HE22      GLN 813  37.886 -18.714 -20.838

  No H/Q in entry =           8
  In of MODEL    5
    1    H    THR 814           H        THR 814  44.015 -20.092 -19.126
    2    HA   THR 814           HA       THR 814  44.220 -19.139 -16.424
    3    HB   THR 814           HB       THR 814  45.296 -17.962 -18.972
    4    HG1  THR 814           HG1      THR 814  47.258 -19.156 -18.120
    5   HG21  THR 814          HG21      THR 814  46.215 -17.713 -16.091
    6   HG23  THR 814          HG22      THR 814  45.424 -16.454 -17.030
    7   HG22  THR 814          HG23      THR 814  47.037 -17.002 -17.476

  No H/Q in entry =           7
  In of MODEL    5
    1    H    MET 815           H        MET 815  43.053 -17.480 -15.627
    2    HA   MET 815           HA       MET 815  41.694 -15.704 -17.533
    3    HB2  MET 815           HB2      MET 815  40.581 -16.608 -14.891
    4    HB3  MET 815           HB3      MET 815  39.797 -15.542 -16.050
    5    HG2  MET 815           HG2      MET 815  39.952 -17.544 -17.656
    6    HG3  MET 815           HG3      MET 815  40.351 -18.421 -16.187
    7    HE2  MET 815           HE1      MET 815  38.373 -20.009 -16.819
    8    HE1  MET 815           HE2      MET 815  38.071 -18.950 -18.185
    9    HE3  MET 815           HE3      MET 815  36.724 -19.408 -17.127

  No H/Q in entry =           9
  In of MODEL    5
    1    H    SER 816           H        SER 816  41.133 -13.688 -16.570
    2    HA   SER 816           HA       SER 816  43.146 -12.702 -14.747
    3    HB2  SER 816           HB2      SER 816  40.717 -11.294 -15.893
    4    HB3  SER 816           HB3      SER 816  42.177 -10.546 -15.242
    5    HG   SER 816           HG       SER 816  43.304 -11.147 -16.978

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLU 817           H        GLU 817  42.557 -11.786 -12.744
    2    HA   GLU 817           HA       GLU 817  41.144 -13.306 -11.013
    3    HB2  GLU 817           HB2      GLU 817  42.811 -11.444 -10.686
    4    HB3  GLU 817           HB3      GLU 817  41.431 -10.365 -10.771
    5    HG2  GLU 817           HG2      GLU 817  40.456 -11.674  -8.844
    6    HG3  GLU 817           HG3      GLU 817  41.994 -12.475  -8.768

  No H/Q in entry =           6
  In of MODEL    5
    1    H    CYS 818           H        CYS 818  40.040 -10.137 -12.236
    2    HA   CYS 818           HA       CYS 818  37.462 -10.192 -11.152
    3    HB2  CYS 818           HB2      CYS 818  38.197  -8.884 -13.732
    4    HB3  CYS 818           HB3      CYS 818  36.965  -8.381 -12.580

  No H/Q in entry =           4
  In of MODEL    5
    1    H    GLU 819           H        GLU 819  38.764 -11.660 -13.934
    2    HA   GLU 819           HA       GLU 819  36.298 -12.006 -15.326
    3    HB2  GLU 819           HB2      GLU 819  38.385 -11.848 -16.523
    4    HB3  GLU 819           HB3      GLU 819  39.016 -13.243 -15.678
    5    HG2  GLU 819           HG2      GLU 819  37.521 -14.693 -16.818
    6    HG3  GLU 819           HG3      GLU 819  36.653 -13.324 -17.520

  No H/Q in entry =           6
  In of MODEL    5
    1    H    ALA 820           H        ALA 820  38.556 -14.350 -13.863
    2    HA   ALA 820           HA       ALA 820  36.928 -16.537 -13.925
    3    HB2  ALA 820           HB1      ALA 820  38.288 -17.431 -12.087
    4    HB3  ALA 820           HB2      ALA 820  38.945 -15.816 -11.825
    5    HB1  ALA 820           HB3      ALA 820  39.255 -16.661 -13.344

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLY 821           H        GLY 821  37.211 -14.021 -11.482
    2    HA3  GLY 821           HA2      GLY 821  35.485 -15.126  -9.553
    3    HA2  GLY 821           HA3      GLY 821  35.932 -13.429  -9.694

  No H/Q in entry =           3
  In of MODEL    5
    1    H    ALA 822           H        ALA 822  34.938 -12.996 -12.302
    2    HA   ALA 822           HA       ALA 822  32.291 -12.329 -11.727
    3    HB2  ALA 822           HB1      ALA 822  33.707 -11.120 -13.375
    4    HB3  ALA 822           HB2      ALA 822  32.152 -11.597 -14.040
    5    HB1  ALA 822           HB3      ALA 822  33.607 -12.515 -14.444

  No H/Q in entry =           5
  In of MODEL    5
    1    H    LEU 823           H        LEU 823  33.698 -14.939 -13.652
    2    HA   LEU 823           HA       LEU 823  31.239 -16.034 -14.415
    3    HB2  LEU 823           HB2      LEU 823  33.920 -17.378 -14.150
    4    HB3  LEU 823           HB3      LEU 823  32.507 -18.253 -14.671
    5    HG   LEU 823           HG       LEU 823  33.474 -17.810 -16.665
    6   HD12  LEU 823          HD11      LEU 823  31.851 -15.323 -16.366
    7   HD11  LEU 823          HD12      LEU 823  31.255 -16.923 -16.779
    8   HD13  LEU 823          HD13      LEU 823  32.349 -16.081 -17.878
    9   HD22  LEU 823          HD21      LEU 823  35.383 -16.570 -15.886
   10   HD21  LEU 823          HD22      LEU 823  34.395 -15.126 -15.683
   11   HD23  LEU 823          HD23      LEU 823  34.685 -15.773 -17.296

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ARG 824           H        ARG 824  33.219 -16.708 -11.515
    2    HA   ARG 824           HA       ARG 824  31.673 -18.754 -10.383
    3    HB2  ARG 824           HB2      ARG 824  33.166 -16.499  -9.061
    4    HB3  ARG 824           HB3      ARG 824  32.569 -17.926  -8.243
    5    HG2  ARG 824           HG2      ARG 824  34.117 -19.312  -9.452
    6    HG3  ARG 824           HG3      ARG 824  34.658 -17.923 -10.406
    7    HD2  ARG 824           HD2      ARG 824  36.172 -18.460  -8.528
    8    HD3  ARG 824           HD3      ARG 824  35.483 -16.839  -8.413
    9    HE   ARG 824           HE       ARG 824  34.102 -18.969  -7.057
   10   HH11  ARG 824          HH11      ARG 824  36.146 -16.087  -6.736
   11   HH12  ARG 824          HH12      ARG 824  36.029 -16.040  -5.024
   12   HH21  ARG 824          HH21      ARG 824  33.997 -18.850  -4.686
   13   HH22  ARG 824          HH22      ARG 824  34.885 -17.625  -3.873

  No H/Q in entry =          13
  In of MODEL    5
    1    H    CYS 825           H        CYS 825  31.526 -15.290 -10.019
    2    HA   CYS 825           HA       CYS 825  29.544 -15.144  -8.073
    3    HB2  CYS 825           HB2      CYS 825  31.187 -13.363  -8.796
    4    HB3  CYS 825           HB3      CYS 825  30.176 -13.107 -10.200

  No H/Q in entry =           4
  In of MODEL    5
    1    H    ARG 826           H        ARG 826  29.333 -15.083 -11.613
    2    HA   ARG 826           HA       ARG 826  26.555 -14.410 -11.578
    3    HB2  ARG 826           HB2      ARG 826  26.602 -14.615 -13.974
    4    HB3  ARG 826           HB3      ARG 826  27.984 -13.674 -13.409
    5    HG2  ARG 826           HG2      ARG 826  29.399 -15.625 -13.740
    6    HG3  ARG 826           HG3      ARG 826  27.996 -16.541 -14.300
    7    HD2  ARG 826           HD2      ARG 826  29.163 -14.077 -15.577
    8    HD3  ARG 826           HD3      ARG 826  29.225 -15.723 -16.207
    9    HE   ARG 826           HE       ARG 826  26.620 -15.398 -16.002
   10   HH11  ARG 826          HH11      ARG 826  28.997 -13.110 -17.295
   11   HH12  ARG 826          HH12      ARG 826  27.896 -12.410 -18.388
   12   HH21  ARG 826          HH21      ARG 826  25.134 -14.394 -17.431
   13   HH22  ARG 826          HH22      ARG 826  25.656 -13.136 -18.460

  No H/Q in entry =          13
  In of MODEL    5
    1    H    GLY 827           H        GLY 827  28.273 -17.459 -11.749
    2    HA3  GLY 827           HA2      GLY 827  26.902 -19.413 -11.089
    3    HA2  GLY 827           HA3      GLY 827  25.634 -18.745 -12.105

  No H/Q in entry =           3
  In of MODEL    5
    1    H    GLN 828           H        GLN 828  28.578 -18.277 -13.550
    2    HA   GLN 828           HA       GLN 828  28.093 -20.270 -15.536
    3    HB2  GLN 828           HB2      GLN 828  29.176 -18.131 -16.082
    4    HB3  GLN 828           HB3      GLN 828  30.529 -18.543 -15.041
    5    HG2  GLN 828           HG2      GLN 828  31.107 -18.879 -17.394
    6    HG3  GLN 828           HG3      GLN 828  31.091 -20.410 -16.527
    7   HE21  GLN 828          HE21      GLN 828  29.446 -18.435 -18.830
    8   HE22  GLN 828          HE22      GLN 828  28.482 -19.671 -19.528

  No H/Q in entry =           8
  In of MODEL    5
    1    H    SER 829           H        SER 829  29.392 -22.127 -15.967
    2    HA   SER 829           HA       SER 829  30.299 -23.355 -13.533
    3    HB2  SER 829           HB2      SER 829  30.082 -24.481 -16.321
    4    HB3  SER 829           HB3      SER 829  30.291 -25.403 -14.829
    5    HG   SER 829           HG       SER 829  28.306 -24.696 -14.130

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ILE 830           H        ILE 830  32.287 -22.932 -12.909
    2    HA   ILE 830           HA       ILE 830  34.595 -23.429 -14.646
    3    HB   ILE 830           HB       ILE 830  35.726 -21.412 -14.076
    4   HG12  ILE 830          HG12      ILE 830  34.970 -21.095 -11.750
    5   HG13  ILE 830          HG13      ILE 830  34.898 -19.593 -12.651
    6   HG21  ILE 830          HG21      ILE 830  32.988 -20.621 -14.971
    7   HG23  ILE 830          HG22      ILE 830  34.374 -21.078 -15.971
    8   HG22  ILE 830          HG23      ILE 830  34.413 -19.580 -15.039
    9   HD11  ILE 830          HD11      ILE 830  32.565 -21.360 -11.972
   10   HD13  ILE 830          HD12      ILE 830  32.488 -19.820 -12.835
   11   HD12  ILE 830          HD13      ILE 830  33.034 -19.872 -11.157

  No H/Q in entry =          11
  In of MODEL    5
    1    H    SER 831           H        SER 831  36.434 -23.935 -13.271
    2    HA   SER 831           HA       SER 831  35.803 -24.132 -10.444
    3    HB2  SER 831           HB2      SER 831  37.055 -26.143 -12.274
    4    HB3  SER 831           HB3      SER 831  37.028 -26.261 -10.516
    5    HG   SER 831           HG       SER 831  34.608 -25.680 -11.553

  No H/Q in entry =           5
  In of MODEL    5
    1    H    VAL 832           H        VAL 832  37.237 -22.668  -9.525
    2    HA   VAL 832           HA       VAL 832  39.729 -22.035 -10.778
    3    HB   VAL 832           HB       VAL 832  38.892 -21.451  -7.910
    4   HG12  VAL 832          HG11      VAL 832  41.041 -20.188  -9.617
    5   HG11  VAL 832          HG12      VAL 832  41.305 -21.273  -8.260
    6   HG13  VAL 832          HG13      VAL 832  40.592 -19.680  -7.987
    7   HG23  VAL 832          HG21      VAL 832  38.277 -19.213  -8.725
    8   HG22  VAL 832          HG22      VAL 832  37.304 -20.473  -9.486
    9   HG21  VAL 832          HG23      VAL 832  38.631 -19.726 -10.376

  No H/Q in entry =           9
  In of MODEL    5
    1    H    THR 833           H        THR 833  41.234 -23.509 -10.923
    2    HA   THR 833           HA       THR 833  41.448 -25.532  -8.871
    3    HB   THR 833           HB       THR 833  42.991 -26.529 -10.653
    4    HG1  THR 833           HG1      THR 833  43.075 -25.499 -12.532
    5   HG22  THR 833          HG21      THR 833  40.086 -26.061 -11.275
    6   HG21  THR 833          HG22      THR 833  40.685 -27.252 -10.129
    7   HG23  THR 833          HG23      THR 833  41.062 -27.417 -11.852

  No H/Q in entry =           7
  In of MODEL    5
    1    H    SER 834           H        SER 834  43.211 -22.880 -10.247
    2    HA   SER 834           HA       SER 834  45.216 -23.250  -8.193
    3    HB2  SER 834           HB2      SER 834  45.874 -23.088 -11.122
    4    HB3  SER 834           HB3      SER 834  47.061 -22.963  -9.829
    5    HG   SER 834           HG       SER 834  45.534 -25.129  -9.453

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ILE 835           H        ILE 835  46.254 -21.432  -7.608
    2    HA   ILE 835           HA       ILE 835  44.982 -18.882  -8.315
    3    HB   ILE 835           HB       ILE 835  46.163 -17.976  -6.433
    4   HG12  ILE 835          HG12      ILE 835  47.718 -20.599  -6.332
    5   HG13  ILE 835          HG13      ILE 835  48.335 -19.022  -6.825
    6   HG21  ILE 835          HG21      ILE 835  44.193 -19.382  -5.939
    7   HG23  ILE 835          HG22      ILE 835  45.369 -19.433  -4.626
    8   HG22  ILE 835          HG23      ILE 835  45.245 -20.785  -5.753
    9   HD11  ILE 835          HD11      ILE 835  47.321 -19.724  -4.132
   10   HD13  ILE 835          HD12      ILE 835  48.024 -18.180  -4.623
   11   HD12  ILE 835          HD13      ILE 835  49.017 -19.644  -4.604

  No H/Q in entry =          11
  In of MODEL    5
    1    H    ARG 836           H        ARG 836  47.437 -20.758  -9.343
    2    HA   ARG 836           HA       ARG 836  49.239 -18.639 -10.143
    3    HB2  ARG 836           HB2      ARG 836  49.354 -21.616 -10.575
    4    HB3  ARG 836           HB3      ARG 836  50.622 -20.465 -10.981
    5    HG2  ARG 836           HG2      ARG 836  50.789 -19.856  -8.624
    6    HG3  ARG 836           HG3      ARG 836  49.570 -21.068  -8.242
    7    HD2  ARG 836           HD2      ARG 836  52.272 -21.526  -9.461
    8    HD3  ARG 836           HD3      ARG 836  51.714 -21.884  -7.821
    9    HE   ARG 836           HE       ARG 836  50.070 -23.229  -9.673
   10   HH11  ARG 836          HH11      ARG 836  53.363 -23.403  -8.410
   11   HH12  ARG 836          HH12      ARG 836  53.569 -25.038  -8.823
   12   HH21  ARG 836          HH21      ARG 836  50.368 -25.469 -10.233
   13   HH22  ARG 836          HH22      ARG 836  51.829 -26.246  -9.868

  No H/Q in entry =          13
  In of MODEL    5
    1    HA   PRO 837           HA       PRO 837  47.138 -18.707 -14.124
    2    HB2  PRO 837           HB2      PRO 837  49.113 -17.691 -15.704
    3    HB3  PRO 837           HB3      PRO 837  48.133 -16.688 -14.629
    4    HG2  PRO 837           HG2      PRO 837  50.897 -17.754 -14.227
    5    HG3  PRO 837           HG3      PRO 837  50.235 -16.162 -13.819
    6    HD2  PRO 837           HD2      PRO 837  50.582 -18.143 -11.994
    7    HD3  PRO 837           HD3      PRO 837  49.308 -16.912 -11.855

  No H/Q in entry =           7
  In of MODEL    5
    1    H    CYS 838           H        CYS 838  47.072 -20.095 -15.914
    2    HA   CYS 838           HA       CYS 838  49.075 -22.173 -15.860
    3    HB2  CYS 838           HB2      CYS 838  46.290 -22.044 -16.942
    4    HB3  CYS 838           HB3      CYS 838  47.408 -23.216 -17.625

  No H/Q in entry =           4
  In of MODEL    5
    1    H    ALA 839           H        ALA 839  49.495 -23.118 -18.180
    2    HA   ALA 839           HA       ALA 839  50.743 -21.001 -19.675
    3    HB3  ALA 839           HB1      ALA 839  51.766 -22.857 -20.906
    4    HB2  ALA 839           HB2      ALA 839  50.730 -23.994 -20.040
    5    HB1  ALA 839           HB3      ALA 839  51.939 -23.062 -19.164

  No H/Q in entry =           5
  In of MODEL    5
    1    H    ALA 840           H        ALA 840  47.918 -21.011 -19.677
    2    HA   ALA 840           HA       ALA 840  47.024 -21.982 -22.264
    3    HB2  ALA 840           HB1      ALA 840  45.515 -22.153 -20.340
    4    HB3  ALA 840           HB2      ALA 840  44.831 -21.117 -21.590
    5    HB1  ALA 840           HB3      ALA 840  45.564 -20.401 -20.154

  No H/Q in entry =           5
  In of MODEL    5
    1    H    GLU 841           H        GLU 841  48.609 -19.323 -21.074
    2    HA   GLU 841           HA       GLU 841  47.435 -17.412 -22.948
    3    HB2  GLU 841           HB2      GLU 841  49.634 -17.050 -20.935
    4    HB3  GLU 841           HB3      GLU 841  48.925 -15.789 -21.922
    5    HG2  GLU 841           HG2      GLU 841  46.812 -16.102 -20.746
    6    HG3  GLU 841           HG3      GLU 841  47.572 -17.358 -19.757

  No H/Q in entry =           6
  In of MODEL    5
    1    H    THR 842           H        THR 842  50.644 -18.113 -21.980
    2    HA   THR 842           HA       THR 842  51.670 -17.368 -24.566
    3    HB   THR 842           HB       THR 842  53.216 -18.325 -22.189
    4    HG1  THR 842           HG1      THR 842  52.655 -16.505 -21.235
    5   HG21  THR 842          HG21      THR 842  53.930 -16.455 -24.467
    6   HG23  THR 842          HG22      THR 842  54.499 -18.113 -24.267
    7   HG22  THR 842          HG23      THR 842  54.998 -16.866 -23.126

  No H/Q in entry =           7
  In of MODEL    5
    1    H    GLN 843           H        GLN 843  50.534 -19.129 -25.387
    2    HA   GLN 843           HA       GLN 843  52.033 -20.980 -26.669
    3    HB2  GLN 843           HB2      GLN 843  50.827 -22.122 -24.171
    4    HB3  GLN 843           HB3      GLN 843  50.669 -23.079 -25.634
    5    HG2  GLN 843           HG2      GLN 843  53.076 -23.162 -25.875
    6    HG3  GLN 843           HG3      GLN 843  53.274 -22.094 -24.492
    7   HE21  GLN 843          HE21      GLN 843  52.963 -22.889 -22.464
    8   HE22  GLN 843          HE22      GLN 843  52.873 -24.569 -22.105

  No H/Q in entry =           8
  In of MODEL    6
    1    H1   GLY 689           H3       GLY 689  66.071  -7.405 -20.339
    2    H2   GLY 689           H2       GLY 689  67.636  -7.445 -20.971
    3    H3   GLY 689           H1       GLY 689  67.312  -6.503 -19.609
    4    HA2  GLY 689           HA2      GLY 689  67.535  -5.184 -21.626
    5    HA3  GLY 689           HA3      GLY 689  65.928  -5.068 -20.912

  No H/Q in entry =           5
  In of MODEL    6
    1    H    SER 690           H        SER 690  64.185  -6.106 -21.880
    2    HA   SER 690           HA       SER 690  64.503  -6.391 -24.729
    3    HB2  SER 690           HB2      SER 690  64.838  -8.690 -23.791
    4    HB3  SER 690           HB3      SER 690  63.252  -8.575 -23.032
    5    HG   SER 690           HG       SER 690  63.485  -9.642 -25.182

  No H/Q in entry =           5
  In of MODEL    6
    1    H    HIS 691           H        HIS 691  62.698  -5.658 -25.719
    2    HA   HIS 691           HA       HIS 691  60.557  -4.655 -24.027
    3    HB2  HIS 691           HB2      HIS 691  61.553  -3.185 -25.787
    4    HB3  HIS 691           HB3      HIS 691  60.990  -4.310 -27.011
    5    HD1  HIS 691           HD1      HIS 691  59.690  -1.829 -24.491
    6    HD2  HIS 691           HD2      HIS 691  58.368  -3.900 -27.834
    7    HE1  HIS 691           HE1      HIS 691  57.487  -0.818 -25.065
    8    HE2  HIS 691           HE2      HIS 691  56.916  -1.823 -27.272

  No H/Q in entry =           8
  In of MODEL    6
    1    H    MET 692           H        MET 692  59.598  -6.554 -23.440
    2    HA   MET 692           HA       MET 692  58.842  -8.617 -25.228
    3    HB2  MET 692           HB2      MET 692  59.144  -9.076 -22.874
    4    HB3  MET 692           HB3      MET 692  57.881  -7.930 -22.450
    5    HG2  MET 692           HG2      MET 692  56.239  -9.356 -23.603
    6    HG3  MET 692           HG3      MET 692  57.518 -10.520 -23.934
    7    HE1  MET 692           HE1      MET 692  54.745 -11.155 -22.481
    8    HE3  MET 692           HE2      MET 692  55.279 -12.238 -21.200
    9    HE2  MET 692           HE3      MET 692  55.960 -12.385 -22.820

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ASN 693           H        ASN 693  57.029  -6.043 -23.662
    2    HA   ASN 693           HA       ASN 693  54.955  -6.237 -25.710
    3    HB2  ASN 693           HB2      ASN 693  53.188  -6.184 -23.969
    4    HB3  ASN 693           HB3      ASN 693  54.232  -7.564 -23.706
    5   HD21  ASN 693          HD21      ASN 693  52.464  -6.129 -21.892
    6   HD22  ASN 693          HD22      ASN 693  53.459  -5.654 -20.562

  No H/Q in entry =           6
  In of MODEL    6
    1    HA   PRO 694           HA       PRO 694  54.864  -1.702 -25.567
    2    HB2  PRO 694           HB2      PRO 694  52.330  -1.324 -24.354
    3    HB3  PRO 694           HB3      PRO 694  52.689  -1.282 -26.084
    4    HG2  PRO 694           HG2      PRO 694  51.628  -3.504 -24.410
    5    HG3  PRO 694           HG3      PRO 694  51.277  -3.102 -26.103
    6    HD2  PRO 694           HD2      PRO 694  52.836  -5.159 -25.555
    7    HD3  PRO 694           HD3      PRO 694  53.270  -4.043 -26.858

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LEU 695           H        LEU 695  55.109   0.016 -24.065
    2    HA   LEU 695           HA       LEU 695  56.179  -0.807 -21.574
    3    HB2  LEU 695           HB2      LEU 695  57.001   1.174 -22.776
    4    HB3  LEU 695           HB3      LEU 695  55.462   1.974 -22.519
    5    HG   LEU 695           HG       LEU 695  55.889   1.972 -20.083
    6   HD11  LEU 695          HD11      LEU 695  58.578   0.837 -20.843
    7   HD13  LEU 695          HD12      LEU 695  57.317   0.022 -19.914
    8   HD12  LEU 695          HD13      LEU 695  58.126   1.436 -19.247
    9   HD22  LEU 695          HD21      LEU 695  56.507   3.911 -21.419
   10   HD21  LEU 695          HD22      LEU 695  58.088   3.199 -21.742
   11   HD23  LEU 695          HD23      LEU 695  57.651   3.669 -20.101

  No H/Q in entry =          11
  In of MODEL    6
    1    H    THR 696           H        THR 696  55.209  -1.093 -19.689
    2    HA   THR 696           HA       THR 696  52.619   0.117 -19.235
    3    HB   THR 696           HB       THR 696  52.128  -2.094 -20.113
    4    HG1  THR 696           HG1      THR 696  50.686  -2.409 -18.674
    5   HG22  THR 696          HG21      THR 696  53.919  -3.189 -17.938
    6   HG21  THR 696          HG22      THR 696  54.256  -3.207 -19.668
    7   HG23  THR 696          HG23      THR 696  52.914  -4.154 -19.021

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLN 697           H        GLN 697  52.179   0.409 -17.054
    2    HA   GLN 697           HA       GLN 697  54.428  -0.172 -15.311
    3    HB2  GLN 697           HB2      GLN 697  53.828   1.860 -13.946
    4    HB3  GLN 697           HB3      GLN 697  54.469   2.209 -15.533
    5    HG2  GLN 697           HG2      GLN 697  51.524   2.253 -14.888
    6    HG3  GLN 697           HG3      GLN 697  52.569   3.655 -14.726
    7   HE21  GLN 697          HE21      GLN 697  54.125   3.005 -17.166
    8   HE22  GLN 697          HE22      GLN 697  53.091   3.352 -18.481

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ALA 698           H        ALA 698  51.704  -1.339 -16.043
    2    HA   ALA 698           HA       ALA 698  50.418  -1.674 -13.481
    3    HB1  ALA 698           HB1      ALA 698  49.158  -1.925 -15.602
    4    HB3  ALA 698           HB2      ALA 698  49.097  -3.382 -14.612
    5    HB2  ALA 698           HB3      ALA 698  50.173  -3.309 -16.006

  No H/Q in entry =           5
  In of MODEL    6
    1    H    VAL 699           H        VAL 699  52.188  -3.664 -15.529
    2    HA   VAL 699           HA       VAL 699  53.426  -5.032 -13.249
    3    HB   VAL 699           HB       VAL 699  52.084  -6.382 -15.588
    4   HG13  VAL 699          HG11      VAL 699  52.827  -8.551 -14.589
    5   HG12  VAL 699          HG12      VAL 699  53.722  -7.657 -13.359
    6   HG11  VAL 699          HG13      VAL 699  54.201  -7.546 -15.050
    7   HG22  VAL 699          HG21      VAL 699  50.722  -7.552 -13.887
    8   HG21  VAL 699          HG22      VAL 699  50.512  -5.800 -13.850
    9   HG23  VAL 699          HG23      VAL 699  51.512  -6.593 -12.635

  No H/Q in entry =           9
  In of MODEL    6
    1    HA   PRO 700           HA       PRO 700  56.667  -4.315 -16.345
    2    HB2  PRO 700           HB2      PRO 700  58.635  -3.713 -14.557
    3    HB3  PRO 700           HB3      PRO 700  57.455  -2.529 -15.113
    4    HG2  PRO 700           HG2      PRO 700  57.685  -3.801 -12.480
    5    HG3  PRO 700           HG3      PRO 700  56.796  -2.346 -12.949
    6    HD2  PRO 700           HD2      PRO 700  55.781  -5.027 -12.530
    7    HD3  PRO 700           HD3      PRO 700  54.878  -3.541 -12.896

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LYS 701           H        LYS 701  58.712  -5.338 -13.788
    2    HA   LYS 701           HA       LYS 701  58.562  -8.060 -14.808
    3    HB2  LYS 701           HB2      LYS 701  60.999  -6.421 -14.286
    4    HB3  LYS 701           HB3      LYS 701  61.109  -8.185 -14.298
    5    HG2  LYS 701           HG2      LYS 701  60.265  -6.362 -16.558
    6    HG3  LYS 701           HG3      LYS 701  61.781  -7.258 -16.447
    7    HD2  LYS 701           HD2      LYS 701  59.001  -8.477 -16.692
    8    HD3  LYS 701           HD3      LYS 701  60.191  -8.354 -17.973
    9    HE2  LYS 701           HE2      LYS 701  61.695  -9.849 -16.790
   10    HE3  LYS 701           HE3      LYS 701  60.603  -9.893 -15.409
   11    HZ3  LYS 701           HZ1      LYS 701  58.943 -10.979 -16.792
   12    HZ2  LYS 701           HZ2      LYS 701  60.358 -11.879 -16.822
   13    HZ1  LYS 701           HZ3      LYS 701  59.945 -10.912 -18.126

  No H/Q in entry =          13
  In of MODEL    6
    1    H    CYS 702           H        CYS 702  57.592  -6.569 -12.488
    2    HA   CYS 702           HA       CYS 702  58.362  -8.629 -10.535
    3    HB2  CYS 702           HB2      CYS 702  56.911  -6.124  -9.615
    4    HB3  CYS 702           HB3      CYS 702  57.957  -7.195  -8.756

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLN 703           H        GLN 703  56.659  -9.835  -9.824
    2    HA   GLN 703           HA       GLN 703  54.348  -9.728 -11.538
    3    HB2  GLN 703           HB2      GLN 703  55.162 -11.560  -9.317
    4    HB3  GLN 703           HB3      GLN 703  53.672 -11.737 -10.233
    5    HG2  GLN 703           HG2      GLN 703  56.448 -11.789 -11.402
    6    HG3  GLN 703           HG3      GLN 703  55.454 -13.205 -11.053
    7   HE21  GLN 703          HE21      GLN 703  55.917 -10.486 -13.139
    8   HE22  GLN 703          HE22      GLN 703  54.808 -10.974 -14.365

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ARG 704           H        ARG 704  52.219 -10.260 -10.390
    2    HA   ARG 704           HA       ARG 704  51.488  -7.824  -9.194
    3    HB2  ARG 704           HB2      ARG 704  50.032 -10.325  -9.835
    4    HB3  ARG 704           HB3      ARG 704  49.245  -9.066  -8.890
    5    HG2  ARG 704           HG2      ARG 704  49.491  -7.498 -10.589
    6    HG3  ARG 704           HG3      ARG 704  50.561  -8.553 -11.537
    7    HD2  ARG 704           HD2      ARG 704  48.731 -10.042 -11.948
    8    HD3  ARG 704           HD3      ARG 704  47.714  -9.118 -10.828
    9    HE   ARG 704           HE       ARG 704  48.008  -7.240 -12.406
   10   HH11  ARG 704          HH11      ARG 704  48.351 -10.536 -13.708
   11   HH12  ARG 704          HH12      ARG 704  47.570 -10.165 -15.160
   12   HH21  ARG 704          HH21      ARG 704  46.972  -6.768 -14.374
   13   HH22  ARG 704          HH22      ARG 704  46.800  -7.963 -15.598

  No H/Q in entry =          13
  In of MODEL    6
    1    H    TRP 705           H        TRP 705  52.677 -10.588  -7.707
    2    HA   TRP 705           HA       TRP 705  51.544  -9.779  -5.140
    3    HB2  TRP 705           HB2      TRP 705  52.642 -11.932  -4.319
    4    HB3  TRP 705           HB3      TRP 705  51.305 -12.108  -5.452
    5    HD1  TRP 705           HD1      TRP 705  55.048 -12.760  -5.111
    6    HE1  TRP 705           HE1      TRP 705  55.825 -14.150  -7.119
    7    HE3  TRP 705           HE3      TRP 705  50.800 -12.564  -7.952
    8    HZ2  TRP 705           HZ2      TRP 705  54.775 -15.080  -9.567
    9    HZ3  TRP 705           HZ3      TRP 705  50.778 -13.719 -10.108
   10    HH2  TRP 705           HH2      TRP 705  52.720 -14.963 -10.901

  No H/Q in entry =          10
  In of MODEL    6
    1    H    GLU 706           H        GLU 706  53.894  -8.828  -6.988
    2    HA   GLU 706           HA       GLU 706  55.816  -8.450  -4.839
    3    HB2  GLU 706           HB2      GLU 706  56.231  -8.629  -7.828
    4    HB3  GLU 706           HB3      GLU 706  57.483  -8.153  -6.658
    5    HG2  GLU 706           HG2      GLU 706  57.252 -10.398  -5.671
    6    HG3  GLU 706           HG3      GLU 706  56.087 -10.799  -6.935

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS 707           H        LYS 707  56.842  -6.455  -4.859
    2    HA   LYS 707           HA       LYS 707  55.293  -4.285  -6.111
    3    HB2  LYS 707           HB2      LYS 707  56.741  -4.323  -3.466
    4    HB3  LYS 707           HB3      LYS 707  56.272  -2.845  -4.267
    5    HG2  LYS 707           HG2      LYS 707  53.909  -3.557  -4.084
    6    HG3  LYS 707           HG3      LYS 707  54.445  -4.973  -3.167
    7    HD2  LYS 707           HD2      LYS 707  55.498  -3.533  -1.503
    8    HD3  LYS 707           HD3      LYS 707  55.039  -2.112  -2.432
    9    HE2  LYS 707           HE2      LYS 707  53.100  -4.055  -1.213
   10    HE3  LYS 707           HE3      LYS 707  53.633  -2.568  -0.438
   11    HZ3  LYS 707           HZ1      LYS 707  51.511  -2.261  -1.492
   12    HZ2  LYS 707           HZ2      LYS 707  52.107  -2.728  -3.005
   13    HZ1  LYS 707           HZ3      LYS 707  52.647  -1.316  -2.277

  No H/Q in entry =          13
  In of MODEL    6
    1    H    LEU 708           H        LEU 708  56.429  -2.927  -7.304
    2    HA   LEU 708           HA       LEU 708  59.302  -3.298  -7.486
    3    HB2  LEU 708           HB2      LEU 708  58.052  -3.026  -9.583
    4    HB3  LEU 708           HB3      LEU 708  57.400  -1.503  -9.019
    5    HG   LEU 708           HG       LEU 708  59.678  -0.532  -9.063
    6   HD11  LEU 708          HD11      LEU 708  60.469  -3.160 -10.296
    7   HD13  LEU 708          HD12      LEU 708  60.988  -2.537  -8.731
    8   HD12  LEU 708          HD13      LEU 708  61.476  -1.716 -10.213
    9   HD22  LEU 708          HD21      LEU 708  58.198  -0.247 -10.972
   10   HD21  LEU 708          HD22      LEU 708  58.775  -1.763 -11.664
   11   HD23  LEU 708          HD23      LEU 708  59.873  -0.393 -11.500

  No H/Q in entry =          11
  In of MODEL    6
    1    H    GLN 709           H        GLN 709  60.183  -2.431  -5.691
    2    HA   GLN 709           HA       GLN 709  59.678   0.412  -5.265
    3    HB2  GLN 709           HB2      GLN 709  59.465   0.225  -2.914
    4    HB3  GLN 709           HB3      GLN 709  58.484  -1.092  -3.520
    5    HG2  GLN 709           HG2      GLN 709  60.446  -2.626  -3.072
    6    HG3  GLN 709           HG3      GLN 709  61.243  -1.247  -2.388
    7   HE21  GLN 709          HE21      GLN 709  61.403  -2.291  -0.419
    8   HE22  GLN 709          HE22      GLN 709  60.101  -2.376   0.695

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ASN 710           H        ASN 710  61.498   1.544  -4.856
    2    HA   ASN 710           HA       ASN 710  63.779   2.026  -4.777
    3    HB2  ASN 710           HB2      ASN 710  63.427   0.622  -2.550
    4    HB3  ASN 710           HB3      ASN 710  64.080  -0.682  -3.488
    5   HD21  ASN 710          HD21      ASN 710  65.709  -0.813  -1.940
    6   HD22  ASN 710          HD22      ASN 710  67.037   0.275  -2.009

  No H/Q in entry =           6
  In of MODEL    6
    1    H    SER 711           H        SER 711  62.660   0.739  -7.027
    2    HA   SER 711           HA       SER 711  63.121  -0.129  -8.959
    3    HB2  SER 711           HB2      SER 711  65.460   0.128  -9.880
    4    HB3  SER 711           HB3      SER 711  64.808   1.557  -9.066
    5    HG   SER 711           HG       SER 711  66.005   0.306  -7.202

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ARG 712           H        ARG 712  63.140  -1.964  -6.575
    2    HA   ARG 712           HA       ARG 712  64.199  -4.255  -8.055
    3    HB2  ARG 712           HB2      ARG 712  64.852  -5.346  -5.960
    4    HB3  ARG 712           HB3      ARG 712  65.714  -3.834  -6.167
    5    HG2  ARG 712           HG2      ARG 712  64.291  -2.749  -4.559
    6    HG3  ARG 712           HG3      ARG 712  63.284  -4.190  -4.433
    7    HD2  ARG 712           HD2      ARG 712  65.268  -5.437  -3.601
    8    HD3  ARG 712           HD3      ARG 712  66.192  -3.938  -3.631
    9    HE   ARG 712           HE       ARG 712  64.336  -3.145  -2.020
   10   HH11  ARG 712          HH11      ARG 712  65.636  -6.451  -2.093
   11   HH12  ARG 712          HH12      ARG 712  65.334  -6.757  -0.454
   12   HH21  ARG 712          HH21      ARG 712  63.937  -3.591   0.263
   13   HH22  ARG 712          HH22      ARG 712  64.336  -5.108   0.894

  No H/Q in entry =          13
  In of MODEL    6
    1    H    CYS 713           H        CYS 713  63.099  -6.312  -7.428
    2    HA   CYS 713           HA       CYS 713  60.271  -5.734  -6.972
    3    HB2  CYS 713           HB2      CYS 713  61.569  -8.249  -8.046
    4    HB3  CYS 713           HB3      CYS 713  59.844  -7.929  -7.967

  No H/Q in entry =           4
  In of MODEL    6
    1    H    VAL 714           H        VAL 714  59.591  -6.065  -5.011
    2    HA   VAL 714           HA       VAL 714  60.789  -8.223  -3.393
    3    HB   VAL 714           HB       VAL 714  60.201  -6.938  -1.370
    4   HG11  VAL 714          HG11      VAL 714  61.877  -5.359  -3.298
    5   HG13  VAL 714          HG12      VAL 714  62.434  -6.668  -2.256
    6   HG12  VAL 714          HG13      VAL 714  61.866  -5.156  -1.549
    7   HG23  VAL 714          HG21      VAL 714  59.385  -4.741  -3.280
    8   HG22  VAL 714          HG22      VAL 714  59.491  -4.582  -1.528
    9   HG21  VAL 714          HG23      VAL 714  58.307  -5.677  -2.248

  No H/Q in entry =           9
  In of MODEL    6
    1    H    CYS 715           H        CYS 715  59.089  -8.856  -1.603
    2    HA   CYS 715           HA       CYS 715  56.671  -9.324  -3.108
    3    HB2  CYS 715           HB2      CYS 715  57.681 -10.458  -0.499
    4    HB3  CYS 715           HB3      CYS 715  56.044 -10.744  -1.074

  No H/Q in entry =           4
  In of MODEL    6
    1    H    LYS 716           H        LYS 716  54.680  -8.808  -2.413
    2    HA   LYS 716           HA       LYS 716  54.445  -6.316  -1.027
    3    HB2  LYS 716           HB2      LYS 716  53.195  -6.814  -3.073
    4    HB3  LYS 716           HB3      LYS 716  52.499  -8.239  -2.352
    5    HG2  LYS 716           HG2      LYS 716  50.917  -7.042  -1.216
    6    HG3  LYS 716           HG3      LYS 716  51.885  -5.575  -1.161
    7    HD2  LYS 716           HD2      LYS 716  49.959  -5.375  -2.734
    8    HD3  LYS 716           HD3      LYS 716  51.520  -5.196  -3.527
    9    HE2  LYS 716           HE2      LYS 716  51.352  -7.524  -4.298
   10    HE3  LYS 716           HE3      LYS 716  49.779  -7.658  -3.512
   11    HZ2  LYS 716           HZ1      LYS 716  49.715  -7.159  -5.938
   12    HZ1  LYS 716           HZ2      LYS 716  50.362  -5.648  -5.641
   13    HZ3  LYS 716           HZ3      LYS 716  48.863  -6.061  -5.001

  No H/Q in entry =          13
  In of MODEL    6
    1    H    MET 717           H        MET 717  52.212  -6.500   0.609
    2    HA   MET 717           HA       MET 717  52.912  -8.674   2.439
    3    HB2  MET 717           HB2      MET 717  51.811  -5.928   3.061
    4    HB3  MET 717           HB3      MET 717  51.942  -7.213   4.241
    5    HG2  MET 717           HG2      MET 717  54.262  -6.020   2.734
    6    HG3  MET 717           HG3      MET 717  53.791  -5.584   4.374
    7    HE2  MET 717           HE1      MET 717  54.557  -8.868   6.364
    8    HE1  MET 717           HE2      MET 717  53.010  -8.313   5.730
    9    HE3  MET 717           HE3      MET 717  54.116  -7.168   6.489

  No H/Q in entry =           9
  In of MODEL    6
    1    HA   PRO 718           HA       PRO 718  49.055 -10.519   1.689
    2    HB2  PRO 718           HB2      PRO 718  48.423 -11.506   4.189
    3    HB3  PRO 718           HB3      PRO 718  49.547 -12.263   3.060
    4    HG2  PRO 718           HG2      PRO 718  50.118 -10.474   5.385
    5    HG3  PRO 718           HG3      PRO 718  50.959 -11.950   4.877
    6    HD2  PRO 718           HD2      PRO 718  51.968  -9.538   4.358
    7    HD3  PRO 718           HD3      PRO 718  52.105 -10.854   3.178

  No H/Q in entry =           7
  In of MODEL    6
    1    H    TYR 719           H        TYR 719  49.158  -8.145   4.254
    2    HA   TYR 719           HA       TYR 719  46.269  -8.030   4.441
    3    HB2  TYR 719           HB2      TYR 719  46.554  -6.346   6.155
    4    HB3  TYR 719           HB3      TYR 719  47.691  -7.651   6.455
    5    HD1  TYR 719           HD1      TYR 719  50.133  -7.280   5.876
    6    HD2  TYR 719           HD2      TYR 719  47.267  -4.139   5.806
    7    HE1  TYR 719           HE1      TYR 719  51.938  -5.626   5.966
    8    HE2  TYR 719           HE2      TYR 719  49.071  -2.483   5.882
    9    HH   TYR 719           HH       TYR 719  51.416  -2.396   6.664

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLU 720           H        GLU 720  48.643  -6.646   2.483
    2    HA   GLU 720           HA       GLU 720  47.428  -4.133   1.826
    3    HB2  GLU 720           HB2      GLU 720  49.786  -4.563   1.398
    4    HB3  GLU 720           HB3      GLU 720  49.401  -5.965   0.429
    5    HG2  GLU 720           HG2      GLU 720  50.038  -4.344  -1.088
    6    HG3  GLU 720           HG3      GLU 720  48.277  -4.329  -1.179

  No H/Q in entry =           6
  In of MODEL    6
    1    H    CYS 721           H        CYS 721  47.235  -7.416   0.857
    2    HA   CYS 721           HA       CYS 721  45.889  -7.187  -1.590
    3    HB2  CYS 721           HB2      CYS 721  46.013  -9.462   0.345
    4    HB3  CYS 721           HB3      CYS 721  45.520  -9.568  -1.334

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLY 722           H        GLY 722  44.079  -5.989  -1.460
    2    HA3  GLY 722           HA2      GLY 722  41.908  -6.948   0.252
    3    HA2  GLY 722           HA3      GLY 722  41.943  -5.389  -0.570

  No H/Q in entry =           3
  In of MODEL    6
    1    HA   PRO 723           HA       PRO 723  39.801  -7.204  -3.986
    2    HB2  PRO 723           HB2      PRO 723  41.471  -5.929  -6.013
    3    HB3  PRO 723           HB3      PRO 723  39.806  -5.554  -5.567
    4    HG2  PRO 723           HG2      PRO 723  41.871  -3.881  -5.030
    5    HG3  PRO 723           HG3      PRO 723  40.434  -3.999  -4.001
    6    HD2  PRO 723           HD2      PRO 723  43.140  -5.229  -3.619
    7    HD3  PRO 723           HD3      PRO 723  42.083  -4.439  -2.428

  No H/Q in entry =           7
  In of MODEL    6
    1    H    SER 724           H        SER 724  40.281  -9.393  -4.002
    2    HA   SER 724           HA       SER 724  42.037 -10.364  -6.018
    3    HB2  SER 724           HB2      SER 724  42.246 -11.107  -3.110
    4    HB3  SER 724           HB3      SER 724  43.152 -11.867  -4.433
    5    HG   SER 724           HG       SER 724  43.512  -9.290  -4.550

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU 725           H        LEU 725  41.582 -12.704  -6.137
    2    HA   LEU 725           HA       LEU 725  38.771 -13.203  -5.793
    3    HB2  LEU 725           HB2      LEU 725  40.239 -13.959  -7.749
    4    HB3  LEU 725           HB3      LEU 725  40.891 -15.148  -6.633
    5    HG   LEU 725           HG       LEU 725  38.566 -15.911  -6.328
    6   HD12  LEU 725          HD11      LEU 725  37.021 -15.537  -8.189
    7   HD11  LEU 725          HD12      LEU 725  38.140 -14.334  -8.835
    8   HD13  LEU 725          HD13      LEU 725  37.367 -14.074  -7.272
    9   HD21  LEU 725          HD21      LEU 725  39.889 -16.276  -9.004
   10   HD23  LEU 725          HD22      LEU 725  38.636 -17.331  -8.349
   11   HD22  LEU 725          HD23      LEU 725  40.201 -17.213  -7.541

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ASP 726           H        ASP 726  37.918 -14.191  -4.134
    2    HA   ASP 726           HA       ASP 726  39.527 -14.992  -1.906
    3    HB2  ASP 726           HB2      ASP 726  36.527 -15.183  -2.330
    4    HB3  ASP 726           HB3      ASP 726  37.350 -15.515  -0.815

  No H/Q in entry =           4
  In of MODEL    6
    1    H    VAL 727           H        VAL 727  40.243 -16.939  -1.452
    2    HA   VAL 727           HA       VAL 727  39.045 -19.309  -2.696
    3    HB   VAL 727           HB       VAL 727  41.317 -20.263  -3.114
    4   HG11  VAL 727          HG11      VAL 727  40.814 -17.672  -4.584
    5   HG13  VAL 727          HG12      VAL 727  40.162 -19.255  -5.001
    6   HG12  VAL 727          HG13      VAL 727  41.891 -18.953  -5.132
    7   HG23  VAL 727          HG21      VAL 727  43.296 -18.784  -3.136
    8   HG22  VAL 727          HG22      VAL 727  42.610 -18.944  -1.518
    9   HG21  VAL 727          HG23      VAL 727  42.315 -17.484  -2.459

  No H/Q in entry =           9
  In of MODEL    6
    1    H    CYS 728           H        CYS 728  39.705 -21.346  -1.538
    2    HA   CYS 728           HA       CYS 728  40.036 -20.835   1.327
    3    HB2  CYS 728           HB2      CYS 728  39.215 -23.338  -0.148
    4    HB3  CYS 728           HB3      CYS 728  39.317 -23.188   1.599

  No H/Q in entry =           4
  In of MODEL    6
    1    H    ALA 729           H        ALA 729  41.909 -21.375   2.326
    2    HA   ALA 729           HA       ALA 729  43.709 -23.114   0.831
    3    HB1  ALA 729           HB1      ALA 729  44.427 -20.614   2.316
    4    HB3  ALA 729           HB2      ALA 729  44.420 -20.828   0.557
    5    HB2  ALA 729           HB3      ALA 729  45.564 -21.725   1.553

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLN 730           H        GLN 730  45.164 -24.241   2.109
    2    HA   GLN 730           HA       GLN 730  44.284 -24.547   4.876
    3    HB2  GLN 730           HB2      GLN 730  43.964 -26.580   3.441
    4    HB3  GLN 730           HB3      GLN 730  45.702 -26.602   3.191
    5    HG2  GLN 730           HG2      GLN 730  46.139 -26.962   5.477
    6    HG3  GLN 730           HG3      GLN 730  44.466 -26.713   5.929
    7   HE21  GLN 730          HE21      GLN 730  46.103 -28.942   6.531
    8   HE22  GLN 730          HE22      GLN 730  45.388 -30.335   5.826

  No H/Q in entry =           8
  In of MODEL    6
    1    H    ASP 731           H        ASP 731  45.571 -23.942   6.261
    2    HA   ASP 731           HA       ASP 731  48.232 -23.039   5.729
    3    HB2  ASP 731           HB2      ASP 731  46.949 -21.813   7.314
    4    HB3  ASP 731           HB3      ASP 731  46.519 -23.275   8.159

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLU 732           H        GLU 732  50.058 -24.158   5.959
    2    HA   GLU 732           HA       GLU 732  49.890 -26.917   6.710
    3    HB2  GLU 732           HB2      GLU 732  52.238 -25.275   5.741
    4    HB3  GLU 732           HB3      GLU 732  52.301 -26.992   6.095
    5    HG2  GLU 732           HG2      GLU 732  50.560 -25.697   4.009
    6    HG3  GLU 732           HG3      GLU 732  52.066 -26.561   3.709

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ARG 733           H        ARG 733  50.662 -23.976   8.359
    2    HA   ARG 733           HA       ARG 733  52.499 -25.097  10.199
    3    HB2  ARG 733           HB2      ARG 733  50.900 -22.556  10.154
    4    HB3  ARG 733           HB3      ARG 733  52.012 -22.974  11.441
    5    HG2  ARG 733           HG2      ARG 733  52.762 -22.662   8.539
    6    HG3  ARG 733           HG3      ARG 733  52.990 -21.430   9.781
    7    HD2  ARG 733           HD2      ARG 733  54.253 -24.180   9.780
    8    HD3  ARG 733           HD3      ARG 733  55.060 -22.672   9.361
    9    HE   ARG 733           HE       ARG 733  54.287 -22.051  11.758
   10   HH11  ARG 733          HH11      ARG 733  55.607 -25.207  10.740
   11   HH12  ARG 733          HH12      ARG 733  56.280 -25.538  12.256
   12   HH21  ARG 733          HH21      ARG 733  55.234 -22.527  13.793
   13   HH22  ARG 733          HH22      ARG 733  56.089 -23.999  14.035

  No H/Q in entry =          13
  In of MODEL    6
    1    H    SER 734           H        SER 734  49.073 -24.119  10.463
    2    HA   SER 734           HA       SER 734  48.974 -25.615  12.978
    3    HB2  SER 734           HB2      SER 734  46.951 -23.706  11.830
    4    HB3  SER 734           HB3      SER 734  47.038 -24.295  13.487
    5    HG   SER 734           HG       SER 734  49.131 -22.897  12.251

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LYS 735           H        LYS 735  48.306 -26.097   9.747
    2    HA   LYS 735           HA       LYS 735  47.051 -27.545   8.498
    3    HB2  LYS 735           HB2      LYS 735  46.563 -29.097  11.064
    4    HB3  LYS 735           HB3      LYS 735  46.527 -29.718   9.426
    5    HG2  LYS 735           HG2      LYS 735  48.975 -28.766  10.912
    6    HG3  LYS 735           HG3      LYS 735  48.529 -30.443  10.616
    7    HD2  LYS 735           HD2      LYS 735  49.156 -28.410   8.467
    8    HD3  LYS 735           HD3      LYS 735  50.305 -29.580   9.102
    9    HE2  LYS 735           HE2      LYS 735  47.718 -30.232   7.711
   10    HE3  LYS 735           HE3      LYS 735  49.308 -30.302   6.971
   11    HZ3  LYS 735           HZ1      LYS 735  48.598 -32.494   7.671
   12    HZ2  LYS 735           HZ2      LYS 735  48.351 -31.976   9.230
   13    HZ1  LYS 735           HZ3      LYS 735  49.913 -32.032   8.620

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ARG 736           H        ARG 736  45.647 -25.599   8.488
    2    HA   ARG 736           HA       ARG 736  42.971 -26.253   9.485
    3    HB2  ARG 736           HB2      ARG 736  42.756 -23.888  10.296
    4    HB3  ARG 736           HB3      ARG 736  43.880 -24.866  11.235
    5    HG2  ARG 736           HG2      ARG 736  45.757 -23.906  10.009
    6    HG3  ARG 736           HG3      ARG 736  44.638 -22.933   9.063
    7    HD2  ARG 736           HD2      ARG 736  44.003 -21.689  10.998
    8    HD3  ARG 736           HD3      ARG 736  44.942 -22.761  12.050
    9    HE   ARG 736           HE       ARG 736  46.833 -21.923  10.413
   10   HH11  ARG 736          HH11      ARG 736  44.324 -20.047  12.048
   11   HH12  ARG 736          HH12      ARG 736  45.244 -18.631  12.180
   12   HH21  ARG 736          HH21      ARG 736  48.105 -19.956  10.528
   13   HH22  ARG 736          HH22      ARG 736  47.440 -18.573  11.279

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ILE 737           H        ILE 737  41.334 -25.292   8.194
    2    HA   ILE 737           HA       ILE 737  42.283 -24.240   5.657
    3    HB   ILE 737           HB       ILE 737  39.415 -24.721   6.456
    4   HG12  ILE 737          HG12      ILE 737  40.718 -26.837   6.755
    5   HG13  ILE 737          HG13      ILE 737  39.519 -26.940   5.473
    6   HG23  ILE 737          HG21      ILE 737  39.068 -24.794   4.062
    7   HG22  ILE 737          HG22      ILE 737  40.803 -24.729   3.786
    8   HG21  ILE 737          HG23      ILE 737  39.979 -23.336   4.488
    9   HD11  ILE 737          HD11      ILE 737  42.468 -26.513   5.122
   10   HD13  ILE 737          HD12      ILE 737  41.273 -26.632   3.829
   11   HD12  ILE 737          HD13      ILE 737  41.590 -28.020   4.875

  No H/Q in entry =          11
  In of MODEL    6
    1    H    LEU 738           H        LEU 738  42.261 -22.113   5.334
    2    HA   LEU 738           HA       LEU 738  40.341 -20.535   6.823
    3    HB2  LEU 738           HB2      LEU 738  41.872 -18.780   7.352
    4    HB3  LEU 738           HB3      LEU 738  42.546 -20.266   7.986
    5    HG   LEU 738           HG       LEU 738  43.473 -18.743   5.539
    6   HD11  LEU 738          HD11      LEU 738  44.014 -17.626   7.617
    7   HD13  LEU 738          HD12      LEU 738  45.466 -18.286   6.869
    8   HD12  LEU 738          HD13      LEU 738  44.732 -19.107   8.248
    9   HD21  LEU 738          HD21      LEU 738  43.776 -21.113   5.287
   10   HD23  LEU 738          HD22      LEU 738  44.621 -21.197   6.841
   11   HD22  LEU 738          HD23      LEU 738  45.334 -20.305   5.473

  No H/Q in entry =          11
  In of MODEL    6
    1    HA   PRO 739           HA       PRO 739  39.593 -18.733   2.900
    2    HB2  PRO 739           HB2      PRO 739  38.546 -16.358   3.651
    3    HB3  PRO 739           HB3      PRO 739  37.665 -17.880   3.889
    4    HG2  PRO 739           HG2      PRO 739  39.249 -16.265   5.839
    5    HG3  PRO 739           HG3      PRO 739  37.687 -17.071   6.068
    6    HD2  PRO 739           HD2      PRO 739  40.093 -18.155   6.888
    7    HD3  PRO 739           HD3      PRO 739  38.665 -19.119   6.430

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LEU 740           H        LEU 740  41.092 -17.890   1.590
    2    HA   LEU 740           HA       LEU 740  42.585 -15.548   2.499
    3    HB2  LEU 740           HB2      LEU 740  43.710 -17.922   1.003
    4    HB3  LEU 740           HB3      LEU 740  44.540 -16.396   1.164
    5    HG   LEU 740           HG       LEU 740  43.901 -18.347   3.379
    6   HD13  LEU 740          HD11      LEU 740  45.720 -19.024   1.926
    7   HD12  LEU 740          HD12      LEU 740  46.340 -18.542   3.508
    8   HD11  LEU 740          HD13      LEU 740  46.485 -17.452   2.127
    9   HD22  LEU 740          HD21      LEU 740  43.747 -16.044   4.205
   10   HD21  LEU 740          HD22      LEU 740  45.333 -15.692   3.511
   11   HD23  LEU 740          HD23      LEU 740  45.184 -16.851   4.829

  No H/Q in entry =          11
  In of MODEL    6
    1    H    THR 741           H        THR 741  43.848 -14.860   0.345
    2    HA   THR 741           HA       THR 741  41.983 -14.982  -1.854
    3    HB   THR 741           HB       THR 741  43.048 -12.600  -2.230
    4    HG1  THR 741           HG1      THR 741  42.553 -11.991   0.287
    5   HG21  THR 741          HG21      THR 741  40.689 -13.156  -0.465
    6   HG23  THR 741          HG22      THR 741  40.726 -13.096  -2.239
    7   HG22  THR 741          HG23      THR 741  41.037 -11.628  -1.294

  No H/Q in entry =           7
  In of MODEL    6
    1    H    VAL 742           H        VAL 742  42.976 -14.546  -3.847
    2    HA   VAL 742           HA       VAL 742  45.175 -16.023  -4.451
    3    HB   VAL 742           HB       VAL 742  44.146 -13.568  -5.866
    4   HG12  VAL 742          HG11      VAL 742  45.053 -14.501  -7.887
    5   HG11  VAL 742          HG12      VAL 742  45.842 -15.792  -6.964
    6   HG13  VAL 742          HG13      VAL 742  46.301 -14.094  -6.721
    7   HG21  VAL 742          HG21      VAL 742  43.461 -16.455  -6.194
    8   HG23  VAL 742          HG22      VAL 742  42.912 -15.097  -7.209
    9   HG22  VAL 742          HG23      VAL 742  42.482 -15.149  -5.490

  No H/Q in entry =           9
  In of MODEL    6
    1    H    CYS 743           H        CYS 743  45.126 -12.475  -4.155
    2    HA   CYS 743           HA       CYS 743  47.860 -12.086  -4.407
    3    HB2  CYS 743           HB2      CYS 743  46.294 -10.275  -4.611
    4    HB3  CYS 743           HB3      CYS 743  45.782 -10.455  -2.950

  No H/Q in entry =           4
  In of MODEL    6
    1    H    LYS 744           H        LYS 744  45.891 -12.472  -1.463
    2    HA   LYS 744           HA       LYS 744  47.860 -11.954   0.439
    3    HB2  LYS 744           HB2      LYS 744  45.369 -12.177   0.598
    4    HB3  LYS 744           HB3      LYS 744  45.604 -13.897   0.701
    5    HG2  LYS 744           HG2      LYS 744  46.894 -13.660   2.752
    6    HG3  LYS 744           HG3      LYS 744  46.718 -11.903   2.670
    7    HD2  LYS 744           HD2      LYS 744  44.417 -13.847   2.851
    8    HD3  LYS 744           HD3      LYS 744  45.102 -13.002   4.235
    9    HE2  LYS 744           HE2      LYS 744  43.884 -11.629   1.822
   10    HE3  LYS 744           HE3      LYS 744  43.018 -11.998   3.299
   11    HZ1  LYS 744           HZ1      LYS 744  45.406 -10.203   3.137
   12    HZ3  LYS 744           HZ2      LYS 744  44.501 -10.568   4.516
   13    HZ2  LYS 744           HZ3      LYS 744  43.789  -9.725   3.262

  No H/Q in entry =          13
  In of MODEL    6
    1    H    MET 745           H        MET 745  46.731 -15.051  -0.836
    2    HA   MET 745           HA       MET 745  48.570 -16.747   0.481
    3    HB2  MET 745           HB2      MET 745  46.765 -17.853  -0.379
    4    HB3  MET 745           HB3      MET 745  46.742 -16.925  -1.868
    5    HG2  MET 745           HG2      MET 745  47.406 -19.031  -2.524
    6    HG3  MET 745           HG3      MET 745  48.863 -18.093  -2.481
    7    HE3  MET 745           HE1      MET 745  46.778 -19.966   0.316
    8    HE2  MET 745           HE2      MET 745  47.636 -21.519   0.269
    9    HE1  MET 745           HE3      MET 745  46.829 -20.902  -1.166

  No H/Q in entry =           9
  In of MODEL    6
    1    H    HIS 746           H        HIS 746  48.613 -15.241  -2.771
    2    HA   HIS 746           HA       HIS 746  50.986 -16.500  -3.713
    3    HB2  HIS 746           HB2      HIS 746  49.399 -14.202  -4.485
    4    HB3  HIS 746           HB3      HIS 746  51.098 -14.064  -4.978
    5    HD1  HIS 746           HD1      HIS 746  51.856 -16.153  -6.617
    6    HD2  HIS 746           HD2      HIS 746  47.790 -15.549  -6.089
    7    HE1  HIS 746           HE1      HIS 746  50.765 -17.214  -8.587
    8    HE2  HIS 746           HE2      HIS 746  48.317 -16.734  -8.327

  No H/Q in entry =           8
  In of MODEL    6
    1    H    VAL 747           H        VAL 747  50.466 -13.489  -2.045
    2    HA   VAL 747           HA       VAL 747  53.089 -12.600  -2.020
    3    HB   VAL 747           HB       VAL 747  50.662 -11.988  -0.346
    4   HG12  VAL 747          HG11      VAL 747  53.379 -10.692  -0.155
    5   HG11  VAL 747          HG12      VAL 747  52.653 -11.721   1.073
    6   HG13  VAL 747          HG13      VAL 747  51.918 -10.169   0.685
    7   HG22  VAL 747          HG21      VAL 747  50.829  -9.844  -1.545
    8   HG21  VAL 747          HG22      VAL 747  50.713 -11.217  -2.656
    9   HG23  VAL 747          HG23      VAL 747  52.267 -10.454  -2.370

  No H/Q in entry =           9
  In of MODEL    6
    1    H    LEU 748           H        LEU 748  51.244 -14.255   0.577
    2    HA   LEU 748           HA       LEU 748  53.526 -14.432   2.205
    3    HB2  LEU 748           HB2      LEU 748  52.226 -16.027   3.616
    4    HB3  LEU 748           HB3      LEU 748  51.357 -14.560   3.243
    5    HG   LEU 748           HG       LEU 748  50.102 -15.889   1.501
    6   HD12  LEU 748          HD11      LEU 748  51.290 -18.226   2.978
    7   HD11  LEU 748          HD12      LEU 748  51.600 -17.794   1.300
    8   HD13  LEU 748          HD13      LEU 748  49.987 -18.310   1.793
    9   HD23  LEU 748          HD21      LEU 748  48.585 -16.860   3.164
   10   HD22  LEU 748          HD22      LEU 748  49.117 -15.239   3.610
   11   HD21  LEU 748          HD23      LEU 748  49.829 -16.650   4.398

  No H/Q in entry =          11
  In of MODEL    6
    1    H    HIS 749           H        HIS 749  52.479 -16.287  -0.402
    2    HA   HIS 749           HA       HIS 749  53.933 -18.653   0.165
    3    HB2  HIS 749           HB2      HIS 749  51.980 -18.087  -1.576
    4    HB3  HIS 749           HB3      HIS 749  53.364 -17.909  -2.649
    5    HD1  HIS 749           HD1      HIS 749  54.401 -20.041  -3.525
    6    HD2  HIS 749           HD2      HIS 749  51.684 -20.676  -0.454
    7    HE1  HIS 749           HE1      HIS 749  54.046 -22.508  -3.446
    8    HE2  HIS 749           HE2      HIS 749  52.128 -22.777  -1.901

  No H/Q in entry =           8
  In of MODEL    6
    1    H    CYS 750           H        CYS 750  54.629 -15.682  -1.735
    2    HA   CYS 750           HA       CYS 750  57.199 -16.713  -2.473
    3    HB2  CYS 750           HB2      CYS 750  57.665 -14.543  -3.505
    4    HB3  CYS 750           HB3      CYS 750  56.056 -15.073  -3.960

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLN 751           H        GLN 751  55.878 -14.825   0.125
    2    HA   GLN 751           HA       GLN 751  58.267 -13.887   1.224
    3    HB2  GLN 751           HB2      GLN 751  55.703 -14.656   2.610
    4    HB3  GLN 751           HB3      GLN 751  57.021 -13.794   3.382
    5    HG2  GLN 751           HG2      GLN 751  56.768 -11.984   1.747
    6    HG3  GLN 751           HG3      GLN 751  55.422 -12.869   1.037
    7   HE21  GLN 751          HE21      GLN 751  55.507 -10.258   2.250
    8   HE22  GLN 751          HE22      GLN 751  54.360 -10.255   3.531

  No H/Q in entry =           8
  In of MODEL    6
    1    H    GLY 752           H        GLY 752  56.887 -17.041   1.208
    2    HA3  GLY 752           HA2      GLY 752  58.482 -18.876   1.500
    3    HA2  GLY 752           HA3      GLY 752  59.151 -17.978   2.854

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ARG 753           H        ARG 753  55.700 -18.434   2.215
    2    HA   ARG 753           HA       ARG 753  55.585 -20.118   4.634
    3    HB2  ARG 753           HB2      ARG 753  53.352 -18.400   3.522
    4    HB3  ARG 753           HB3      ARG 753  53.379 -19.261   5.056
    5    HG2  ARG 753           HG2      ARG 753  55.066 -16.886   4.304
    6    HG3  ARG 753           HG3      ARG 753  53.686 -16.889   5.401
    7    HD2  ARG 753           HD2      ARG 753  54.835 -18.282   6.946
    8    HD3  ARG 753           HD3      ARG 753  56.172 -18.520   5.814
    9    HE   ARG 753           HE       ARG 753  55.482 -15.898   6.926
   10   HH11  ARG 753          HH11      ARG 753  57.941 -18.370   6.168
   11   HH12  ARG 753          HH12      ARG 753  59.255 -17.406   6.614
   12   HH21  ARG 753          HH21      ARG 753  57.313 -14.578   7.555
   13   HH22  ARG 753          HH22      ARG 753  58.885 -15.192   7.447

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ASN 754           H        ASN 754  54.626 -22.081   4.451
    2    HA   ASN 754           HA       ASN 754  53.725 -22.791   1.772
    3    HB2  ASN 754           HB2      ASN 754  54.232 -24.694   4.082
    4    HB3  ASN 754           HB3      ASN 754  53.846 -25.129   2.433
    5   HD21  ASN 754          HD21      ASN 754  56.278 -24.234   4.592
    6   HD22  ASN 754          HD22      ASN 754  57.622 -24.317   3.518

  No H/Q in entry =           6
  In of MODEL    6
    1    H    TYR 755           H        TYR 755  51.773 -22.906   1.328
    2    HA   TYR 755           HA       TYR 755  49.799 -23.702   3.289
    3    HB2  TYR 755           HB2      TYR 755  49.704 -21.271   1.499
    4    HB3  TYR 755           HB3      TYR 755  48.246 -22.068   2.049
    5    HD1  TYR 755           HD1      TYR 755  51.411 -20.711   3.554
    6    HD2  TYR 755           HD2      TYR 755  47.192 -21.075   3.838
    7    HE1  TYR 755           HE1      TYR 755  51.418 -19.253   5.522
    8    HE2  TYR 755           HE2      TYR 755  47.197 -19.617   5.812
    9    HH   TYR 755           HH       TYR 755  49.851 -17.748   6.669

  No H/Q in entry =           9
  In of MODEL    6
    1    H    THR 756           H        THR 756  48.166 -24.856   2.288
    2    HA   THR 756           HA       THR 756  48.701 -25.747  -0.456
    3    HB   THR 756           HB       THR 756  47.086 -26.975   1.806
    4    HG1  THR 756           HG1      THR 756  48.989 -27.542   2.458
    5   HG23  THR 756          HG21      THR 756  47.017 -28.993   0.410
    6   HG22  THR 756          HG22      THR 756  47.886 -28.111  -0.866
    7   HG21  THR 756          HG23      THR 756  46.263 -27.606  -0.388

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LEU 757           H        LEU 757  46.717 -25.849  -1.873
    2    HA   LEU 757           HA       LEU 757  44.699 -24.079  -0.801
    3    HB2  LEU 757           HB2      LEU 757  45.281 -24.744  -3.665
    4    HB3  LEU 757           HB3      LEU 757  43.860 -23.856  -3.143
    5    HG   LEU 757           HG       LEU 757  45.704 -22.399  -1.949
    6   HD11  LEU 757          HD11      LEU 757  47.603 -23.645  -2.669
    7   HD13  LEU 757          HD12      LEU 757  47.633 -22.032  -3.380
    8   HD12  LEU 757          HD13      LEU 757  47.163 -23.420  -4.364
    9   HD21  LEU 757          HD21      LEU 757  44.845 -22.138  -4.809
   10   HD23  LEU 757          HD22      LEU 757  45.531 -20.845  -3.803
   11   HD22  LEU 757          HD23      LEU 757  43.996 -21.597  -3.356

  No H/Q in entry =          11
  In of MODEL    6
    1    H    THR 758           H        THR 758  42.539 -24.491  -1.086
    2    HA   THR 758           HA       THR 758  41.940 -27.324  -1.309
    3    HB   THR 758           HB       THR 758  40.440 -27.010   0.768
    4    HG1  THR 758           HG1      THR 758  41.754 -24.632   0.635
    5   HG23  THR 758          HG21      THR 758  42.278 -27.582   2.298
    6   HG22  THR 758          HG22      THR 758  43.446 -26.958   1.140
    7   HG21  THR 758          HG23      THR 758  42.498 -28.392   0.747

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLY 759           H        GLY 759  39.328 -27.411  -0.904
    2    HA3  GLY 759           HA2      GLY 759  38.457 -25.791  -3.149
    3    HA2  GLY 759           HA3      GLY 759  37.637 -27.211  -2.506

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ARG 760           H        ARG 760  36.142 -25.150  -3.089
    2    HA   ARG 760           HA       ARG 760  35.710 -23.165  -1.143
    3    HB2  ARG 760           HB2      ARG 760  33.444 -22.928  -2.145
    4    HB3  ARG 760           HB3      ARG 760  34.711 -22.995  -3.357
    5    HG2  ARG 760           HG2      ARG 760  33.092 -24.379  -4.308
    6    HG3  ARG 760           HG3      ARG 760  34.123 -25.516  -3.436
    7    HD2  ARG 760           HD2      ARG 760  32.524 -25.472  -1.542
    8    HD3  ARG 760           HD3      ARG 760  31.452 -24.462  -2.516
    9    HE   ARG 760           HE       ARG 760  32.161 -26.729  -3.967
   10   HH11  ARG 760          HH11      ARG 760  30.192 -25.959  -1.129
   11   HH12  ARG 760          HH12      ARG 760  29.109 -27.243  -1.361
   12   HH21  ARG 760          HH21      ARG 760  30.640 -28.473  -4.302
   13   HH22  ARG 760          HH22      ARG 760  29.373 -28.702  -3.197

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ASP 761           H        ASP 761  35.020 -26.453  -1.120
    2    HA   ASP 761           HA       ASP 761  32.899 -26.601   0.734
    3    HB2  ASP 761           HB2      ASP 761  35.019 -28.465  -0.158
    4    HB3  ASP 761           HB3      ASP 761  33.865 -28.953   1.101

  No H/Q in entry =           4
  In of MODEL    6
    1    H    SER 762           H        SER 762  36.375 -26.310   1.004
    2    HA   SER 762           HA       SER 762  36.546 -27.399   3.599
    3    HB2  SER 762           HB2      SER 762  38.601 -25.800   2.093
    4    HB3  SER 762           HB3      SER 762  38.878 -26.927   3.416
    5    HG   SER 762           HG       SER 762  38.273 -28.614   2.113

  No H/Q in entry =           5
  In of MODEL    6
    1    H    CYS 763           H        CYS 763  36.563 -24.001   2.350
    2    HA   CYS 763           HA       CYS 763  36.850 -23.214   5.176
    3    HB2  CYS 763           HB2      CYS 763  37.861 -21.191   4.555
    4    HB3  CYS 763           HB3      CYS 763  38.616 -22.393   3.521

  No H/Q in entry =           4
  In of MODEL    6
    1    H    THR 764           H        THR 764  35.800 -21.206   5.739
    2    HA   THR 764           HA       THR 764  33.252 -20.905   4.381
    3    HB   THR 764           HB       THR 764  34.193 -19.750   7.044
    4    HG1  THR 764           HG1      THR 764  32.316 -21.809   6.536
    5   HG21  THR 764          HG21      THR 764  31.445 -19.811   5.777
    6   HG23  THR 764          HG22      THR 764  32.465 -18.386   5.984
    7   HG22  THR 764          HG23      THR 764  31.815 -19.216   7.399

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LEU 765           H        LEU 765  33.621 -19.822   2.649
    2    HA   LEU 765           HA       LEU 765  35.511 -17.632   2.589
    3    HB2  LEU 765           HB2      LEU 765  35.248 -19.676   0.977
    4    HB3  LEU 765           HB3      LEU 765  33.925 -18.724   0.333
    5    HG   LEU 765           HG       LEU 765  35.480 -16.938  -0.258
    6   HD12  LEU 765          HD11      LEU 765  37.922 -17.419  -0.053
    7   HD11  LEU 765          HD12      LEU 765  37.481 -18.863   0.883
    8   HD13  LEU 765          HD13      LEU 765  37.109 -17.281   1.513
    9   HD22  LEU 765          HD21      LEU 765  34.997 -18.696  -1.884
   10   HD21  LEU 765          HD22      LEU 765  36.300 -19.678  -1.222
   11   HD23  LEU 765          HD23      LEU 765  36.666 -18.153  -2.027

  No H/Q in entry =          11
  In of MODEL    6
    1    HA   PRO 766           HA       PRO 766  32.087 -14.758   2.562
    2    HB2  PRO 766           HB2      PRO 766  33.324 -12.646   1.271
    3    HB3  PRO 766           HB3      PRO 766  33.459 -12.977   2.994
    4    HG2  PRO 766           HG2      PRO 766  35.386 -13.530   0.808
    5    HG3  PRO 766           HG3      PRO 766  35.692 -13.151   2.507
    6    HD2  PRO 766           HD2      PRO 766  35.874 -15.653   1.397
    7    HD3  PRO 766           HD3      PRO 766  35.606 -15.367   3.118

  No H/Q in entry =           7
  In of MODEL    6
    1    H    ALA 767           H        ALA 767  33.958 -14.316  -0.446
    2    HA   ALA 767           HA       ALA 767  31.433 -14.558  -1.901
    3    HB3  ALA 767           HB1      ALA 767  32.430 -13.135  -3.612
    4    HB2  ALA 767           HB2      ALA 767  33.922 -13.037  -2.670
    5    HB1  ALA 767           HB3      ALA 767  32.433 -12.331  -2.043

  No H/Q in entry =           5
  In of MODEL    6
    1    H    SER 768           H        SER 768  31.299 -16.552  -2.586
    2    HA   SER 768           HA       SER 768  33.522 -17.569  -4.206
    3    HB2  SER 768           HB2      SER 768  33.016 -18.890  -2.044
    4    HB3  SER 768           HB3      SER 768  31.453 -19.249  -2.753
    5    HG   SER 768           HG       SER 768  33.987 -20.136  -3.485

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA 769           H        ALA 769  30.036 -17.947  -3.619
    2    HA   ALA 769           HA       ALA 769  29.550 -18.019  -6.502
    3    HB3  ALA 769           HB1      ALA 769  27.780 -18.746  -4.151
    4    HB2  ALA 769           HB2      ALA 769  28.631 -19.885  -5.193
    5    HB1  ALA 769           HB3      ALA 769  27.325 -18.900  -5.848

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLU 770           H        GLU 770  26.913 -17.097  -6.477
    2    HA   GLU 770           HA       GLU 770  27.117 -14.337  -6.594
    3    HB2  GLU 770           HB2      GLU 770  24.647 -14.328  -6.664
    4    HB3  GLU 770           HB3      GLU 770  25.341 -15.543  -7.729
    5    HG2  GLU 770           HG2      GLU 770  24.852 -17.279  -6.106
    6    HG3  GLU 770           HG3      GLU 770  24.213 -16.077  -4.992

  No H/Q in entry =           6
  In of MODEL    6
    1    H    LYS 771           H        LYS 771  26.388 -12.647  -5.316
    2    HA   LYS 771           HA       LYS 771  26.230 -13.255  -2.434
    3    HB2  LYS 771           HB2      LYS 771  27.968 -11.268  -3.840
    4    HB3  LYS 771           HB3      LYS 771  27.620 -11.201  -2.131
    5    HG2  LYS 771           HG2      LYS 771  28.927 -13.558  -3.457
    6    HG3  LYS 771           HG3      LYS 771  29.825 -12.192  -2.804
    7    HD2  LYS 771           HD2      LYS 771  29.887 -13.639  -1.010
    8    HD3  LYS 771           HD3      LYS 771  28.448 -12.715  -0.640
    9    HE2  LYS 771           HE2      LYS 771  27.037 -14.520  -1.423
   10    HE3  LYS 771           HE3      LYS 771  28.437 -15.383  -2.036
   11    HZ3  LYS 771           HZ1      LYS 771  27.741 -16.291   0.058
   12    HZ2  LYS 771           HZ2      LYS 771  27.800 -14.775   0.795
   13    HZ1  LYS 771           HZ3      LYS 771  29.233 -15.505   0.282

  No H/Q in entry =          13
  In of MODEL    6
    1    H    ALA 772           H        ALA 772  25.117 -11.778  -1.200
    2    HA   ALA 772           HA       ALA 772  23.738  -9.581  -2.490
    3    HB2  ALA 772           HB1      ALA 772  22.556 -10.721  -0.644
    4    HB1  ALA 772           HB2      ALA 772  23.030  -9.103  -0.114
    5    HB3  ALA 772           HB3      ALA 772  23.963 -10.504   0.403

  No H/Q in entry =           5
  In of MODEL    6
    1    H    CYS 773           H        CYS 773  24.599  -7.374  -2.042
    2    HA   CYS 773           HA       CYS 773  27.385  -7.761  -1.798
    3    HB2  CYS 773           HB2      CYS 773  27.643  -5.344  -2.324
    4    HB3  CYS 773           HB3      CYS 773  26.912  -6.361  -3.557

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLY 774           H        GLY 774  28.717  -5.869  -0.801
    2    HA3  GLY 774           HA2      GLY 774  28.813  -4.795   1.449
    3    HA2  GLY 774           HA3      GLY 774  28.219  -6.352   2.041

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ALA 775           H        ALA 775  29.649  -7.754  -0.138
    2    HA   ALA 775           HA       ALA 775  32.429  -7.105   0.186
    3    HB1  ALA 775           HB1      ALA 775  33.063  -9.394   0.850
    4    HB3  ALA 775           HB2      ALA 775  31.361  -9.830   0.982
    5    HB2  ALA 775           HB3      ALA 775  32.053  -8.634   2.080

  No H/Q in entry =           5
  In of MODEL    6
    1    H    CYS 776           H        CYS 776  32.646  -6.761  -1.891
    2    HA   CYS 776           HA       CYS 776  33.403  -8.483  -3.744
    3    HB2  CYS 776           HB2      CYS 776  31.482  -8.594  -5.419
    4    HB3  CYS 776           HB3      CYS 776  31.300  -9.628  -4.015

  No H/Q in entry =           4
  In of MODEL    6
    1    HA   PRO 777           HA       PRO 777  33.719  -4.193  -5.072
    2    HB2  PRO 777           HB2      PRO 777  36.394  -3.963  -4.964
    3    HB3  PRO 777           HB3      PRO 777  35.365  -3.817  -3.540
    4    HG2  PRO 777           HG2      PRO 777  37.161  -6.027  -4.337
    5    HG3  PRO 777           HG3      PRO 777  36.599  -5.563  -2.730
    6    HD2  PRO 777           HD2      PRO 777  35.578  -7.682  -4.379
    7    HD3  PRO 777           HD3      PRO 777  34.971  -7.132  -2.810

  No H/Q in entry =           7
  In of MODEL    6
    1    H    LEU 778           H        LEU 778  35.464  -6.973  -6.385
    2    HA   LEU 778           HA       LEU 778  36.054  -5.370  -8.730
    3    HB2  LEU 778           HB2      LEU 778  37.626  -7.196  -9.497
    4    HB3  LEU 778           HB3      LEU 778  38.074  -6.280  -8.085
    5    HG   LEU 778           HG       LEU 778  36.860  -9.039  -7.873
    6   HD11  LEU 778          HD11      LEU 778  38.902  -9.163  -9.258
    7   HD13  LEU 778          HD12      LEU 778  39.106  -9.894  -7.671
    8   HD12  LEU 778          HD13      LEU 778  39.789  -8.296  -7.993
    9   HD23  LEU 778          HD21      LEU 778  38.647  -7.461  -6.031
   10   HD22  LEU 778          HD22      LEU 778  37.960  -9.055  -5.713
   11   HD21  LEU 778          HD23      LEU 778  36.908  -7.646  -5.838

  No H/Q in entry =          11
  In of MODEL    6
    1    H    TRP 779           H        TRP 779  34.986  -8.791  -8.458
    2    HA   TRP 779           HA       TRP 779  33.985  -8.634 -11.170
    3    HB2  TRP 779           HB2      TRP 779  33.275 -11.006 -10.784
    4    HB3  TRP 779           HB3      TRP 779  34.987 -10.730 -10.494
    5    HD1  TRP 779           HD1      TRP 779  31.704 -11.400  -8.560
    6    HE1  TRP 779           HE1      TRP 779  32.305 -12.301  -6.237
    7    HE3  TRP 779           HE3      TRP 779  36.766 -10.919  -8.812
    8    HZ2  TRP 779           HZ2      TRP 779  34.674 -12.749  -4.706
    9    HZ3  TRP 779           HZ3      TRP 779  38.109 -11.600  -6.893
   10    HH2  TRP 779           HH2      TRP 779  37.080 -12.499  -4.886

  No H/Q in entry =          10
  In of MODEL    6
    1    H    GLY 780           H        GLY 780  32.825  -7.931  -8.149
    2    HA3  GLY 780           HA2      GLY 780  30.058  -8.267  -9.015
    3    HA2  GLY 780           HA3      GLY 780  30.573  -8.429  -7.336

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LYS 781           H        LYS 781  28.750  -6.595  -8.740
    2    HA   LYS 781           HA       LYS 781  30.030  -4.120  -7.849
    3    HB2  LYS 781           HB2      LYS 781  29.700  -4.246 -10.301
    4    HB3  LYS 781           HB3      LYS 781  27.972  -4.420 -10.029
    5    HG2  LYS 781           HG2      LYS 781  28.508  -2.157 -10.631
    6    HG3  LYS 781           HG3      LYS 781  27.932  -2.215  -8.960
    7    HD2  LYS 781           HD2      LYS 781  30.273  -2.131  -8.177
    8    HD3  LYS 781           HD3      LYS 781  30.822  -2.051  -9.854
    9    HE2  LYS 781           HE2      LYS 781  29.521   0.018 -10.123
   10    HE3  LYS 781           HE3      LYS 781  29.089  -0.075  -8.414
   11    HZ1  LYS 781           HZ1      LYS 781  31.876   0.134  -9.436
   12    HZ3  LYS 781           HZ2      LYS 781  31.410   0.234  -7.814
   13    HZ2  LYS 781           HZ3      LYS 781  30.960   1.435  -8.898

  No H/Q in entry =          13
  In of MODEL    6
    1    H    CYS 782           H        CYS 782  29.000  -2.993  -6.406
    2    HA   CYS 782           HA       CYS 782  26.221  -3.641  -5.700
    3    HB2  CYS 782           HB2      CYS 782  27.996  -4.208  -4.022
    4    HB3  CYS 782           HB3      CYS 782  28.417  -2.502  -3.968

  No H/Q in entry =           4
  In of MODEL    6
    1    H    ASP 783           H        ASP 783  24.874  -1.847  -5.770
    2    HA   ASP 783           HA       ASP 783  26.250   0.670  -6.386
    3    HB2  ASP 783           HB2      ASP 783  25.131  -0.237  -8.358
    4    HB3  ASP 783           HB3      ASP 783  23.607  -0.283  -7.479

  No H/Q in entry =           4
  In of MODEL    6
    1    H    ALA 784           H        ALA 784  22.936  -0.244  -5.462
    2    HA   ALA 784           HA       ALA 784  22.899   2.065  -3.668
    3    HB1  ALA 784           HB1      ALA 784  20.668   0.218  -4.531
    4    HB2  ALA 784           HB2      ALA 784  21.040   1.784  -5.251
    5    HB3  ALA 784           HB3      ALA 784  20.476   1.694  -3.584

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLU 785           H        GLU 785  21.300   1.461  -1.641
    2    HA   GLU 785           HA       GLU 785  22.625  -0.710  -0.227
    3    HB2  GLU 785           HB2      GLU 785  22.275   1.511   0.890
    4    HB3  GLU 785           HB3      GLU 785  20.541   1.268   0.755
    5    HG2  GLU 785           HG2      GLU 785  20.713  -0.707   2.193
    6    HG3  GLU 785           HG3      GLU 785  22.444  -0.435   2.343

  No H/Q in entry =           6
  In of MODEL    6
    1    H    SER 786           H        SER 786  21.285  -2.403   0.862
    2    HA   SER 786           HA       SER 786  19.821  -4.116   0.762
    3    HB2  SER 786           HB2      SER 786  17.906  -2.024  -0.354
    4    HB3  SER 786           HB3      SER 786  17.429  -3.627   0.203
    5    HG   SER 786           HG       SER 786  18.267  -1.387   1.669

  No H/Q in entry =           5
  In of MODEL    6
    1    H    SER 787           H        SER 787  21.601  -3.483  -1.369
    2    HA   SER 787           HA       SER 787  20.219  -4.441  -3.742
    3    HB2  SER 787           HB2      SER 787  21.480  -2.347  -4.002
    4    HB3  SER 787           HB3      SER 787  22.928  -3.121  -3.382
    5    HG   SER 787           HG       SER 787  22.822  -4.530  -5.259

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LYS 788           H        LYS 788  20.973  -6.243  -4.763
    2    HA   LYS 788           HA       LYS 788  22.625  -8.021  -3.233
    3    HB2  LYS 788           HB2      LYS 788  22.202  -9.651  -4.969
    4    HB3  LYS 788           HB3      LYS 788  20.685  -8.918  -4.478
    5    HG2  LYS 788           HG2      LYS 788  20.719  -7.506  -6.482
    6    HG3  LYS 788           HG3      LYS 788  22.253  -8.231  -6.959
    7    HD2  LYS 788           HD2      LYS 788  19.721  -9.756  -6.497
    8    HD3  LYS 788           HD3      LYS 788  20.248  -9.208  -8.095
    9    HE2  LYS 788           HE2      LYS 788  22.293 -10.566  -7.844
   10    HE3  LYS 788           HE3      LYS 788  21.732 -11.111  -6.264
   11    HZ3  LYS 788           HZ1      LYS 788  21.258 -12.737  -7.977
   12    HZ2  LYS 788           HZ2      LYS 788  20.373 -11.614  -8.848
   13    HZ1  LYS 788           HZ3      LYS 788  19.820 -12.132  -7.353

  No H/Q in entry =          13
  In of MODEL    6
    1    H    CYS 789           H        CYS 789  24.385  -9.177  -4.727
    2    HA   CYS 789           HA       CYS 789  25.966  -6.979  -5.802
    3    HB2  CYS 789           HB2      CYS 789  26.920  -8.419  -3.980
    4    HB3  CYS 789           HB3      CYS 789  26.700  -9.807  -5.021

  No H/Q in entry =           4
  In of MODEL    6
    1    H    VAL 790           H        VAL 790  26.128  -6.905  -7.933
    2    HA   VAL 790           HA       VAL 790  25.041  -9.169  -9.407
    3    HB   VAL 790           HB       VAL 790  23.879  -7.012  -9.772
    4   HG13  VAL 790          HG11      VAL 790  24.938  -5.169 -10.991
    5   HG12  VAL 790          HG12      VAL 790  26.486  -6.006 -10.876
    6   HG11  VAL 790          HG13      VAL 790  25.678  -5.450  -9.412
    7   HG22  VAL 790          HG21      VAL 790  23.905  -6.988 -12.239
    8   HG21  VAL 790          HG22      VAL 790  23.858  -8.626 -11.584
    9   HG23  VAL 790          HG23      VAL 790  25.368  -7.972 -12.212

  No H/Q in entry =           9
  In of MODEL    6
    1    H    CYS 791           H        CYS 791  26.174 -10.019 -11.099
    2    HA   CYS 791           HA       CYS 791  29.049  -9.724 -10.751
    3    HB2  CYS 791           HB2      CYS 791  27.841 -11.810 -12.497
    4    HB3  CYS 791           HB3      CYS 791  29.166 -11.913 -11.353

  No H/Q in entry =           4
  In of MODEL    6
    1    H    ARG 792           H        ARG 792  30.040  -8.517 -12.169
    2    HA   ARG 792           HA       ARG 792  28.707  -7.612 -14.563
    3    HB2  ARG 792           HB2      ARG 792  31.266  -6.895 -13.200
    4    HB3  ARG 792           HB3      ARG 792  30.952  -6.364 -14.843
    5    HG2  ARG 792           HG2      ARG 792  28.924  -5.235 -14.051
    6    HG3  ARG 792           HG3      ARG 792  29.316  -5.724 -12.396
    7    HD2  ARG 792           HD2      ARG 792  31.286  -4.431 -12.379
    8    HD3  ARG 792           HD3      ARG 792  31.246  -4.207 -14.124
    9    HE   ARG 792           HE       ARG 792  28.960  -3.110 -12.821
   10   HH11  ARG 792          HH11      ARG 792  32.331  -2.454 -13.766
   11   HH12  ARG 792          HH12      ARG 792  32.190  -0.775 -13.667
   12   HH21  ARG 792          HH21      ARG 792  28.757  -0.729 -12.725
   13   HH22  ARG 792          HH22      ARG 792  30.126   0.218 -13.079

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLU 793           H        GLU 793  30.108  -7.419 -16.553
    2    HA   GLU 793           HA       GLU 793  31.179  -9.975 -17.271
    3    HB2  GLU 793           HB2      GLU 793  31.120  -7.320 -18.681
    4    HB3  GLU 793           HB3      GLU 793  31.861  -8.753 -19.356
    5    HG2  GLU 793           HG2      GLU 793  29.685  -9.894 -19.276
    6    HG3  GLU 793           HG3      GLU 793  28.957  -8.395 -18.684

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ALA 794           H        ALA 794  33.379 -10.169 -18.120
    2    HA   ALA 794           HA       ALA 794  35.247  -9.488 -16.131
    3    HB2  ALA 794           HB1      ALA 794  35.409 -11.510 -17.499
    4    HB3  ALA 794           HB2      ALA 794  36.883 -10.545 -17.594
    5    HB1  ALA 794           HB3      ALA 794  35.721 -10.517 -18.921

  No H/Q in entry =           5
  In of MODEL    6
    1    H    SER 795           H        SER 795  34.439  -8.143 -19.222
    2    HA   SER 795           HA       SER 795  36.703  -6.445 -19.311
    3    HB2  SER 795           HB2      SER 795  34.169  -6.338 -20.936
    4    HB3  SER 795           HB3      SER 795  35.680  -5.507 -21.315
    5    HG   SER 795           HG       SER 795  35.498  -8.314 -20.978

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLU 796           H        GLU 796  33.629  -6.247 -17.753
    2    HA   GLU 796           HA       GLU 796  33.848  -3.343 -17.584
    3    HB2  GLU 796           HB2      GLU 796  31.628  -4.311 -18.298
    4    HB3  GLU 796           HB3      GLU 796  31.494  -5.064 -16.716
    5    HG2  GLU 796           HG2      GLU 796  31.459  -2.884 -15.646
    6    HG3  GLU 796           HG3      GLU 796  31.743  -2.110 -17.190

  No H/Q in entry =           6
  In of MODEL    6
    1    H    CYS 797           H        CYS 797  35.145  -5.768 -16.127
    2    HA   CYS 797           HA       CYS 797  34.711  -5.275 -13.381
    3    HB2  CYS 797           HB2      CYS 797  35.739  -7.356 -14.032
    4    HB3  CYS 797           HB3      CYS 797  37.020  -6.512 -14.894

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLU 798           H        GLU 798  35.401  -3.644 -12.182
    2    HA   GLU 798           HA       GLU 798  37.084  -1.609 -13.388
    3    HB2  GLU 798           HB2      GLU 798  36.367  -0.268 -11.360
    4    HB3  GLU 798           HB3      GLU 798  35.084  -0.725 -12.468
    5    HG2  GLU 798           HG2      GLU 798  34.426  -2.533 -10.944
    6    HG3  GLU 798           HG3      GLU 798  35.718  -2.064  -9.840

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU 799           H        GLU 799  38.372  -3.921 -12.794
    2    HA   GLU 799           HA       GLU 799  40.484  -3.093 -11.112
    3    HB2  GLU 799           HB2      GLU 799  38.901  -3.948  -9.407
    4    HB3  GLU 799           HB3      GLU 799  38.705  -5.431 -10.310
    5    HG2  GLU 799           HG2      GLU 799  40.107  -5.625  -8.258
    6    HG3  GLU 799           HG3      GLU 799  40.908  -6.150  -9.735

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLU 800           H        GLU 800  42.156  -5.007 -11.212
    2    HA   GLU 800           HA       GLU 800  41.758  -6.496 -13.714
    3    HB2  GLU 800           HB2      GLU 800  44.200  -6.395 -14.041
    4    HB3  GLU 800           HB3      GLU 800  43.433  -4.808 -14.151
    5    HG2  GLU 800           HG2      GLU 800  44.217  -4.335 -11.863
    6    HG3  GLU 800           HG3      GLU 800  44.979  -5.922 -11.810

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLY 801           H        GLY 801  42.571  -6.589 -10.368
    2    HA3  GLY 801           HA2      GLY 801  43.454  -8.025  -9.015
    3    HA2  GLY 801           HA3      GLY 801  42.499  -9.170  -9.952

  No H/Q in entry =           3
  In of MODEL    6
    1    H    PHE 802           H        PHE 802  43.932 -10.698  -9.572
    2    HA   PHE 802           HA       PHE 802  46.539 -10.635 -10.921
    3    HB2  PHE 802           HB2      PHE 802  45.200 -12.555  -9.039
    4    HB3  PHE 802           HB3      PHE 802  46.619 -13.028  -9.948
    5    HD1  PHE 802           HD1      PHE 802  46.171  -9.622  -8.551
    6    HD2  PHE 802           HD2      PHE 802  47.967 -13.454  -8.051
    7    HE1  PHE 802           HE1      PHE 802  47.558  -8.754  -6.769
    8    HE2  PHE 802           HE2      PHE 802  49.333 -12.614  -6.316
    9    HZ   PHE 802           HZ       PHE 802  49.171 -10.233  -5.623

  No H/Q in entry =           9
  In of MODEL    6
    1    H    SER 803           H        SER 803  46.828 -13.174 -11.731
    2    HA   SER 803           HA       SER 803  44.606 -13.731 -13.485
    3    HB2  SER 803           HB2      SER 803  47.561 -13.867 -14.134
    4    HB3  SER 803           HB3      SER 803  46.247 -14.371 -15.200
    5    HG   SER 803           HG       SER 803  45.600 -11.960 -14.519

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ILE 804           H        ILE 804  44.052 -15.866 -13.426
    2    HA   ILE 804           HA       ILE 804  45.766 -17.656 -11.860
    3    HB   ILE 804           HB       ILE 804  43.929 -18.572 -10.607
    4   HG12  ILE 804          HG12      ILE 804  42.135 -18.312 -12.372
    5   HG13  ILE 804          HG13      ILE 804  41.609 -17.900 -10.748
    6   HG23  ILE 804          HG21      ILE 804  44.938 -16.622  -9.613
    7   HG22  ILE 804          HG22      ILE 804  43.210 -16.646  -9.239
    8   HG21  ILE 804          HG23      ILE 804  43.828 -15.575 -10.500
    9   HD11  ILE 804          HD11      ILE 804  41.850 -15.522 -11.316
   10   HD13  ILE 804          HD12      ILE 804  40.704 -16.362 -12.362
   11   HD12  ILE 804          HD13      ILE 804  42.312 -15.973 -12.959

  No H/Q in entry =          11
  In of MODEL    6
    1    H    CYS 805           H        CYS 805  44.753 -19.991 -12.017
    2    HA   CYS 805           HA       CYS 805  44.091 -20.460 -14.838
    3    HB2  CYS 805           HB2      CYS 805  46.369 -21.183 -14.177
    4    HB3  CYS 805           HB3      CYS 805  45.638 -22.189 -12.929

  No H/Q in entry =           4
  In of MODEL    6
    1    H    VAL 806           H        VAL 806  42.157 -21.339 -15.034
    2    HA   VAL 806           HA       VAL 806  41.081 -22.821 -12.765
    3    HB   VAL 806           HB       VAL 806  40.227 -20.489 -12.889
    4   HG12  VAL 806          HG11      VAL 806  39.104 -21.288 -15.528
    5   HG11  VAL 806          HG12      VAL 806  40.364 -20.095 -15.211
    6   HG13  VAL 806          HG13      VAL 806  38.714 -19.807 -14.651
    7   HG22  VAL 806          HG21      VAL 806  38.796 -22.164 -11.877
    8   HG21  VAL 806          HG22      VAL 806  38.198 -22.630 -13.448
    9   HG23  VAL 806          HG23      VAL 806  37.819 -21.025 -12.801

  No H/Q in entry =           9
  In of MODEL    6
    1    H    GLU 807           H        GLU 807  39.937 -24.670 -13.321
    2    HA   GLU 807           HA       GLU 807  40.222 -25.536 -16.044
    3    HB2  GLU 807           HB2      GLU 807  40.687 -27.075 -14.163
    4    HB3  GLU 807           HB3      GLU 807  39.027 -26.910 -13.626
    5    HG2  GLU 807           HG2      GLU 807  38.269 -27.906 -15.746
    6    HG3  GLU 807           HG3      GLU 807  39.956 -28.112 -16.218

  No H/Q in entry =           6
  In of MODEL    6
    1    H    VAL 808           H        VAL 808  38.813 -25.102 -17.434
    2    HA   VAL 808           HA       VAL 808  35.986 -24.925 -16.799
    3    HB   VAL 808           HB       VAL 808  36.828 -22.609 -16.769
    4   HG13  VAL 808          HG11      VAL 808  38.846 -22.872 -18.049
    5   HG12  VAL 808          HG12      VAL 808  37.856 -21.586 -18.754
    6   HG11  VAL 808          HG13      VAL 808  37.913 -23.175 -19.514
    7   HG21  VAL 808          HG21      VAL 808  35.330 -23.209 -19.309
    8   HG23  VAL 808          HG22      VAL 808  35.478 -21.622 -18.561
    9   HG22  VAL 808          HG23      VAL 808  34.608 -22.916 -17.722

  No H/Q in entry =           9
  In of MODEL    6
    1    H    ASN 809           H        ASN 809  34.860 -25.994 -18.318
    2    HA   ASN 809           HA       ASN 809  34.306 -27.022 -20.291
    3    HB2  ASN 809           HB2      ASN 809  36.489 -25.214 -21.185
    4    HB3  ASN 809           HB3      ASN 809  35.852 -26.393 -22.324
    5   HD21  ASN 809          HD21      ASN 809  33.865 -24.794 -19.895
    6   HD22  ASN 809          HD22      ASN 809  32.990 -23.787 -20.970

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLY 810           H        GLY 810  36.566 -27.878 -18.397
    2    HA3  GLY 810           HA2      GLY 810  37.441 -30.057 -18.271
    3    HA2  GLY 810           HA3      GLY 810  37.379 -30.126 -20.046

  No H/Q in entry =           3
  In of MODEL    6
    1    H    LYS 811           H        LYS 811  38.630 -27.248 -19.659
    2    HA   LYS 811           HA       LYS 811  41.372 -28.300 -19.520
    3    HB2  LYS 811           HB2      LYS 811  41.960 -26.606 -21.205
    4    HB3  LYS 811           HB3      LYS 811  40.900 -27.878 -21.806
    5    HG2  LYS 811           HG2      LYS 811  38.978 -26.317 -21.517
    6    HG3  LYS 811           HG3      LYS 811  40.126 -25.058 -21.066
    7    HD2  LYS 811           HD2      LYS 811  40.108 -26.558 -23.663
    8    HD3  LYS 811           HD3      LYS 811  39.425 -24.949 -23.439
    9    HE2  LYS 811           HE2      LYS 811  41.657 -24.108 -22.786
   10    HE3  LYS 811           HE3      LYS 811  42.327 -25.712 -23.040
   11    HZ1  LYS 811           HZ1      LYS 811  41.711 -25.569 -25.354
   12    HZ3  LYS 811           HZ2      LYS 811  42.736 -24.296 -24.939
   13    HZ2  LYS 811           HZ3      LYS 811  41.083 -24.027 -25.149

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLU 812           H        GLU 812  42.981 -26.842 -18.847
    2    HA   GLU 812           HA       GLU 812  41.984 -24.951 -16.892
    3    HB2  GLU 812           HB2      GLU 812  44.855 -25.710 -17.429
    4    HB3  GLU 812           HB3      GLU 812  44.213 -24.907 -16.008
    5    HG2  GLU 812           HG2      GLU 812  44.387 -26.993 -15.137
    6    HG3  GLU 812           HG3      GLU 812  42.805 -27.161 -15.900

  No H/Q in entry =           6
  In of MODEL    6
    1    H    GLN 813           H        GLN 813  41.651 -23.004 -17.442
    2    HA   GLN 813           HA       GLN 813  43.295 -21.794 -19.538
    3    HB2  GLN 813           HB2      GLN 813  41.050 -22.126 -20.311
    4    HB3  GLN 813           HB3      GLN 813  40.392 -21.447 -18.840
    5    HG2  GLN 813           HG2      GLN 813  41.153 -19.253 -19.462
    6    HG3  GLN 813           HG3      GLN 813  41.961 -19.903 -20.892
    7   HE21  GLN 813          HE21      GLN 813  39.743 -17.938 -20.588
    8   HE22  GLN 813          HE22      GLN 813  38.460 -18.585 -21.542

  No H/Q in entry =           8
  In of MODEL    6
    1    H    THR 814           H        THR 814  44.021 -19.734 -19.195
    2    HA   THR 814           HA       THR 814  44.192 -18.872 -16.444
    3    HB   THR 814           HB       THR 814  45.376 -17.672 -18.959
    4    HG1  THR 814           HG1      THR 814  47.326 -18.762 -18.061
    5   HG23  THR 814          HG21      THR 814  47.000 -16.620 -17.422
    6   HG22  THR 814          HG22      THR 814  46.149 -17.328 -16.050
    7   HG21  THR 814          HG23      THR 814  45.347 -16.124 -17.054

  No H/Q in entry =           7
  In of MODEL    6
    1    H    MET 815           H        MET 815  42.903 -17.363 -15.682
    2    HA   MET 815           HA       MET 815  41.605 -15.551 -17.591
    3    HB2  MET 815           HB2      MET 815  40.329 -16.651 -15.090
    4    HB3  MET 815           HB3      MET 815  39.589 -15.555 -16.247
    5    HG2  MET 815           HG2      MET 815  39.952 -17.441 -17.956
    6    HG3  MET 815           HG3      MET 815  40.280 -18.402 -16.518
    7    HE3  MET 815           HE1      MET 815  38.082 -19.059 -18.673
    8    HE2  MET 815           HE2      MET 815  36.882 -19.738 -17.551
    9    HE1  MET 815           HE3      MET 815  38.614 -20.018 -17.299

  No H/Q in entry =           9
  In of MODEL    6
    1    H    SER 816           H        SER 816  40.964 -13.573 -16.619
    2    HA   SER 816           HA       SER 816  42.883 -12.602 -14.727
    3    HB2  SER 816           HB2      SER 816  40.351 -11.310 -15.785
    4    HB3  SER 816           HB3      SER 816  41.691 -10.485 -14.984
    5    HG   SER 816           HG       SER 816  42.951 -10.790 -16.711

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLU 817           H        GLU 817  42.303 -11.784 -12.667
    2    HA   GLU 817           HA       GLU 817  41.091 -13.623 -11.068
    3    HB2  GLU 817           HB2      GLU 817  42.706 -11.735 -10.548
    4    HB3  GLU 817           HB3      GLU 817  41.251 -10.741 -10.442
    5    HG2  GLU 817           HG2      GLU 817  40.460 -11.851  -8.561
    6    HG3  GLU 817           HG3      GLU 817  41.530 -13.222  -8.910

  No H/Q in entry =           6
  In of MODEL    6
    1    H    CYS 818           H        CYS 818  39.642 -10.557 -12.186
    2    HA   CYS 818           HA       CYS 818  37.216 -11.425 -10.984
    3    HB2  CYS 818           HB2      CYS 818  36.283  -9.253 -11.985
    4    HB3  CYS 818           HB3      CYS 818  37.423  -9.163 -10.657

  No H/Q in entry =           4
  In of MODEL    6
    1    H    GLU 819           H        GLU 819  38.582 -12.255 -13.809
    2    HA   GLU 819           HA       GLU 819  36.179 -12.288 -15.432
    3    HB2  GLU 819           HB2      GLU 819  38.351 -12.157 -16.559
    4    HB3  GLU 819           HB3      GLU 819  38.870 -13.647 -15.776
    5    HG2  GLU 819           HG2      GLU 819  37.298 -14.899 -17.102
    6    HG3  GLU 819           HG3      GLU 819  36.644 -13.409 -17.781

  No H/Q in entry =           6
  In of MODEL    6
    1    H    ALA 820           H        ALA 820  38.320 -14.692 -13.970
    2    HA   ALA 820           HA       ALA 820  36.638 -16.863 -14.193
    3    HB3  ALA 820           HB1      ALA 820  38.702 -16.303 -12.073
    4    HB1  ALA 820           HB2      ALA 820  38.983 -17.098 -13.626
    5    HB2  ALA 820           HB3      ALA 820  37.996 -17.885 -12.395

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLY 821           H        GLY 821  37.071 -14.387 -11.749
    2    HA3  GLY 821           HA2      GLY 821  35.403 -15.369  -9.716
    3    HA2  GLY 821           HA3      GLY 821  35.892 -13.695  -9.924

  No H/Q in entry =           3
  In of MODEL    6
    1    H    ALA 822           H        ALA 822  34.704 -13.199 -12.446
    2    HA   ALA 822           HA       ALA 822  32.060 -12.616 -11.638
    3    HB2  ALA 822           HB1      ALA 822  33.273 -11.230 -13.255
    4    HB3  ALA 822           HB2      ALA 822  31.748 -11.815 -13.930
    5    HB1  ALA 822           HB3      ALA 822  33.273 -12.570 -14.399

  No H/Q in entry =           5
  In of MODEL    6
    1    H    LEU 823           H        LEU 823  33.527 -15.015 -13.680
    2    HA   LEU 823           HA       LEU 823  31.207 -16.187 -14.672
    3    HB2  LEU 823           HB2      LEU 823  33.952 -17.324 -14.193
    4    HB3  LEU 823           HB3      LEU 823  32.721 -18.162 -15.117
    5    HG   LEU 823           HG       LEU 823  33.803 -15.428 -15.829
    6   HD12  LEU 823          HD11      LEU 823  34.984 -16.540 -17.645
    7   HD11  LEU 823          HD12      LEU 823  34.581 -18.114 -16.944
    8   HD13  LEU 823          HD13      LEU 823  35.588 -16.955 -16.061
    9   HD23  LEU 823          HD21      LEU 823  32.756 -15.856 -18.007
   10   HD22  LEU 823          HD22      LEU 823  31.581 -15.788 -16.698
   11   HD21  LEU 823          HD23      LEU 823  32.059 -17.348 -17.371

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ARG 824           H        ARG 824  32.969 -16.840 -11.670
    2    HA   ARG 824           HA       ARG 824  31.471 -19.083 -10.748
    3    HB2  ARG 824           HB2      ARG 824  32.628 -16.903  -8.987
    4    HB3  ARG 824           HB3      ARG 824  32.185 -18.514  -8.484
    5    HG2  ARG 824           HG2      ARG 824  34.039 -19.398  -9.885
    6    HG3  ARG 824           HG3      ARG 824  34.509 -17.724 -10.240
    7    HD2  ARG 824           HD2      ARG 824  34.438 -19.140  -7.585
    8    HD3  ARG 824           HD3      ARG 824  35.865 -18.581  -8.452
    9    HE   ARG 824           HE       ARG 824  34.252 -16.377  -7.995
   10   HH11  ARG 824          HH11      ARG 824  36.068 -18.690  -5.988
   11   HH12  ARG 824          HH12      ARG 824  36.386 -17.616  -4.722
   12   HH21  ARG 824          HH21      ARG 824  34.609 -14.887  -6.168
   13   HH22  ARG 824          HH22      ARG 824  35.417 -15.442  -4.779

  No H/Q in entry =          13
  In of MODEL    6
    1    H    CYS 825           H        CYS 825  30.810 -15.706 -10.783
    2    HA   CYS 825           HA       CYS 825  28.751 -15.813  -8.736
    3    HB2  CYS 825           HB2      CYS 825  30.389 -13.920  -8.917
    4    HB3  CYS 825           HB3      CYS 825  29.734 -13.567 -10.499

  No H/Q in entry =           4
  In of MODEL    6
    1    H    ARG 826           H        ARG 826  29.205 -15.321 -12.146
    2    HA   ARG 826           HA       ARG 826  26.615 -14.704 -12.896
    3    HB2  ARG 826           HB2      ARG 826  28.323 -14.023 -14.283
    4    HB3  ARG 826           HB3      ARG 826  29.113 -15.589 -14.242
    5    HG2  ARG 826           HG2      ARG 826  27.458 -16.523 -15.534
    6    HG3  ARG 826           HG3      ARG 826  26.510 -15.016 -15.574
    7    HD2  ARG 826           HD2      ARG 826  28.331 -13.911 -16.722
    8    HD3  ARG 826           HD3      ARG 826  29.323 -15.371 -16.629
    9    HE   ARG 826           HE       ARG 826  27.204 -16.241 -17.903
   10   HH11  ARG 826          HH11      ARG 826  29.089 -13.249 -18.405
   11   HH12  ARG 826          HH12      ARG 826  28.918 -13.238 -20.098
   12   HH21  ARG 826          HH21      ARG 826  26.981 -16.200 -20.290
   13   HH22  ARG 826          HH22      ARG 826  27.698 -14.958 -21.189

  No H/Q in entry =          13
  In of MODEL    6
    1    H    GLY 827           H        GLY 827  28.353 -17.848 -12.854
    2    HA3  GLY 827           HA2      GLY 827  26.645 -19.672 -12.309
    3    HA2  GLY 827           HA3      GLY 827  25.796 -19.008 -13.702

  No H/Q in entry =           3
  In of MODEL    6
    1    H    GLN 828           H        GLN 828  28.955 -18.748 -14.470
    2    HA   GLN 828           HA       GLN 828  28.924 -21.061 -16.168
    3    HB2  GLN 828           HB2      GLN 828  30.086 -19.091 -16.973
    4    HB3  GLN 828           HB3      GLN 828  31.052 -19.021 -15.511
    5    HG2  GLN 828           HG2      GLN 828  32.428 -19.851 -17.324
    6    HG3  GLN 828           HG3      GLN 828  32.127 -21.128 -16.149
    7   HE21  GLN 828          HE21      GLN 828  29.792 -20.138 -18.561
    8   HE22  GLN 828          HE22      GLN 828  29.849 -21.600 -19.460

  No H/Q in entry =           8
  In of MODEL    6
    1    H    SER 829           H        SER 829  30.035 -22.939 -15.881
    2    HA   SER 829           HA       SER 829  30.703 -23.536 -13.130
    3    HB2  SER 829           HB2      SER 829  30.599 -25.356 -15.532
    4    HB3  SER 829           HB3      SER 829  30.623 -25.850 -13.835
    5    HG   SER 829           HG       SER 829  28.643 -24.091 -14.704

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ILE 830           H        ILE 830  32.712 -23.262 -12.476
    2    HA   ILE 830           HA       ILE 830  34.916 -24.035 -14.209
    3    HB   ILE 830           HB       ILE 830  36.265 -22.080 -13.655
    4   HG12  ILE 830          HG12      ILE 830  35.110 -21.523 -11.495
    5   HG13  ILE 830          HG13      ILE 830  35.493 -20.115 -12.474
    6   HG22  ILE 830          HG21      ILE 830  33.675 -21.292 -14.896
    7   HG21  ILE 830          HG22      ILE 830  35.067 -21.989 -15.726
    8   HG23  ILE 830          HG23      ILE 830  35.171 -20.366 -15.026
    9   HD11  ILE 830          HD11      ILE 830  33.119 -20.148 -13.261
   10   HD13  ILE 830          HD12      ILE 830  33.314 -19.808 -11.558
   11   HD12  ILE 830          HD13      ILE 830  32.806 -21.417 -12.079

  No H/Q in entry =          11
  In of MODEL    6
    1    H    SER 831           H        SER 831  36.752 -24.667 -13.101
    2    HA   SER 831           HA       SER 831  36.388 -25.005 -10.219
    3    HB2  SER 831           HB2      SER 831  37.647 -26.765 -12.282
    4    HB3  SER 831           HB3      SER 831  37.706 -27.073 -10.555
    5    HG   SER 831           HG       SER 831  35.202 -26.691 -11.043

  No H/Q in entry =           5
  In of MODEL    6
    1    H    VAL 832           H        VAL 832  37.856 -23.593  -9.263
    2    HA   VAL 832           HA       VAL 832  40.218 -22.848 -10.700
    3    HB   VAL 832           HB       VAL 832  39.258 -21.131  -9.310
    4   HG13  VAL 832          HG11      VAL 832  38.212 -22.421  -7.552
    5   HG12  VAL 832          HG12      VAL 832  39.290 -21.225  -6.831
    6   HG11  VAL 832          HG13      VAL 832  39.789 -22.912  -6.936
    7   HG22  VAL 832          HG21      VAL 832  41.225 -20.395  -8.014
    8   HG21  VAL 832          HG22      VAL 832  41.648 -20.989  -9.620
    9   HG23  VAL 832          HG23      VAL 832  41.922 -22.004  -8.202

  No H/Q in entry =           9
  In of MODEL    6
    1    H    THR 833           H        THR 833  41.753 -24.108 -11.057
    2    HA   THR 833           HA       THR 833  42.386 -26.205  -9.254
    3    HB   THR 833           HB       THR 833  44.120 -26.599 -11.129
    4    HG1  THR 833           HG1      THR 833  44.042 -25.288 -12.787
    5   HG22  THR 833          HG21      THR 833  42.400 -27.586 -12.598
    6   HG21  THR 833          HG22      THR 833  41.158 -26.663 -11.754
    7   HG23  THR 833          HG23      THR 833  42.057 -27.917 -10.900

  No H/Q in entry =           7
  In of MODEL    6
    1    H    SER 834           H        SER 834  43.809 -23.227 -10.551
    2    HA   SER 834           HA       SER 834  45.786 -23.300  -8.408
    3    HB2  SER 834           HB2      SER 834  46.521 -22.833 -11.285
    4    HB3  SER 834           HB3      SER 834  47.598 -22.958  -9.901
    5    HG   SER 834           HG       SER 834  46.447 -24.945 -11.400

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ILE 835           H        ILE 835  46.190 -21.312  -7.636
    2    HA   ILE 835           HA       ILE 835  44.857 -19.027  -8.772
    3    HB   ILE 835           HB       ILE 835  46.018 -17.752  -6.994
    4   HG12  ILE 835          HG12      ILE 835  47.094 -20.459  -6.174
    5   HG13  ILE 835          HG13      ILE 835  48.035 -19.182  -6.941
    6   HG22  ILE 835          HG21      ILE 835  44.777 -18.794  -5.139
    7   HG21  ILE 835          HG22      ILE 835  44.554 -20.234  -6.136
    8   HG23  ILE 835          HG23      ILE 835  43.819 -18.707  -6.621
    9   HD11  ILE 835          HD11      ILE 835  46.626 -18.988  -4.340
   10   HD13  ILE 835          HD12      ILE 835  47.664 -17.758  -5.078
   11   HD12  ILE 835          HD13      ILE 835  48.346 -19.303  -4.558

  No H/Q in entry =          11
  In of MODEL    6
    1    H    ARG 836           H        ARG 836  47.581 -20.647  -9.454
    2    HA   ARG 836           HA       ARG 836  49.288 -18.452 -10.191
    3    HB2  ARG 836           HB2      ARG 836  49.501 -21.435 -10.526
    4    HB3  ARG 836           HB3      ARG 836  50.709 -20.301 -11.114
    5    HG2  ARG 836           HG2      ARG 836  51.022 -19.502  -8.815
    6    HG3  ARG 836           HG3      ARG 836  49.863 -20.713  -8.268
    7    HD2  ARG 836           HD2      ARG 836  52.465 -21.276  -9.681
    8    HD3  ARG 836           HD3      ARG 836  52.134 -21.387  -7.947
    9    HE   ARG 836           HE       ARG 836  50.513 -23.011  -9.768
   10   HH11  ARG 836          HH11      ARG 836  53.197 -22.987  -7.438
   11   HH12  ARG 836          HH12      ARG 836  53.076 -24.668  -7.155
   12   HH21  ARG 836          HH21      ARG 836  50.409 -25.266  -9.341
   13   HH22  ARG 836          HH22      ARG 836  51.491 -25.976  -8.246

  No H/Q in entry =          13
  In of MODEL    6
    1    HA   PRO 837           HA       PRO 837  47.314 -18.438 -14.203
    2    HB2  PRO 837           HB2      PRO 837  49.278 -17.266 -15.688
    3    HB3  PRO 837           HB3      PRO 837  48.237 -16.353 -14.593
    4    HG2  PRO 837           HG2      PRO 837  51.030 -17.339 -14.166
    5    HG3  PRO 837           HG3      PRO 837  50.306 -15.789 -13.705
    6    HD2  PRO 837           HD2      PRO 837  50.677 -17.825 -11.954
    7    HD3  PRO 837           HD3      PRO 837  49.348 -16.657 -11.808

  No H/Q in entry =           7
  In of MODEL    6
    1    H    CYS 838           H        CYS 838  47.275 -19.796 -15.974
    2    HA   CYS 838           HA       CYS 838  49.417 -21.710 -16.090
    3    HB2  CYS 838           HB2      CYS 838  46.618 -21.719 -17.145
    4    HB3  CYS 838           HB3      CYS 838  47.818 -22.777 -17.874

  No H/Q in entry =           4
  In of MODEL    6
    1    H    ALA 839           H        ALA 839  49.686 -22.471 -18.659
    2    HA   ALA 839           HA       ALA 839  50.684 -20.102 -19.983
    3    HB1  ALA 839           HB1      ALA 839  52.037 -22.162 -19.863
    4    HB3  ALA 839           HB2      ALA 839  51.704 -21.681 -21.526
    5    HB2  ALA 839           HB3      ALA 839  50.796 -23.003 -20.796

  No H/Q in entry =           5
  In of MODEL    6
    1    H    ALA 840           H        ALA 840  47.851 -20.366 -19.717
    2    HA   ALA 840           HA       ALA 840  46.950 -20.931 -22.428
    3    HB1  ALA 840           HB1      ALA 840  45.445 -20.240 -19.924
    4    HB2  ALA 840           HB2      ALA 840  45.604 -21.848 -20.634
    5    HB3  ALA 840           HB3      ALA 840  44.686 -20.591 -21.474

  No H/Q in entry =           5
  In of MODEL    6
    1    H    GLU 841           H        GLU 841  48.374 -18.487 -20.912
    2    HA   GLU 841           HA       GLU 841  46.821 -16.373 -22.194
    3    HB2  GLU 841           HB2      GLU 841  48.327 -14.792 -21.013
    4    HB3  GLU 841           HB3      GLU 841  47.567 -15.911 -19.895
    5    HG2  GLU 841           HG2      GLU 841  49.649 -17.229 -19.823
    6    HG3  GLU 841           HG3      GLU 841  50.397 -16.072 -20.922

  No H/Q in entry =           6
  In of MODEL    6
    1    H    THR 842           H        THR 842  49.526 -18.286 -22.541
    2    HA   THR 842           HA       THR 842  50.041 -17.649 -25.230
    3    HB   THR 842           HB       THR 842  52.287 -17.059 -23.248
    4    HG1  THR 842           HG1      THR 842  50.346 -15.505 -24.104
    5   HG23  THR 842          HG21      THR 842  53.546 -16.332 -25.237
    6   HG22  THR 842          HG22      THR 842  52.172 -16.762 -26.258
    7   HG21  THR 842          HG23      THR 842  53.043 -18.017 -25.380

  No H/Q in entry =           7
  In of MODEL    6
    1    H    GLN 843           H        GLN 843  50.437 -19.681 -25.964
    2    HA   GLN 843           HA       GLN 843  51.431 -21.600 -24.007
    3    HB2  GLN 843           HB2      GLN 843  50.209 -23.346 -25.376
    4    HB3  GLN 843           HB3      GLN 843  49.203 -22.215 -24.484
    5    HG2  GLN 843           HG2      GLN 843  48.791 -20.966 -26.527
    6    HG3  GLN 843           HG3      GLN 843  49.835 -22.061 -27.422
    7   HE21  GLN 843          HE21      GLN 843  48.192 -22.609 -28.777
    8   HE22  GLN 843          HE22      GLN 843  46.889 -23.648 -28.333

  No H/Q in entry =           8
  In of MODEL    7
    1    H1   GLY 689           H2       GLY 689  67.742 -13.818 -31.934
    2    H2   GLY 689           H1       GLY 689  68.540 -13.747 -30.447
    3    H3   GLY 689           H3       GLY 689  69.287 -14.484 -31.773
    4    HA2  GLY 689           HA2      GLY 689  68.445 -16.126 -30.261
    5    HA3  GLY 689           HA3      GLY 689  67.640 -16.198 -31.824

  No H/Q in entry =           5
  In of MODEL    7
    1    H    SER 690           H        SER 690  67.335 -15.179 -28.499
    2    HA   SER 690           HA       SER 690  64.521 -15.719 -28.577
    3    HB2  SER 690           HB2      SER 690  66.254 -14.670 -26.334
    4    HB3  SER 690           HB3      SER 690  64.669 -15.435 -26.183
    5    HG   SER 690           HG       SER 690  65.945 -17.212 -27.454

  No H/Q in entry =           5
  In of MODEL    7
    1    H    HIS 691           H        HIS 691  62.887 -14.192 -28.351
    2    HA   HIS 691           HA       HIS 691  63.678 -11.358 -28.608
    3    HB2  HIS 691           HB2      HIS 691  61.204 -12.799 -29.599
    4    HB3  HIS 691           HB3      HIS 691  61.398 -11.057 -29.633
    5    HD1  HIS 691           HD1      HIS 691  62.460 -10.117 -31.694
    6    HD2  HIS 691           HD2      HIS 691  63.064 -14.211 -31.343
    7    HE1  HIS 691           HE1      HIS 691  63.475 -10.830 -33.864
    8    HE2  HIS 691           HE2      HIS 691  64.112 -13.213 -33.498

  No H/Q in entry =           8
  In of MODEL    7
    1    H    MET 692           H        MET 692  62.767 -13.376 -26.319
    2    HA   MET 692           HA       MET 692  60.423 -12.043 -25.247
    3    HB2  MET 692           HB2      MET 692  62.113 -14.258 -24.090
    4    HB3  MET 692           HB3      MET 692  60.657 -13.635 -23.340
    5    HG2  MET 692           HG2      MET 692  60.841 -15.015 -26.004
    6    HG3  MET 692           HG3      MET 692  60.264 -15.729 -24.507
    7    HE2  MET 692           HE1      MET 692  58.529 -13.336 -23.246
    8    HE1  MET 692           HE2      MET 692  58.027 -15.025 -23.284
    9    HE3  MET 692           HE3      MET 692  56.931 -13.768 -23.861

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ASN 693           H        ASN 693  63.782 -11.545 -24.955
    2    HA   ASN 693           HA       ASN 693  63.564 -10.677 -22.183
    3    HB2  ASN 693           HB2      ASN 693  66.002 -11.026 -23.933
    4    HB3  ASN 693           HB3      ASN 693  66.032 -10.498 -22.256
    5   HD21  ASN 693          HD21      ASN 693  67.211 -12.815 -23.570
    6   HD22  ASN 693          HD22      ASN 693  66.624 -14.180 -22.692

  No H/Q in entry =           6
  In of MODEL    7
    1    HA   PRO 694           HA       PRO 694  63.517  -6.412 -23.392
    2    HB2  PRO 694           HB2      PRO 694  63.970  -5.271 -21.030
    3    HB3  PRO 694           HB3      PRO 694  62.483  -6.187 -21.313
    4    HG2  PRO 694           HG2      PRO 694  65.011  -7.071 -19.969
    5    HG3  PRO 694           HG3      PRO 694  63.343  -7.256 -19.406
    6    HD2  PRO 694           HD2      PRO 694  64.686  -9.250 -20.668
    7    HD3  PRO 694           HD3      PRO 694  62.930  -9.032 -20.827

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LEU 695           H        LEU 695  64.870  -4.529 -23.465
    2    HA   LEU 695           HA       LEU 695  67.736  -5.117 -23.256
    3    HB2  LEU 695           HB2      LEU 695  66.263  -3.080 -24.953
    4    HB3  LEU 695           HB3      LEU 695  67.998  -3.122 -24.797
    5    HG   LEU 695           HG       LEU 695  67.502  -4.077 -26.873
    6   HD11  LEU 695          HD11      LEU 695  69.224  -5.237 -25.706
    7   HD13  LEU 695          HD12      LEU 695  68.316  -6.346 -26.730
    8   HD12  LEU 695          HD13      LEU 695  68.048  -6.340 -24.988
    9   HD21  LEU 695          HD21      LEU 695  65.129  -4.529 -26.583
   10   HD23  LEU 695          HD22      LEU 695  65.498  -5.894 -25.527
   11   HD22  LEU 695          HD23      LEU 695  65.951  -5.947 -27.232

  No H/Q in entry =          11
  In of MODEL    7
    1    H    THR 696           H        THR 696  68.451  -4.444 -21.376
    2    HA   THR 696           HA       THR 696  68.955  -3.195 -19.602
    3    HB   THR 696           HB       THR 696  67.713  -0.880 -21.139
    4    HG1  THR 696           HG1      THR 696  70.425  -1.687 -20.776
    5   HG21  THR 696          HG21      THR 696  69.469  -0.862 -18.668
    6   HG23  THR 696          HG22      THR 696  67.764  -0.414 -18.729
    7   HG22  THR 696          HG23      THR 696  68.965   0.570 -19.566

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLN 697           H        GLN 697  67.904  -3.728 -17.847
    2    HA   GLN 697           HA       GLN 697  65.045  -3.701 -17.902
    3    HB2  GLN 697           HB2      GLN 697  66.960  -4.725 -15.795
    4    HB3  GLN 697           HB3      GLN 697  65.218  -4.775 -15.628
    5    HG2  GLN 697           HG2      GLN 697  66.031  -6.944 -16.273
    6    HG3  GLN 697           HG3      GLN 697  65.102  -6.267 -17.602
    7   HE21  GLN 697          HE21      GLN 697  68.262  -7.138 -16.460
    8   HE22  GLN 697          HE22      GLN 697  69.044  -7.115 -18.002

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ALA 698           H        ALA 698  65.105  -1.339 -18.108
    2    HA   ALA 698           HA       ALA 698  65.488   0.143 -15.654
    3    HB3  ALA 698           HB1      ALA 698  64.143   1.004 -18.224
    4    HB1  ALA 698           HB2      ALA 698  65.847   1.249 -17.851
    5    HB2  ALA 698           HB3      ALA 698  64.609   2.066 -16.898

  No H/Q in entry =           5
  In of MODEL    7
    1    H    VAL 699           H        VAL 699  63.143  -1.471 -17.300
    2    HA   VAL 699           HA       VAL 699  61.334  -1.186 -15.038
    3    HB   VAL 699           HB       VAL 699  60.718  -1.147 -17.969
    4   HG12  VAL 699          HG11      VAL 699  58.755  -1.285 -15.630
    5   HG11  VAL 699          HG12      VAL 699  59.047  -2.578 -16.792
    6   HG13  VAL 699          HG13      VAL 699  58.273  -1.080 -17.315
    7   HG22  VAL 699          HG21      VAL 699  61.267   1.031 -17.145
    8   HG21  VAL 699          HG22      VAL 699  60.114   0.874 -15.821
    9   HG23  VAL 699          HG23      VAL 699  59.537   0.990 -17.482

  No H/Q in entry =           9
  In of MODEL    7
    1    HA   PRO 700           HA       PRO 700  61.916  -5.584 -15.946
    2    HB2  PRO 700           HB2      PRO 700  61.900  -6.350 -13.294
    3    HB3  PRO 700           HB3      PRO 700  63.350  -5.889 -14.188
    4    HG2  PRO 700           HG2      PRO 700  62.065  -4.486 -12.025
    5    HG3  PRO 700           HG3      PRO 700  63.563  -4.068 -12.863
    6    HD2  PRO 700           HD2      PRO 700  60.849  -2.989 -13.225
    7    HD3  PRO 700           HD3      PRO 700  62.413  -2.303 -13.721

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LYS 701           H        LYS 701  60.585  -7.503 -15.157
    2    HA   LYS 701           HA       LYS 701  57.855  -6.576 -14.746
    3    HB2  LYS 701           HB2      LYS 701  58.869  -9.072 -16.095
    4    HB3  LYS 701           HB3      LYS 701  57.176  -8.725 -15.773
    5    HG2  LYS 701           HG2      LYS 701  57.248  -6.795 -17.194
    6    HG3  LYS 701           HG3      LYS 701  58.981  -7.011 -17.453
    7    HD2  LYS 701           HD2      LYS 701  58.535  -9.182 -18.472
    8    HD3  LYS 701           HD3      LYS 701  56.804  -8.926 -18.245
    9    HE2  LYS 701           HE2      LYS 701  57.490  -8.382 -20.545
   10    HE3  LYS 701           HE3      LYS 701  56.877  -6.970 -19.689
   11    HZ3  LYS 701           HZ1      LYS 701  59.124  -6.218 -19.339
   12    HZ2  LYS 701           HZ2      LYS 701  58.903  -6.504 -20.975
   13    HZ1  LYS 701           HZ3      LYS 701  59.758  -7.609 -20.044

  No H/Q in entry =          13
  In of MODEL    7
    1    H    CYS 702           H        CYS 702  56.960  -7.065 -12.922
    2    HA   CYS 702           HA       CYS 702  58.163  -9.160 -11.293
    3    HB2  CYS 702           HB2      CYS 702  56.352  -6.842 -10.518
    4    HB3  CYS 702           HB3      CYS 702  56.819  -8.127  -9.453

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLN 703           H        GLN 703  56.791 -10.639 -10.240
    2    HA   GLN 703           HA       GLN 703  54.589 -11.453 -11.879
    3    HB2  GLN 703           HB2      GLN 703  55.527 -12.484  -9.195
    4    HB3  GLN 703           HB3      GLN 703  54.273 -13.234 -10.166
    5    HG2  GLN 703           HG2      GLN 703  57.158 -12.909 -10.951
    6    HG3  GLN 703           HG3      GLN 703  56.400 -14.397 -10.390
    7   HE21  GLN 703          HE21      GLN 703  55.014 -15.501 -11.784
    8   HE22  GLN 703          HE22      GLN 703  54.939 -15.152 -13.471

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ARG 704           H        ARG 704  52.470 -12.007 -10.659
    2    HA   ARG 704           HA       ARG 704  51.225  -9.581 -10.092
    3    HB2  ARG 704           HB2      ARG 704  50.343 -12.371  -9.442
    4    HB3  ARG 704           HB3      ARG 704  49.323 -10.962  -9.219
    5    HG2  ARG 704           HG2      ARG 704  50.507 -11.858 -11.826
    6    HG3  ARG 704           HG3      ARG 704  48.852 -12.158 -11.294
    7    HD2  ARG 704           HD2      ARG 704  48.483  -9.736 -11.166
    8    HD3  ARG 704           HD3      ARG 704  50.112  -9.459 -11.755
    9    HE   ARG 704           HE       ARG 704  48.629 -11.154 -13.517
   10   HH11  ARG 704          HH11      ARG 704  49.127  -7.720 -12.708
   11   HH12  ARG 704          HH12      ARG 704  48.690  -7.201 -14.270
   12   HH21  ARG 704          HH21      ARG 704  48.029 -10.369 -15.620
   13   HH22  ARG 704          HH22      ARG 704  48.062  -8.684 -15.910

  No H/Q in entry =          13
  In of MODEL    7
    1    H    TRP 705           H        TRP 705  52.757 -11.756  -7.848
    2    HA   TRP 705           HA       TRP 705  51.699 -10.329  -5.542
    3    HB2  TRP 705           HB2      TRP 705  52.836 -12.174  -4.275
    4    HB3  TRP 705           HB3      TRP 705  51.563 -12.692  -5.376
    5    HD1  TRP 705           HD1      TRP 705  55.290 -13.094  -4.714
    6    HE1  TRP 705           HE1      TRP 705  56.269 -14.786  -6.355
    7    HE3  TRP 705           HE3      TRP 705  51.254 -13.663  -7.824
    8    HZ2  TRP 705           HZ2      TRP 705  55.446 -16.219  -8.662
    9    HZ3  TRP 705           HZ3      TRP 705  51.440 -15.223  -9.718
   10    HH2  TRP 705           HH2      TRP 705  53.490 -16.472 -10.122

  No H/Q in entry =          10
  In of MODEL    7
    1    H    GLU 706           H        GLU 706  54.018  -9.653  -7.615
    2    HA   GLU 706           HA       GLU 706  55.879  -8.841  -5.528
    3    HB2  GLU 706           HB2      GLU 706  56.551  -9.647  -8.376
    4    HB3  GLU 706           HB3      GLU 706  57.686  -8.993  -7.193
    5    HG2  GLU 706           HG2      GLU 706  57.262 -10.965  -5.798
    6    HG3  GLU 706           HG3      GLU 706  56.199 -11.593  -7.060

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS 707           H        LYS 707  56.870  -6.862  -5.820
    2    HA   LYS 707           HA       LYS 707  55.543  -5.066  -7.701
    3    HB2  LYS 707           HB2      LYS 707  55.175  -3.392  -5.938
    4    HB3  LYS 707           HB3      LYS 707  54.281  -4.869  -5.608
    5    HG2  LYS 707           HG2      LYS 707  56.051  -5.536  -4.006
    6    HG3  LYS 707           HG3      LYS 707  56.862  -4.003  -4.308
    7    HD2  LYS 707           HD2      LYS 707  54.074  -4.316  -3.179
    8    HD3  LYS 707           HD3      LYS 707  55.515  -3.972  -2.221
    9    HE2  LYS 707           HE2      LYS 707  55.768  -1.875  -3.541
   10    HE3  LYS 707           HE3      LYS 707  54.237  -2.252  -4.333
   11    HZ2  LYS 707           HZ1      LYS 707  54.668  -1.695  -1.453
   12    HZ1  LYS 707           HZ2      LYS 707  53.226  -2.297  -2.057
   13    HZ3  LYS 707           HZ3      LYS 707  53.763  -0.779  -2.540

  No H/Q in entry =          13
  In of MODEL    7
    1    H    LEU 708           H        LEU 708  56.807  -3.388  -8.364
    2    HA   LEU 708           HA       LEU 708  59.633  -3.562  -7.765
    3    HB2  LEU 708           HB2      LEU 708  58.909  -3.296 -10.082
    4    HB3  LEU 708           HB3      LEU 708  58.065  -1.818  -9.668
    5    HG   LEU 708           HG       LEU 708  60.277  -0.806  -9.076
    6   HD12  LEU 708          HD11      LEU 708  62.304  -1.848  -9.956
    7   HD11  LEU 708          HD12      LEU 708  61.374  -3.294 -10.354
    8   HD13  LEU 708          HD13      LEU 708  61.560  -2.800  -8.673
    9   HD21  LEU 708          HD21      LEU 708  59.899  -1.774 -11.899
   10   HD23  LEU 708          HD22      LEU 708  60.963  -0.458 -11.411
   11   HD22  LEU 708          HD23      LEU 708  59.218  -0.311 -11.186

  No H/Q in entry =          11
  In of MODEL    7
    1    H    GLN 709           H        GLN 709  60.259  -2.552  -5.944
    2    HA   GLN 709           HA       GLN 709  59.635   0.274  -5.586
    3    HB2  GLN 709           HB2      GLN 709  58.908   0.088  -3.322
    4    HB3  GLN 709           HB3      GLN 709  57.981  -1.136  -4.182
    5    HG2  GLN 709           HG2      GLN 709  59.479  -2.872  -3.397
    6    HG3  GLN 709           HG3      GLN 709  60.474  -1.666  -2.612
    7   HE21  GLN 709          HE21      GLN 709  60.220  -2.603  -0.640
    8   HE22  GLN 709          HE22      GLN 709  58.755  -2.500   0.270

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ASN 710           H        ASN 710  61.250   1.293  -4.395
    2    HA   ASN 710           HA       ASN 710  63.352   1.652  -3.578
    3    HB2  ASN 710           HB2      ASN 710  62.405  -0.007  -1.843
    4    HB3  ASN 710           HB3      ASN 710  63.215  -1.255  -2.745
    5   HD21  ASN 710          HD21      ASN 710  64.220  -1.713  -0.775
    6   HD22  ASN 710          HD22      ASN 710  65.593  -0.790  -0.261

  No H/Q in entry =           6
  In of MODEL    7
    1    H    SER 711           H        SER 711  62.892   0.675  -6.282
    2    HA   SER 711           HA       SER 711  64.006   0.231  -8.167
    3    HB2  SER 711           HB2      SER 711  66.441   0.426  -6.401
    4    HB3  SER 711           HB3      SER 711  66.477   0.439  -8.174
    5    HG   SER 711           HG       SER 711  64.861   2.233  -6.747

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ARG 712           H        ARG 712  63.255  -1.982  -6.189
    2    HA   ARG 712           HA       ARG 712  64.701  -4.111  -7.585
    3    HB2  ARG 712           HB2      ARG 712  64.956  -5.365  -5.497
    4    HB3  ARG 712           HB3      ARG 712  65.798  -3.825  -5.384
    5    HG2  ARG 712           HG2      ARG 712  63.957  -2.898  -4.107
    6    HG3  ARG 712           HG3      ARG 712  63.075  -4.410  -4.246
    7    HD2  ARG 712           HD2      ARG 712  64.066  -4.427  -2.093
    8    HD3  ARG 712           HD3      ARG 712  65.061  -5.490  -3.090
    9    HE   ARG 712           HE       ARG 712  66.152  -2.955  -3.227
   10   HH11  ARG 712          HH11      ARG 712  65.753  -5.549  -0.853
   11   HH12  ARG 712          HH12      ARG 712  67.016  -5.004   0.155
   12   HH21  ARG 712          HH21      ARG 712  67.868  -2.195  -1.835
   13   HH22  ARG 712          HH22      ARG 712  68.249  -3.062  -0.418

  No H/Q in entry =          13
  In of MODEL    7
    1    H    CYS 713           H        CYS 713  63.477  -6.249  -7.237
    2    HA   CYS 713           HA       CYS 713  60.633  -5.612  -7.096
    3    HB2  CYS 713           HB2      CYS 713  61.380  -6.659  -9.269
    4    HB3  CYS 713           HB3      CYS 713  61.880  -8.090  -8.358

  No H/Q in entry =           4
  In of MODEL    7
    1    H    VAL 714           H        VAL 714  59.594  -6.249  -5.417
    2    HA   VAL 714           HA       VAL 714  60.664  -8.382  -3.705
    3    HB   VAL 714           HB       VAL 714  59.866  -7.112  -1.721
    4   HG11  VAL 714          HG11      VAL 714  61.875  -5.676  -3.414
    5   HG13  VAL 714          HG12      VAL 714  62.200  -6.975  -2.262
    6   HG12  VAL 714          HG13      VAL 714  61.638  -5.398  -1.691
    7   HG23  VAL 714          HG21      VAL 714  59.361  -4.697  -1.950
    8   HG22  VAL 714          HG22      VAL 714  58.184  -5.725  -2.759
    9   HG21  VAL 714          HG23      VAL 714  59.405  -4.885  -3.703

  No H/Q in entry =           9
  In of MODEL    7
    1    H    CYS 715           H        CYS 715  58.799  -8.844  -2.008
    2    HA   CYS 715           HA       CYS 715  56.505  -9.492  -3.638
    3    HB2  CYS 715           HB2      CYS 715  57.224 -10.127  -0.770
    4    HB3  CYS 715           HB3      CYS 715  55.688 -10.566  -1.497

  No H/Q in entry =           4
  In of MODEL    7
    1    H    LYS 716           H        LYS 716  54.552  -8.714  -3.330
    2    HA   LYS 716           HA       LYS 716  54.345  -6.062  -2.378
    3    HB2  LYS 716           HB2      LYS 716  53.176  -6.877  -4.380
    4    HB3  LYS 716           HB3      LYS 716  52.293  -8.031  -3.407
    5    HG2  LYS 716           HG2      LYS 716  50.923  -6.353  -2.484
    6    HG3  LYS 716           HG3      LYS 716  52.006  -5.063  -3.007
    7    HD2  LYS 716           HD2      LYS 716  49.968  -5.229  -4.409
    8    HD3  LYS 716           HD3      LYS 716  51.451  -5.470  -5.325
    9    HE2  LYS 716           HE2      LYS 716  51.095  -7.932  -5.130
   10    HE3  LYS 716           HE3      LYS 716  49.541  -7.595  -4.360
   11    HZ1  LYS 716           HZ1      LYS 716  50.298  -6.645  -7.065
   12    HZ3  LYS 716           HZ2      LYS 716  48.751  -6.603  -6.376
   13    HZ2  LYS 716           HZ3      LYS 716  49.464  -8.059  -6.786

  No H/Q in entry =          13
  In of MODEL    7
    1    H    MET 717           H        MET 717  52.421  -5.500  -0.855
    2    HA   MET 717           HA       MET 717  52.875  -7.135   1.511
    3    HB2  MET 717           HB2      MET 717  51.391  -4.539   1.205
    4    HB3  MET 717           HB3      MET 717  51.869  -5.287   2.712
    5    HG2  MET 717           HG2      MET 717  53.872  -4.340   0.669
    6    HG3  MET 717           HG3      MET 717  53.215  -3.284   1.903
    7    HE2  MET 717           HE1      MET 717  56.211  -6.743   2.661
    8    HE1  MET 717           HE2      MET 717  55.485  -6.373   1.084
    9    HE3  MET 717           HE3      MET 717  54.542  -7.163   2.359

  No H/Q in entry =           9
  In of MODEL    7
    1    HA   PRO 718           HA       PRO 718  49.064  -9.280   0.985
    2    HB2  PRO 718           HB2      PRO 718  48.471  -9.902   3.587
    3    HB3  PRO 718           HB3      PRO 718  49.708 -10.739   2.645
    4    HG2  PRO 718           HG2      PRO 718  50.027  -8.534   4.645
    5    HG3  PRO 718           HG3      PRO 718  50.997 -10.006   4.444
    6    HD2  PRO 718           HD2      PRO 718  51.834  -7.618   3.521
    7    HD3  PRO 718           HD3      PRO 718  52.184  -9.128   2.660

  No H/Q in entry =           7
  In of MODEL    7
    1    H    TYR 719           H        TYR 719  49.344  -6.474   2.825
    2    HA   TYR 719           HA       TYR 719  46.490  -6.212   3.246
    3    HB2  TYR 719           HB2      TYR 719  47.074  -4.161   4.551
    4    HB3  TYR 719           HB3      TYR 719  47.735  -5.652   5.194
    5    HD1  TYR 719           HD1      TYR 719  48.508  -2.436   3.623
    6    HD2  TYR 719           HD2      TYR 719  50.167  -6.030   5.210
    7    HE1  TYR 719           HE1      TYR 719  50.710  -1.371   3.726
    8    HE2  TYR 719           HE2      TYR 719  52.372  -4.967   5.326
    9    HH   TYR 719           HH       TYR 719  52.771  -1.593   4.872

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLU 720           H        GLU 720  48.676  -5.543   0.882
    2    HA   GLU 720           HA       GLU 720  47.315  -3.177  -0.068
    3    HB2  GLU 720           HB2      GLU 720  49.586  -4.839  -1.043
    4    HB3  GLU 720           HB3      GLU 720  48.872  -3.606  -2.092
    5    HG2  GLU 720           HG2      GLU 720  49.429  -1.948  -0.355
    6    HG3  GLU 720           HG3      GLU 720  50.250  -3.195   0.567

  No H/Q in entry =           6
  In of MODEL    7
    1    H    CYS 721           H        CYS 721  46.895  -6.425  -0.017
    2    HA   CYS 721           HA       CYS 721  45.820  -6.790  -2.653
    3    HB2  CYS 721           HB2      CYS 721  45.660  -8.576  -0.235
    4    HB3  CYS 721           HB3      CYS 721  45.254  -9.026  -1.882

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLY 722           H        GLY 722  44.224  -5.130  -2.596
    2    HA3  GLY 722           HA2      GLY 722  41.963  -5.418  -0.821
    3    HA2  GLY 722           HA3      GLY 722  42.095  -4.302  -2.183

  No H/Q in entry =           3
  In of MODEL    7
    1    HA   PRO 723           HA       PRO 723  39.821  -7.195  -4.677
    2    HB2  PRO 723           HB2      PRO 723  41.027  -7.001  -7.103
    3    HB3  PRO 723           HB3      PRO 723  40.035  -5.691  -6.449
    4    HG2  PRO 723           HG2      PRO 723  43.011  -5.969  -6.489
    5    HG3  PRO 723           HG3      PRO 723  42.016  -4.541  -6.822
    6    HD2  PRO 723           HD2      PRO 723  43.258  -4.964  -4.439
    7    HD3  PRO 723           HD3      PRO 723  41.736  -4.068  -4.586

  No H/Q in entry =           7
  In of MODEL    7
    1    H    SER 724           H        SER 724  39.951  -9.397  -4.626
    2    HA   SER 724           HA       SER 724  42.059 -10.927  -5.803
    3    HB2  SER 724           HB2      SER 724  41.770 -11.013  -2.783
    4    HB3  SER 724           HB3      SER 724  42.718 -12.128  -3.760
    5    HG   SER 724           HG       SER 724  43.342  -9.548  -4.206

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU 725           H        LEU 725  41.308 -12.938  -6.251
    2    HA   LEU 725           HA       LEU 725  38.621 -13.724  -5.737
    3    HB2  LEU 725           HB2      LEU 725  41.035 -15.194  -6.725
    4    HB3  LEU 725           HB3      LEU 725  39.523 -16.028  -6.438
    5    HG   LEU 725           HG       LEU 725  39.842 -13.734  -8.377
    6   HD11  LEU 725          HD11      LEU 725  39.735 -16.715  -8.847
    7   HD13  LEU 725          HD12      LEU 725  41.158 -15.690  -9.056
    8   HD12  LEU 725          HD13      LEU 725  39.750 -15.469 -10.092
    9   HD23  LEU 725          HD21      LEU 725  37.698 -14.536  -9.200
   10   HD22  LEU 725          HD22      LEU 725  37.588 -14.023  -7.521
   11   HD21  LEU 725          HD23      LEU 725  37.648 -15.745  -7.920

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ASP 726           H        ASP 726  37.746 -14.749  -4.143
    2    HA   ASP 726           HA       ASP 726  39.193 -15.294  -1.718
    3    HB2  ASP 726           HB2      ASP 726  36.313 -15.924  -2.432
    4    HB3  ASP 726           HB3      ASP 726  37.012 -15.922  -0.819

  No H/Q in entry =           4
  In of MODEL    7
    1    H    VAL 727           H        VAL 727  40.002 -17.237  -1.104
    2    HA   VAL 727           HA       VAL 727  38.990 -19.681  -2.336
    3    HB   VAL 727           HB       VAL 727  41.305 -20.548  -2.724
    4   HG11  VAL 727          HG11      VAL 727  40.041 -19.715  -4.618
    5   HG13  VAL 727          HG12      VAL 727  41.754 -19.350  -4.812
    6   HG12  VAL 727          HG13      VAL 727  40.634 -18.082  -4.316
    7   HG22  VAL 727          HG21      VAL 727  43.191 -18.970  -2.869
    8   HG21  VAL 727          HG22      VAL 727  42.542 -19.063  -1.232
    9   HG23  VAL 727          HG23      VAL 727  42.151 -17.684  -2.257

  No H/Q in entry =           9
  In of MODEL    7
    1    H    CYS 728           H        CYS 728  39.644 -21.633  -1.155
    2    HA   CYS 728           HA       CYS 728  40.182 -21.037   1.649
    3    HB2  CYS 728           HB2      CYS 728  39.101 -23.543   0.342
    4    HB3  CYS 728           HB3      CYS 728  39.408 -23.353   2.062

  No H/Q in entry =           4
  In of MODEL    7
    1    H    ALA 729           H        ALA 729  42.058 -21.567   2.514
    2    HA   ALA 729           HA       ALA 729  43.806 -23.354   0.991
    3    HB1  ALA 729           HB1      ALA 729  44.568 -20.878   2.501
    4    HB3  ALA 729           HB2      ALA 729  44.506 -21.022   0.744
    5    HB2  ALA 729           HB3      ALA 729  45.682 -21.963   1.670

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLN 730           H        GLN 730  45.287 -24.500   2.295
    2    HA   GLN 730           HA       GLN 730  44.330 -24.809   5.031
    3    HB2  GLN 730           HB2      GLN 730  44.179 -26.845   3.513
    4    HB3  GLN 730           HB3      GLN 730  45.923 -26.784   3.419
    5    HG2  GLN 730           HG2      GLN 730  46.214 -27.154   5.694
    6    HG3  GLN 730           HG3      GLN 730  44.519 -26.935   6.056
    7   HE21  GLN 730          HE21      GLN 730  46.121 -29.062   6.756
    8   HE22  GLN 730          HE22      GLN 730  45.554 -30.516   6.007

  No H/Q in entry =           8
  In of MODEL    7
    1    H    ASP 731           H        ASP 731  45.596 -24.133   6.504
    2    HA   ASP 731           HA       ASP 731  48.193 -23.139   5.905
    3    HB2  ASP 731           HB2      ASP 731  46.802 -22.074   7.639
    4    HB3  ASP 731           HB3      ASP 731  46.871 -23.546   8.576

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLU 732           H        GLU 732  50.169 -23.983   6.423
    2    HA   GLU 732           HA       GLU 732  50.147 -26.825   6.890
    3    HB2  GLU 732           HB2      GLU 732  52.248 -24.949   5.913
    4    HB3  GLU 732           HB3      GLU 732  52.619 -26.614   6.346
    5    HG2  GLU 732           HG2      GLU 732  50.646 -25.709   4.265
    6    HG3  GLU 732           HG3      GLU 732  52.236 -26.426   3.970

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ARG 733           H        ARG 733  50.601 -24.086   8.887
    2    HA   ARG 733           HA       ARG 733  52.448 -25.495  10.583
    3    HB2  ARG 733           HB2      ARG 733  51.110 -22.817  10.860
    4    HB3  ARG 733           HB3      ARG 733  52.378 -23.460  11.887
    5    HG2  ARG 733           HG2      ARG 733  52.594 -22.715   8.985
    6    HG3  ARG 733           HG3      ARG 733  53.295 -21.839  10.345
    7    HD2  ARG 733           HD2      ARG 733  54.673 -23.878  10.825
    8    HD3  ARG 733           HD3      ARG 733  54.045 -24.587   9.335
    9    HE   ARG 733           HE       ARG 733  55.233 -21.982   9.124
   10   HH11  ARG 733          HH11      ARG 733  55.706 -25.478   8.643
   11   HH12  ARG 733          HH12      ARG 733  57.138 -25.311   7.759
   12   HH21  ARG 733          HH21      ARG 733  57.227 -21.751   7.896
   13   HH22  ARG 733          HH22      ARG 733  58.026 -23.120   7.308

  No H/Q in entry =          13
  In of MODEL    7
    1    H    SER 734           H        SER 734  49.206 -24.179  10.591
    2    HA   SER 734           HA       SER 734  48.521 -25.341  13.154
    3    HB2  SER 734           HB2      SER 734  46.643 -24.048  11.205
    4    HB3  SER 734           HB3      SER 734  46.566 -24.059  12.968
    5    HG   SER 734           HG       SER 734  48.248 -22.620  11.238

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LYS 735           H        LYS 735  48.185 -26.001   9.760
    2    HA   LYS 735           HA       LYS 735  47.125 -27.497   8.479
    3    HB2  LYS 735           HB2      LYS 735  47.194 -29.241  10.953
    4    HB3  LYS 735           HB3      LYS 735  46.899 -29.801   9.313
    5    HG2  LYS 735           HG2      LYS 735  49.451 -28.518  10.293
    6    HG3  LYS 735           HG3      LYS 735  49.199 -30.244  10.070
    7    HD2  LYS 735           HD2      LYS 735  48.980 -28.198   7.862
    8    HD3  LYS 735           HD3      LYS 735  50.444 -29.113   8.202
    9    HE2  LYS 735           HE2      LYS 735  49.133 -31.203   7.822
   10    HE3  LYS 735           HE3      LYS 735  47.760 -30.203   7.365
   11    HZ3  LYS 735           HZ1      LYS 735  48.912 -30.937   5.410
   12    HZ2  LYS 735           HZ2      LYS 735  50.380 -30.332   5.963
   13    HZ1  LYS 735           HZ3      LYS 735  49.193 -29.277   5.530

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ARG 736           H        ARG 736  45.419 -25.931   8.436
    2    HA   ARG 736           HA       ARG 736  42.933 -27.275   8.816
    3    HB2  ARG 736           HB2      ARG 736  41.858 -25.548  10.145
    4    HB3  ARG 736           HB3      ARG 736  43.170 -26.322  11.020
    5    HG2  ARG 736           HG2      ARG 736  44.605 -24.414  10.496
    6    HG3  ARG 736           HG3      ARG 736  43.234 -23.627   9.705
    7    HD2  ARG 736           HD2      ARG 736  43.567 -22.869  11.941
    8    HD3  ARG 736           HD3      ARG 736  41.990 -23.657  11.775
    9    HE   ARG 736           HE       ARG 736  43.464 -25.679  12.654
   10   HH11  ARG 736          HH11      ARG 736  43.225 -22.379  13.911
   11   HH12  ARG 736          HH12      ARG 736  43.718 -22.809  15.478
   12   HH21  ARG 736          HH21      ARG 736  44.080 -26.264  14.780
   13   HH22  ARG 736          HH22      ARG 736  44.195 -25.095  16.000

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ILE 737           H        ILE 737  41.173 -26.092   7.723
    2    HA   ILE 737           HA       ILE 737  42.259 -24.636   5.474
    3    HB   ILE 737           HB       ILE 737  39.335 -25.096   5.974
    4   HG12  ILE 737          HG12      ILE 737  40.532 -27.312   6.288
    5   HG13  ILE 737          HG13      ILE 737  39.397 -27.283   4.948
    6   HG23  ILE 737          HG21      ILE 737  39.240 -25.035   3.561
    7   HG22  ILE 737          HG22      ILE 737  40.993 -25.076   3.462
    8   HG21  ILE 737          HG23      ILE 737  40.198 -23.657   4.129
    9   HD12  ILE 737          HD11      ILE 737  42.391 -27.066   4.772
   10   HD11  ILE 737          HD12      ILE 737  41.230 -26.931   3.433
   11   HD13  ILE 737          HD13      ILE 737  41.383 -28.453   4.312

  No H/Q in entry =          11
  In of MODEL    7
    1    H    LEU 738           H        LEU 738  42.175 -22.483   5.359
    2    HA   LEU 738           HA       LEU 738  40.179 -21.063   6.916
    3    HB2  LEU 738           HB2      LEU 738  41.766 -19.257   7.468
    4    HB3  LEU 738           HB3      LEU 738  42.245 -20.773   8.188
    5    HG   LEU 738           HG       LEU 738  43.501 -19.779   5.637
    6   HD12  LEU 738          HD11      LEU 738  44.362 -19.286   8.489
    7   HD11  LEU 738          HD12      LEU 738  43.737 -18.063   7.381
    8   HD13  LEU 738          HD13      LEU 738  45.277 -18.845   7.049
    9   HD21  LEU 738          HD21      LEU 738  43.703 -22.089   6.287
   10   HD23  LEU 738          HD22      LEU 738  44.382 -21.593   7.839
   11   HD22  LEU 738          HD23      LEU 738  45.273 -21.274   6.332

  No H/Q in entry =          11
  In of MODEL    7
    1    HA   PRO 739           HA       PRO 739  39.432 -18.944   3.132
    2    HB2  PRO 739           HB2      PRO 739  38.416 -16.621   4.089
    3    HB3  PRO 739           HB3      PRO 739  37.517 -18.140   4.159
    4    HG2  PRO 739           HG2      PRO 739  39.109 -16.786   6.304
    5    HG3  PRO 739           HG3      PRO 739  37.523 -17.569   6.420
    6    HD2  PRO 739           HD2      PRO 739  39.857 -18.846   7.178
    7    HD3  PRO 739           HD3      PRO 739  38.439 -19.691   6.507

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LEU 740           H        LEU 740  40.921 -18.129   1.882
    2    HA   LEU 740           HA       LEU 740  42.417 -15.768   2.741
    3    HB2  LEU 740           HB2      LEU 740  43.497 -18.187   1.321
    4    HB3  LEU 740           HB3      LEU 740  44.305 -16.642   1.300
    5    HG   LEU 740           HG       LEU 740  43.856 -18.426   3.686
    6   HD12  LEU 740          HD11      LEU 740  46.308 -18.545   3.622
    7   HD11  LEU 740          HD12      LEU 740  46.291 -17.549   2.153
    8   HD13  LEU 740          HD13      LEU 740  45.565 -19.146   2.137
    9   HD21  LEU 740          HD21      LEU 740  45.197 -15.715   3.524
   10   HD23  LEU 740          HD22      LEU 740  45.199 -16.779   4.925
   11   HD22  LEU 740          HD23      LEU 740  43.689 -16.065   4.371

  No H/Q in entry =          11
  In of MODEL    7
    1    H    THR 741           H        THR 741  43.658 -15.114   0.582
    2    HA   THR 741           HA       THR 741  41.777 -15.206  -1.608
    3    HB   THR 741           HB       THR 741  42.951 -12.719  -1.702
    4    HG1  THR 741           HG1      THR 741  41.939 -13.162   0.911
    5   HG21  THR 741          HG21      THR 741  40.258 -13.541  -0.657
    6   HG23  THR 741          HG22      THR 741  40.776 -13.313  -2.345
    7   HG22  THR 741          HG23      THR 741  40.724 -11.920  -1.241

  No H/Q in entry =           7
  In of MODEL    7
    1    H    VAL 742           H        VAL 742  42.770 -14.896  -3.608
    2    HA   VAL 742           HA       VAL 742  45.146 -16.217  -3.925
    3    HB   VAL 742           HB       VAL 742  43.702 -16.199  -5.788
    4   HG11  VAL 742          HG11      VAL 742  42.593 -14.114  -5.439
    5   HG13  VAL 742          HG12      VAL 742  43.164 -14.403  -7.094
    6   HG12  VAL 742          HG13      VAL 742  44.036 -13.249  -6.053
    7   HG21  VAL 742          HG21      VAL 742  46.139 -16.190  -6.342
    8   HG23  VAL 742          HG22      VAL 742  45.969 -14.455  -6.629
    9   HG22  VAL 742          HG23      VAL 742  45.080 -15.596  -7.628

  No H/Q in entry =           9
  In of MODEL    7
    1    H    CYS 743           H        CYS 743  44.863 -12.652  -3.918
    2    HA   CYS 743           HA       CYS 743  47.588 -12.285  -4.455
    3    HB2  CYS 743           HB2      CYS 743  45.992 -10.470  -4.739
    4    HB3  CYS 743           HB3      CYS 743  45.645 -10.485  -3.017

  No H/Q in entry =           4
  In of MODEL    7
    1    H    LYS 744           H        LYS 744  45.769 -12.452  -1.374
    2    HA   LYS 744           HA       LYS 744  47.983 -11.904   0.263
    3    HB2  LYS 744           HB2      LYS 744  45.499 -13.486   0.876
    4    HB3  LYS 744           HB3      LYS 744  46.686 -13.004   2.078
    5    HG2  LYS 744           HG2      LYS 744  46.214 -10.626   1.509
    6    HG3  LYS 744           HG3      LYS 744  44.987 -11.176   0.367
    7    HD2  LYS 744           HD2      LYS 744  43.866 -12.338   2.296
    8    HD3  LYS 744           HD3      LYS 744  44.993 -11.499   3.364
    9    HE2  LYS 744           HE2      LYS 744  43.089 -10.153   1.441
   10    HE3  LYS 744           HE3      LYS 744  42.798 -10.364   3.159
   11    HZ2  LYS 744           HZ1      LYS 744  43.629  -8.157   2.573
   12    HZ1  LYS 744           HZ2      LYS 744  45.135  -8.807   2.102
   13    HZ3  LYS 744           HZ3      LYS 744  44.586  -8.945   3.674

  No H/Q in entry =          13
  In of MODEL    7
    1    H    MET 745           H        MET 745  46.630 -15.011  -0.747
    2    HA   MET 745           HA       MET 745  48.364 -16.764   0.555
    3    HB2  MET 745           HB2      MET 745  46.687 -17.925  -0.406
    4    HB3  MET 745           HB3      MET 745  46.555 -16.863  -1.785
    5    HG2  MET 745           HG2      MET 745  47.216 -18.966  -2.670
    6    HG3  MET 745           HG3      MET 745  48.645 -17.970  -2.676
    7    HE2  MET 745           HE1      MET 745  47.876 -21.398   0.274
    8    HE1  MET 745           HE2      MET 745  46.746 -20.801  -0.952
    9    HE3  MET 745           HE3      MET 745  47.091 -19.833   0.479

  No H/Q in entry =           9
  In of MODEL    7
    1    H    HIS 746           H        HIS 746  48.764 -15.199  -2.600
    2    HA   HIS 746           HA       HIS 746  51.173 -16.671  -3.192
    3    HB2  HIS 746           HB2      HIS 746  49.817 -14.376  -4.413
    4    HB3  HIS 746           HB3      HIS 746  51.528 -14.615  -4.814
    5    HD1  HIS 746           HD1      HIS 746  51.999 -17.093  -5.917
    6    HD2  HIS 746           HD2      HIS 746  48.100 -15.688  -5.879
    7    HE1  HIS 746           HE1      HIS 746  50.846 -18.310  -7.732
    8    HE2  HIS 746           HE2      HIS 746  48.506 -17.346  -7.783

  No H/Q in entry =           8
  In of MODEL    7
    1    H    VAL 747           H        VAL 747  50.481 -13.496  -1.966
    2    HA   VAL 747           HA       VAL 747  53.116 -12.629  -1.810
    3    HB   VAL 747           HB       VAL 747  50.538 -11.787  -0.508
    4   HG12  VAL 747          HG11      VAL 747  53.253 -10.541  -0.026
    5   HG11  VAL 747          HG12      VAL 747  52.296 -11.404   1.169
    6   HG13  VAL 747          HG13      VAL 747  51.708  -9.878   0.507
    7   HG23  VAL 747          HG21      VAL 747  52.445 -10.465  -2.425
    8   HG22  VAL 747          HG22      VAL 747  50.922  -9.769  -1.869
    9   HG21  VAL 747          HG23      VAL 747  50.927 -11.234  -2.856

  No H/Q in entry =           9
  In of MODEL    7
    1    H    LEU 748           H        LEU 748  51.021 -14.094   0.692
    2    HA   LEU 748           HA       LEU 748  53.106 -14.102   2.570
    3    HB2  LEU 748           HB2      LEU 748  51.695 -15.635   3.940
    4    HB3  LEU 748           HB3      LEU 748  50.823 -14.239   3.359
    5    HG   LEU 748           HG       LEU 748  49.796 -15.742   1.622
    6   HD13  LEU 748          HD11      LEU 748  49.742 -18.129   2.047
    7   HD12  LEU 748          HD12      LEU 748  50.861 -17.931   3.391
    8   HD11  LEU 748          HD13      LEU 748  51.402 -17.605   1.746
    9   HD23  LEU 748          HD21      LEU 748  48.169 -16.659   3.206
   10   HD22  LEU 748          HD22      LEU 748  48.592 -14.985   3.562
   11   HD21  LEU 748          HD23      LEU 748  49.279 -16.294   4.530

  No H/Q in entry =          11
  In of MODEL    7
    1    H    HIS 749           H        HIS 749  52.296 -16.239   0.028
    2    HA   HIS 749           HA       HIS 749  53.767 -18.488   0.878
    3    HB2  HIS 749           HB2      HIS 749  52.016 -18.325  -1.010
    4    HB3  HIS 749           HB3      HIS 749  53.340 -17.742  -2.009
    5    HD1  HIS 749           HD1      HIS 749  54.996 -19.505  -2.889
    6    HD2  HIS 749           HD2      HIS 749  52.211 -20.994  -0.202
    7    HE1  HIS 749           HE1      HIS 749  55.211 -21.992  -3.018
    8    HE2  HIS 749           HE2      HIS 749  53.724 -22.840  -1.173

  No H/Q in entry =           8
  In of MODEL    7
    1    H    CYS 750           H        CYS 750  54.627 -15.632  -1.106
    2    HA   CYS 750           HA       CYS 750  57.272 -16.679  -1.456
    3    HB2  CYS 750           HB2      CYS 750  57.766 -14.644  -2.728
    4    HB3  CYS 750           HB3      CYS 750  56.242 -15.349  -3.253

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLN 751           H        GLN 751  55.654 -14.607   0.813
    2    HA   GLN 751           HA       GLN 751  57.993 -13.516   1.930
    3    HB2  GLN 751           HB2      GLN 751  55.273 -13.938   3.159
    4    HB3  GLN 751           HB3      GLN 751  56.568 -13.018   3.916
    5    HG2  GLN 751           HG2      GLN 751  56.583 -11.501   1.978
    6    HG3  GLN 751           HG3      GLN 751  55.248 -12.408   1.294
    7   HE21  GLN 751          HE21      GLN 751  55.408  -9.679   2.018
    8   HE22  GLN 751          HE22      GLN 751  54.159  -9.365   3.182

  No H/Q in entry =           8
  In of MODEL    7
    1    H    GLY 752           H        GLY 752  56.626 -16.625   2.092
    2    HA3  GLY 752           HA2      GLY 752  58.220 -18.353   2.842
    3    HA2  GLY 752           HA3      GLY 752  58.565 -17.312   4.210

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ARG 753           H        ARG 753  55.260 -17.720   3.184
    2    HA   ARG 753           HA       ARG 753  54.827 -19.326   5.596
    3    HB2  ARG 753           HB2      ARG 753  52.817 -17.801   3.943
    4    HB3  ARG 753           HB3      ARG 753  52.507 -18.632   5.462
    5    HG2  ARG 753           HG2      ARG 753  54.231 -16.198   5.064
    6    HG3  ARG 753           HG3      ARG 753  52.622 -16.228   5.777
    7    HD2  ARG 753           HD2      ARG 753  55.069 -17.598   6.868
    8    HD3  ARG 753           HD3      ARG 753  54.370 -16.093   7.457
    9    HE   ARG 753           HE       ARG 753  52.609 -18.392   7.476
   10   HH11  ARG 753          HH11      ARG 753  54.817 -16.338   9.354
   11   HH12  ARG 753          HH12      ARG 753  54.305 -16.938  10.858
   12   HH21  ARG 753          HH21      ARG 753  51.879 -19.160   9.565
   13   HH22  ARG 753          HH22      ARG 753  52.590 -18.586  10.990

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ASN 754           H        ASN 754  54.380 -21.401   5.333
    2    HA   ASN 754           HA       ASN 754  53.818 -22.350   2.669
    3    HB2  ASN 754           HB2      ASN 754  54.328 -23.898   5.215
    4    HB3  ASN 754           HB3      ASN 754  54.013 -24.641   3.652
    5   HD21  ASN 754          HD21      ASN 754  56.304 -24.968   5.253
    6   HD22  ASN 754          HD22      ASN 754  57.658 -24.360   4.361

  No H/Q in entry =           6
  In of MODEL    7
    1    H    TYR 755           H        TYR 755  51.952 -22.677   1.949
    2    HA   TYR 755           HA       TYR 755  49.779 -23.525   3.674
    3    HB2  TYR 755           HB2      TYR 755  49.779 -21.147   1.819
    4    HB3  TYR 755           HB3      TYR 755  48.312 -22.044   2.153
    5    HD1  TYR 755           HD1      TYR 755  46.949 -21.276   3.824
    6    HD2  TYR 755           HD2      TYR 755  51.070 -20.303   4.007
    7    HE1  TYR 755           HE1      TYR 755  46.517 -19.836   5.750
    8    HE2  TYR 755           HE2      TYR 755  50.638 -18.862   5.956
    9    HH   TYR 755           HH       TYR 755  47.666 -18.910   7.643

  No H/Q in entry =           9
  In of MODEL    7
    1    H    THR 756           H        THR 756  48.231 -24.701   2.519
    2    HA   THR 756           HA       THR 756  49.058 -25.641  -0.124
    3    HB   THR 756           HB       THR 756  47.464 -26.983   2.085
    4    HG1  THR 756           HG1      THR 756  49.371 -27.430   2.847
    5   HG23  THR 756          HG21      THR 756  46.824 -27.772  -0.119
    6   HG22  THR 756          HG22      THR 756  47.724 -29.029   0.738
    7   HG21  THR 756          HG23      THR 756  48.515 -28.079  -0.530

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LEU 757           H        LEU 757  47.177 -25.882  -1.607
    2    HA   LEU 757           HA       LEU 757  44.967 -24.268  -0.645
    3    HB2  LEU 757           HB2      LEU 757  45.795 -24.821  -3.469
    4    HB3  LEU 757           HB3      LEU 757  44.308 -24.010  -3.015
    5    HG   LEU 757           HG       LEU 757  46.073 -22.546  -1.666
    6   HD12  LEU 757          HD11      LEU 757  47.993 -22.046  -3.097
    7   HD11  LEU 757          HD12      LEU 757  47.550 -23.399  -4.139
    8   HD13  LEU 757          HD13      LEU 757  48.022 -23.694  -2.466
    9   HD23  LEU 757          HD21      LEU 757  45.218 -22.187  -4.512
   10   HD22  LEU 757          HD22      LEU 757  45.809 -20.903  -3.445
   11   HD21  LEU 757          HD23      LEU 757  44.309 -21.752  -3.069

  No H/Q in entry =          11
  In of MODEL    7
    1    H    THR 758           H        THR 758  42.903 -24.803  -1.060
    2    HA   THR 758           HA       THR 758  42.486 -27.629  -1.570
    3    HB   THR 758           HB       THR 758  40.751 -27.546   0.298
    4    HG1  THR 758           HG1      THR 758  41.511 -24.950   0.311
    5   HG23  THR 758          HG21      THR 758  42.412 -27.846   2.096
    6   HG22  THR 758          HG22      THR 758  43.623 -27.022   1.127
    7   HG21  THR 758          HG23      THR 758  42.995 -28.577   0.601

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLY 759           H        GLY 759  39.673 -27.567  -1.396
    2    HA3  GLY 759           HA2      GLY 759  39.154 -26.064  -3.809
    3    HA2  GLY 759           HA3      GLY 759  38.080 -27.229  -3.042

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ARG 760           H        ARG 760  36.813 -25.108  -3.864
    2    HA   ARG 760           HA       ARG 760  36.740 -22.881  -2.166
    3    HB2  ARG 760           HB2      ARG 760  35.711 -22.552  -4.247
    4    HB3  ARG 760           HB3      ARG 760  34.888 -24.098  -4.181
    5    HG2  ARG 760           HG2      ARG 760  34.146 -22.073  -2.209
    6    HG3  ARG 760           HG3      ARG 760  33.570 -21.810  -3.889
    7    HD2  ARG 760           HD2      ARG 760  32.488 -24.012  -3.782
    8    HD3  ARG 760           HD3      ARG 760  33.165 -24.283  -2.184
    9    HE   ARG 760           HE       ARG 760  30.983 -22.522  -2.913
   10   HH11  ARG 760          HH11      ARG 760  33.091 -23.492  -0.261
   11   HH12  ARG 760          HH12      ARG 760  31.846 -23.524   0.896
   12   HH21  ARG 760          HH21      ARG 760  29.232 -22.518  -1.247
   13   HH22  ARG 760          HH22      ARG 760  29.650 -23.009   0.315

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ASP 761           H        ASP 761  35.160 -25.928  -2.105
    2    HA   ASP 761           HA       ASP 761  33.732 -25.083   0.208
    3    HB2  ASP 761           HB2      ASP 761  32.416 -26.301  -1.379
    4    HB3  ASP 761           HB3      ASP 761  33.490 -27.696  -1.282

  No H/Q in entry =           4
  In of MODEL    7
    1    H    SER 762           H        SER 762  35.969 -24.974   1.172
    2    HA   SER 762           HA       SER 762  36.327 -27.361   2.788
    3    HB2  SER 762           HB2      SER 762  38.552 -25.724   1.572
    4    HB3  SER 762           HB3      SER 762  38.765 -27.019   2.749
    5    HG   SER 762           HG       SER 762  37.195 -27.777   0.705

  No H/Q in entry =           5
  In of MODEL    7
    1    H    CYS 763           H        CYS 763  36.130 -23.890   2.543
    2    HA   CYS 763           HA       CYS 763  36.326 -23.744   5.440
    3    HB2  CYS 763           HB2      CYS 763  37.524 -21.690   5.349
    4    HB3  CYS 763           HB3      CYS 763  38.442 -22.849   4.411

  No H/Q in entry =           4
  In of MODEL    7
    1    H    THR 764           H        THR 764  35.322 -21.651   6.139
    2    HA   THR 764           HA       THR 764  32.913 -21.179   4.612
    3    HB   THR 764           HB       THR 764  33.780 -19.910   7.228
    4    HG1  THR 764           HG1      THR 764  32.576 -22.353   6.586
    5   HG22  THR 764          HG21      THR 764  31.364 -19.538   7.518
    6   HG21  THR 764          HG22      THR 764  31.066 -20.281   5.943
    7   HG23  THR 764          HG23      THR 764  31.961 -18.765   6.048

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LEU 765           H        LEU 765  33.212 -19.927   2.971
    2    HA   LEU 765           HA       LEU 765  35.257 -17.891   2.983
    3    HB2  LEU 765           HB2      LEU 765  34.568 -19.732   1.181
    4    HB3  LEU 765           HB3      LEU 765  33.394 -18.502   0.764
    5    HG   LEU 765           HG       LEU 765  35.202 -16.940   0.229
    6   HD12  LEU 765          HD11      LEU 765  37.519 -17.804   0.128
    7   HD11  LEU 765          HD12      LEU 765  36.960 -19.297   0.899
    8   HD13  LEU 765          HD13      LEU 765  36.889 -17.779   1.776
    9   HD21  LEU 765          HD21      LEU 765  35.429 -19.630  -1.118
   10   HD23  LEU 765          HD22      LEU 765  35.989 -18.096  -1.781
   11   HD22  LEU 765          HD23      LEU 765  34.266 -18.366  -1.516

  No H/Q in entry =          11
  In of MODEL    7
    1    HA   PRO 766           HA       PRO 766  32.368 -14.565   3.818
    2    HB2  PRO 766           HB2      PRO 766  33.260 -12.811   1.790
    3    HB3  PRO 766           HB3      PRO 766  33.807 -12.848   3.465
    4    HG2  PRO 766           HG2      PRO 766  35.075 -13.978   1.039
    5    HG3  PRO 766           HG3      PRO 766  35.823 -13.395   2.532
    6    HD2  PRO 766           HD2      PRO 766  35.618 -16.009   1.910
    7    HD3  PRO 766           HD3      PRO 766  35.583 -15.458   3.581

  No H/Q in entry =           7
  In of MODEL    7
    1    H    ALA 767           H        ALA 767  32.869 -15.631   0.541
    2    HA   ALA 767           HA       ALA 767  29.995 -15.393   0.086
    3    HB3  ALA 767           HB1      ALA 767  32.111 -14.833  -1.998
    4    HB2  ALA 767           HB2      ALA 767  31.114 -13.605  -1.216
    5    HB1  ALA 767           HB3      ALA 767  30.367 -14.831  -2.248

  No H/Q in entry =           5
  In of MODEL    7
    1    H    SER 768           H        SER 768  29.530 -17.322   0.489
    2    HA   SER 768           HA       SER 768  30.857 -19.427  -1.064
    3    HB2  SER 768           HB2      SER 768  29.355 -19.677   1.538
    4    HB3  SER 768           HB3      SER 768  30.202 -20.957   0.671
    5    HG   SER 768           HG       SER 768  31.324 -18.657   1.875

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA 769           H        ALA 769  27.838 -18.090   0.115
    2    HA   ALA 769           HA       ALA 769  26.201 -19.900  -1.484
    3    HB1  ALA 769           HB1      ALA 769  25.486 -17.738   0.490
    4    HB3  ALA 769           HB2      ALA 769  25.590 -19.459   0.874
    5    HB2  ALA 769           HB3      ALA 769  24.355 -18.872  -0.245

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLU 770           H        GLU 770  24.141 -17.810  -1.730
    2    HA   GLU 770           HA       GLU 770  24.917 -16.798  -4.204
    3    HB2  GLU 770           HB2      GLU 770  22.623 -16.072  -2.440
    4    HB3  GLU 770           HB3      GLU 770  22.820 -15.466  -4.092
    5    HG2  GLU 770           HG2      GLU 770  22.917 -17.808  -4.850
    6    HG3  GLU 770           HG3      GLU 770  22.531 -18.314  -3.217

  No H/Q in entry =           6
  In of MODEL    7
    1    H    LYS 771           H        LYS 771  24.779 -14.501  -4.861
    2    HA   LYS 771           HA       LYS 771  26.915 -13.274  -3.410
    3    HB2  LYS 771           HB2      LYS 771  25.566 -12.268  -5.904
    4    HB3  LYS 771           HB3      LYS 771  27.113 -11.786  -5.229
    5    HG2  LYS 771           HG2      LYS 771  26.460 -14.475  -6.467
    6    HG3  LYS 771           HG3      LYS 771  27.430 -13.208  -7.187
    7    HD2  LYS 771           HD2      LYS 771  29.097 -14.576  -6.399
    8    HD3  LYS 771           HD3      LYS 771  28.875 -13.557  -4.990
    9    HE2  LYS 771           HE2      LYS 771  29.013 -15.897  -4.296
   10    HE3  LYS 771           HE3      LYS 771  27.395 -15.295  -3.999
   11    HZ1  LYS 771           HZ1      LYS 771  28.144 -16.997  -6.334
   12    HZ3  LYS 771           HZ2      LYS 771  26.587 -16.479  -5.940
   13    HZ2  LYS 771           HZ3      LYS 771  27.409 -17.495  -4.920

  No H/Q in entry =          13
  In of MODEL    7
    1    H    ALA 772           H        ALA 772  26.568 -11.865  -1.891
    2    HA   ALA 772           HA       ALA 772  24.231 -10.124  -2.008
    3    HB1  ALA 772           HB1      ALA 772  23.929 -10.412   0.420
    4    HB3  ALA 772           HB2      ALA 772  25.212 -11.624   0.425
    5    HB2  ALA 772           HB3      ALA 772  23.710 -11.930  -0.449

  No H/Q in entry =           5
  In of MODEL    7
    1    H    CYS 773           H        CYS 773  24.534  -8.200  -0.654
    2    HA   CYS 773           HA       CYS 773  27.081  -7.077  -1.093
    3    HB2  CYS 773           HB2      CYS 773  24.836  -6.069   0.662
    4    HB3  CYS 773           HB3      CYS 773  26.212  -5.120   0.112

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLY 774           H        GLY 774  28.768  -6.822   0.175
    2    HA3  GLY 774           HA2      GLY 774  29.552  -6.658   2.542
    3    HA2  GLY 774           HA3      GLY 774  28.714  -8.193   2.776

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ALA 775           H        ALA 775  29.435  -9.015   0.001
    2    HA   ALA 775           HA       ALA 775  32.315  -9.122   0.034
    3    HB3  ALA 775           HB1      ALA 775  30.665 -11.652   0.198
    4    HB2  ALA 775           HB2      ALA 775  31.716 -11.026   1.462
    5    HB1  ALA 775           HB3      ALA 775  32.405 -11.574  -0.068

  No H/Q in entry =           5
  In of MODEL    7
    1    H    CYS 776           H        CYS 776  32.470  -8.230  -1.851
    2    HA   CYS 776           HA       CYS 776  32.478  -9.464  -4.241
    3    HB2  CYS 776           HB2      CYS 776  30.487  -8.555  -5.463
    4    HB3  CYS 776           HB3      CYS 776  30.030  -9.711  -4.224

  No H/Q in entry =           4
  In of MODEL    7
    1    HA   PRO 777           HA       PRO 777  34.167  -5.247  -4.057
    2    HB2  PRO 777           HB2      PRO 777  36.699  -6.139  -4.991
    3    HB3  PRO 777           HB3      PRO 777  36.258  -5.706  -3.343
    4    HG2  PRO 777           HG2      PRO 777  36.909  -8.285  -4.231
    5    HG3  PRO 777           HG3      PRO 777  36.101  -7.885  -2.711
    6    HD2  PRO 777           HD2      PRO 777  34.940  -8.877  -5.276
    7    HD3  PRO 777           HD3      PRO 777  34.425  -9.176  -3.601

  No H/Q in entry =           7
  In of MODEL    7
    1    H    LEU 778           H        LEU 778  35.551  -7.244  -6.621
    2    HA   LEU 778           HA       LEU 778  35.266  -4.956  -8.375
    3    HB2  LEU 778           HB2      LEU 778  36.929  -6.098  -9.895
    4    HB3  LEU 778           HB3      LEU 778  37.513  -5.557  -8.343
    5    HG   LEU 778           HG       LEU 778  36.817  -8.459  -8.896
    6   HD13  LEU 778          HD11      LEU 778  39.162  -8.842  -9.252
    7   HD12  LEU 778          HD12      LEU 778  39.509  -7.124  -9.048
    8   HD11  LEU 778          HD13      LEU 778  38.574  -7.675 -10.442
    9   HD21  LEU 778          HD21      LEU 778  38.509  -7.113  -6.787
   10   HD23  LEU 778          HD22      LEU 778  38.410  -8.846  -7.042
   11   HD22  LEU 778          HD23      LEU 778  36.988  -7.969  -6.511

  No H/Q in entry =          11
  In of MODEL    7
    1    H    TRP 779           H        TRP 779  34.582  -8.422  -8.556
    2    HA   TRP 779           HA       TRP 779  33.319  -8.187 -11.125
    3    HB2  TRP 779           HB2      TRP 779  32.629 -10.619 -10.554
    4    HB3  TRP 779           HB3      TRP 779  34.337 -10.270 -10.811
    5    HD1  TRP 779           HD1      TRP 779  31.860 -10.850  -7.917
    6    HE1  TRP 779           HE1      TRP 779  33.259 -11.655  -5.834
    7    HE3  TRP 779           HE3      TRP 779  36.477 -10.494  -9.886
    8    HZ2  TRP 779           HZ2      TRP 779  35.980 -12.063  -5.216
    9    HZ3  TRP 779           HZ3      TRP 779  38.420 -11.108  -8.537
   10    HH2  TRP 779           HH2      TRP 779  38.171 -11.873  -6.253

  No H/Q in entry =          10
  In of MODEL    7
    1    H    GLY 780           H        GLY 780  32.262  -7.213  -8.177
    2    HA3  GLY 780           HA2      GLY 780  29.518  -7.678  -8.948
    3    HA2  GLY 780           HA3      GLY 780  30.024  -8.149  -7.331

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LYS 781           H        LYS 781  28.121  -6.204  -8.120
    2    HA   LYS 781           HA       LYS 781  29.311  -3.925  -6.755
    3    HB2  LYS 781           HB2      LYS 781  27.729  -3.877  -9.275
    4    HB3  LYS 781           HB3      LYS 781  27.711  -2.487  -8.191
    5    HG2  LYS 781           HG2      LYS 781  30.116  -3.704  -9.521
    6    HG3  LYS 781           HG3      LYS 781  29.292  -2.211 -10.023
    7    HD2  LYS 781           HD2      LYS 781  29.831  -1.300  -7.731
    8    HD3  LYS 781           HD3      LYS 781  30.825  -2.732  -7.470
    9    HE2  LYS 781           HE2      LYS 781  32.262  -0.961  -8.179
   10    HE3  LYS 781           HE3      LYS 781  32.128  -2.118  -9.498
   11    HZ3  LYS 781           HZ1      LYS 781  30.568  -0.656 -10.607
   12    HZ2  LYS 781           HZ2      LYS 781  31.940   0.255 -10.215
   13    HZ1  LYS 781           HZ3      LYS 781  30.554   0.386  -9.301

  No H/Q in entry =          13
  In of MODEL    7
    1    H    CYS 782           H        CYS 782  28.195  -3.089  -5.288
    2    HA   CYS 782           HA       CYS 782  25.389  -3.874  -4.935
    3    HB2  CYS 782           HB2      CYS 782  26.919  -4.716  -3.106
    4    HB3  CYS 782           HB3      CYS 782  27.380  -3.050  -2.779

  No H/Q in entry =           4
  In of MODEL    7
    1    H    ASP 783           H        ASP 783  24.357  -2.185  -5.845
    2    HA   ASP 783           HA       ASP 783  25.246   0.518  -5.138
    3    HB2  ASP 783           HB2      ASP 783  26.488  -0.082  -7.151
    4    HB3  ASP 783           HB3      ASP 783  24.992  -0.492  -7.972

  No H/Q in entry =           4
  In of MODEL    7
    1    H    ALA 784           H        ALA 784  23.012  -0.947  -7.511
    2    HA   ALA 784           HA       ALA 784  20.928   0.895  -6.766
    3    HB1  ALA 784           HB1      ALA 784  20.847  -1.525  -8.585
    4    HB2  ALA 784           HB2      ALA 784  21.109   0.139  -9.100
    5    HB3  ALA 784           HB3      ALA 784  19.559  -0.337  -8.412

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLU 785           H        GLU 785  21.535  -2.528  -6.555
    2    HA   GLU 785           HA       GLU 785  19.450  -2.819  -4.560
    3    HB2  GLU 785           HB2      GLU 785  19.475  -4.479  -6.340
    4    HB3  GLU 785           HB3      GLU 785  21.169  -4.816  -6.066
    5    HG2  GLU 785           HG2      GLU 785  19.662  -6.559  -5.249
    6    HG3  GLU 785           HG3      GLU 785  20.674  -5.875  -3.976

  No H/Q in entry =           6
  In of MODEL    7
    1    H    SER 786           H        SER 786  19.931  -3.259  -2.463
    2    HA   SER 786           HA       SER 786  22.735  -2.858  -1.687
    3    HB2  SER 786           HB2      SER 786  20.244  -2.062  -0.171
    4    HB3  SER 786           HB3      SER 786  21.916  -1.659   0.244
    5    HG   SER 786           HG       SER 786  21.499  -0.959  -2.256

  No H/Q in entry =           5
  In of MODEL    7
    1    H    SER 787           H        SER 787  20.314  -5.149  -1.752
    2    HA   SER 787           HA       SER 787  21.297  -6.476   0.675
    3    HB2  SER 787           HB2      SER 787  18.823  -6.310   0.353
    4    HB3  SER 787           HB3      SER 787  18.982  -7.225  -1.139
    5    HG   SER 787           HG       SER 787  18.695  -8.147   1.307

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LYS 788           H        LYS 788  20.567  -7.222  -2.682
    2    HA   LYS 788           HA       LYS 788  22.334  -9.532  -2.694
    3    HB2  LYS 788           HB2      LYS 788  20.113  -9.755  -3.583
    4    HB3  LYS 788           HB3      LYS 788  20.360  -8.373  -4.633
    5    HG2  LYS 788           HG2      LYS 788  22.044  -9.706  -5.889
    6    HG3  LYS 788           HG3      LYS 788  21.683 -11.088  -4.855
    7    HD2  LYS 788           HD2      LYS 788  20.406 -11.321  -6.887
    8    HD3  LYS 788           HD3      LYS 788  19.296 -10.922  -5.575
    9    HE2  LYS 788           HE2      LYS 788  19.474  -8.493  -6.324
   10    HE3  LYS 788           HE3      LYS 788  20.341  -9.092  -7.728
   11    HZ3  LYS 788           HZ1      LYS 788  18.014  -8.790  -8.240
   12    HZ2  LYS 788           HZ2      LYS 788  17.555  -9.721  -6.963
   13    HZ1  LYS 788           HZ3      LYS 788  18.345 -10.432  -8.272

  No H/Q in entry =          13
  In of MODEL    7
    1    H    CYS 789           H        CYS 789  24.135  -9.618  -4.074
    2    HA   CYS 789           HA       CYS 789  24.961  -7.008  -5.084
    3    HB2  CYS 789           HB2      CYS 789  26.441  -8.302  -3.430
    4    HB3  CYS 789           HB3      CYS 789  26.726  -9.441  -4.740

  No H/Q in entry =           4
  In of MODEL    7
    1    H    VAL 790           H        VAL 790  25.493  -6.821  -7.259
    2    HA   VAL 790           HA       VAL 790  24.536  -9.067  -8.853
    3    HB   VAL 790           HB       VAL 790  23.271  -6.962  -9.096
    4   HG11  VAL 790          HG11      VAL 790  25.023  -5.340  -8.712
    5   HG13  VAL 790          HG12      VAL 790  24.204  -5.042 -10.242
    6   HG12  VAL 790          HG13      VAL 790  25.798  -5.800 -10.233
    7   HG23  VAL 790          HG21      VAL 790  23.279  -6.831 -11.559
    8   HG22  VAL 790          HG22      VAL 790  23.256  -8.485 -10.949
    9   HG21  VAL 790          HG23      VAL 790  24.755  -7.798 -11.577

  No H/Q in entry =           9
  In of MODEL    7
    1    H    CYS 791           H        CYS 791  25.746  -9.811 -10.531
    2    HA   CYS 791           HA       CYS 791  28.596  -9.241 -10.238
    3    HB2  CYS 791           HB2      CYS 791  27.286 -11.553 -11.676
    4    HB3  CYS 791           HB3      CYS 791  28.966 -11.384 -11.202

  No H/Q in entry =           4
  In of MODEL    7
    1    H    ARG 792           H        ARG 792  29.746  -8.437 -11.810
    2    HA   ARG 792           HA       ARG 792  28.411  -7.632 -14.282
    3    HB2  ARG 792           HB2      ARG 792  31.154  -6.911 -13.192
    4    HB3  ARG 792           HB3      ARG 792  30.475  -6.287 -14.690
    5    HG2  ARG 792           HG2      ARG 792  28.622  -5.292 -13.350
    6    HG3  ARG 792           HG3      ARG 792  29.470  -5.804 -11.894
    7    HD2  ARG 792           HD2      ARG 792  30.594  -3.941 -13.996
    8    HD3  ARG 792           HD3      ARG 792  29.860  -3.438 -12.481
    9    HE   ARG 792           HE       ARG 792  31.878  -5.147 -11.764
   10   HH11  ARG 792          HH11      ARG 792  31.768  -2.124 -13.695
   11   HH12  ARG 792          HH12      ARG 792  33.296  -1.615 -13.147
   12   HH21  ARG 792          HH21      ARG 792  33.976  -4.354 -11.069
   13   HH22  ARG 792          HH22      ARG 792  34.559  -2.864 -11.697

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLU 793           H        GLU 793  30.156  -7.773 -16.239
    2    HA   GLU 793           HA       GLU 793  31.044 -10.552 -16.155
    3    HB2  GLU 793           HB2      GLU 793  30.507  -8.834 -18.604
    4    HB3  GLU 793           HB3      GLU 793  30.987 -10.519 -18.591
    5    HG2  GLU 793           HG2      GLU 793  28.892 -11.067 -17.404
    6    HG3  GLU 793           HG3      GLU 793  28.384  -9.388 -17.622

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ALA 794           H        ALA 794  32.896 -10.560 -18.161
    2    HA   ALA 794           HA       ALA 794  35.113  -9.374 -16.771
    3    HB2  ALA 794           HB1      ALA 794  35.246 -11.623 -17.728
    4    HB3  ALA 794           HB2      ALA 794  36.480 -10.549 -18.394
    5    HB1  ALA 794           HB3      ALA 794  35.040 -10.936 -19.340

  No H/Q in entry =           5
  In of MODEL    7
    1    H    SER 795           H        SER 795  33.044  -8.468 -19.241
    2    HA   SER 795           HA       SER 795  34.723  -6.954 -20.878
    3    HB2  SER 795           HB2      SER 795  32.480  -5.958 -21.551
    4    HB3  SER 795           HB3      SER 795  32.674  -7.701 -21.749
    5    HG   SER 795           HG       SER 795  30.710  -7.212 -20.773

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLU 796           H        GLU 796  32.909  -6.266 -17.961
    2    HA   GLU 796           HA       GLU 796  33.834  -3.495 -18.148
    3    HB2  GLU 796           HB2      GLU 796  31.350  -3.946 -17.846
    4    HB3  GLU 796           HB3      GLU 796  31.742  -4.513 -16.225
    5    HG2  GLU 796           HG2      GLU 796  32.741  -2.302 -15.746
    6    HG3  GLU 796           HG3      GLU 796  32.207  -1.751 -17.330

  No H/Q in entry =           6
  In of MODEL    7
    1    H    CYS 797           H        CYS 797  35.790  -4.752 -17.674
    2    HA   CYS 797           HA       CYS 797  36.206  -4.697 -14.782
    3    HB2  CYS 797           HB2      CYS 797  36.387  -6.975 -15.386
    4    HB3  CYS 797           HB3      CYS 797  37.349  -6.599 -16.812

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLU 798           H        GLU 798  37.260  -2.938 -14.352
    2    HA   GLU 798           HA       GLU 798  39.375  -2.000 -16.158
    3    HB2  GLU 798           HB2      GLU 798  37.700  -0.361 -15.465
    4    HB3  GLU 798           HB3      GLU 798  38.032  -0.704 -13.779
    5    HG2  GLU 798           HG2      GLU 798  40.354   0.127 -14.157
    6    HG3  GLU 798           HG3      GLU 798  39.852   0.617 -15.774

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU 799           H        GLU 799  38.742  -3.370 -13.068
    2    HA   GLU 799           HA       GLU 799  41.136  -2.721 -11.730
    3    HB2  GLU 799           HB2      GLU 799  39.016  -3.392 -10.638
    4    HB3  GLU 799           HB3      GLU 799  39.228  -5.025 -11.252
    5    HG2  GLU 799           HG2      GLU 799  39.882  -4.916  -8.940
    6    HG3  GLU 799           HG3      GLU 799  41.306  -5.194  -9.945

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLU 800           H        GLU 800  43.008  -3.861 -11.523
    2    HA   GLU 800           HA       GLU 800  43.273  -6.225 -13.169
    3    HB2  GLU 800           HB2      GLU 800  45.265  -3.981 -12.889
    4    HB3  GLU 800           HB3      GLU 800  45.652  -5.551 -13.585
    5    HG2  GLU 800           HG2      GLU 800  43.850  -5.180 -15.242
    6    HG3  GLU 800           HG3      GLU 800  43.661  -3.559 -14.601

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLY 801           H        GLY 801  42.831  -7.374 -11.467
    2    HA3  GLY 801           HA2      GLY 801  44.534  -7.428  -9.132
    3    HA2  GLY 801           HA3      GLY 801  43.256  -8.577  -9.533

  No H/Q in entry =           3
  In of MODEL    7
    1    H    PHE 802           H        PHE 802  44.222 -10.474  -9.360
    2    HA   PHE 802           HA       PHE 802  46.817 -10.915 -10.559
    3    HB2  PHE 802           HB2      PHE 802  45.042 -12.525  -8.779
    4    HB3  PHE 802           HB3      PHE 802  46.289 -13.339  -9.712
    5    HD1  PHE 802           HD1      PHE 802  47.670 -14.054  -7.939
    6    HD2  PHE 802           HD2      PHE 802  46.584  -9.963  -8.269
    7    HE1  PHE 802           HE1      PHE 802  49.350 -13.475  -6.269
    8    HE2  PHE 802           HE2      PHE 802  48.243  -9.377  -6.616
    9    HZ   PHE 802           HZ       PHE 802  49.642 -11.134  -5.580

  No H/Q in entry =           9
  In of MODEL    7
    1    H    SER 803           H        SER 803  46.976 -13.217 -11.567
    2    HA   SER 803           HA       SER 803  44.890 -13.576 -13.540
    3    HB2  SER 803           HB2      SER 803  47.874 -14.052 -13.877
    4    HB3  SER 803           HB3      SER 803  46.613 -14.122 -15.118
    5    HG   SER 803           HG       SER 803  46.298 -11.795 -14.198

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ILE 804           H        ILE 804  44.233 -15.723 -13.570
    2    HA   ILE 804           HA       ILE 804  45.683 -17.554 -11.811
    3    HB   ILE 804           HB       ILE 804  43.659 -18.384 -10.753
    4   HG12  ILE 804          HG12      ILE 804  42.048 -17.821 -12.622
    5   HG13  ILE 804          HG13      ILE 804  41.459 -17.441 -11.012
    6   HG21  ILE 804          HG21      ILE 804  44.844 -16.625  -9.616
    7   HG23  ILE 804          HG22      ILE 804  43.113 -16.493  -9.303
    8   HG22  ILE 804          HG23      ILE 804  43.890 -15.405 -10.459
    9   HD11  ILE 804          HD11      ILE 804  41.979 -15.081 -11.397
   10   HD13  ILE 804          HD12      ILE 804  40.860 -15.710 -12.605
   11   HD12  ILE 804          HD13      ILE 804  42.546 -15.467 -13.019

  No H/Q in entry =          11
  In of MODEL    7
    1    H    CYS 805           H        CYS 805  44.587 -19.793 -11.953
    2    HA   CYS 805           HA       CYS 805  44.194 -20.408 -14.803
    3    HB2  CYS 805           HB2      CYS 805  46.371 -21.113 -13.874
    4    HB3  CYS 805           HB3      CYS 805  45.520 -21.982 -12.604

  No H/Q in entry =           4
  In of MODEL    7
    1    H    VAL 806           H        VAL 806  42.274 -21.147 -15.164
    2    HA   VAL 806           HA       VAL 806  40.996 -22.682 -13.062
    3    HB   VAL 806           HB       VAL 806  40.179 -20.383 -12.947
    4   HG13  VAL 806          HG11      VAL 806  40.609 -19.630 -15.122
    5   HG12  VAL 806          HG12      VAL 806  38.892 -19.397 -14.759
    6   HG11  VAL 806          HG13      VAL 806  39.415 -20.742 -15.783
    7   HG23  VAL 806          HG21      VAL 806  38.111 -22.214 -14.133
    8   HG22  VAL 806          HG22      VAL 806  37.780 -20.803 -13.116
    9   HG21  VAL 806          HG23      VAL 806  38.594 -22.217 -12.449

  No H/Q in entry =           9
  In of MODEL    7
    1    H    GLU 807           H        GLU 807  39.998 -24.474 -13.759
    2    HA   GLU 807           HA       GLU 807  40.257 -25.114 -16.550
    3    HB2  GLU 807           HB2      GLU 807  40.806 -26.813 -14.815
    4    HB3  GLU 807           HB3      GLU 807  39.130 -26.796 -14.294
    5    HG2  GLU 807           HG2      GLU 807  38.447 -27.557 -16.524
    6    HG3  GLU 807           HG3      GLU 807  40.156 -27.598 -16.986

  No H/Q in entry =           6
  In of MODEL    7
    1    H    VAL 808           H        VAL 808  38.850 -24.794 -17.920
    2    HA   VAL 808           HA       VAL 808  36.019 -24.784 -17.332
    3    HB   VAL 808           HB       VAL 808  36.818 -22.436 -17.091
    4   HG12  VAL 808          HG11      VAL 808  37.723 -22.670 -19.934
    5   HG11  VAL 808          HG12      VAL 808  38.738 -22.442 -18.511
    6   HG13  VAL 808          HG13      VAL 808  37.629 -21.167 -19.020
    7   HG22  VAL 808          HG21      VAL 808  34.559 -22.751 -17.859
    8   HG21  VAL 808          HG22      VAL 808  35.126 -22.902 -19.524
    9   HG23  VAL 808          HG23      VAL 808  35.279 -21.363 -18.675

  No H/Q in entry =           9
  In of MODEL    7
    1    H    ASN 809           H        ASN 809  34.944 -25.625 -19.125
    2    HA   ASN 809           HA       ASN 809  34.635 -26.603 -21.180
    3    HB2  ASN 809           HB2      ASN 809  36.856 -24.720 -21.753
    4    HB3  ASN 809           HB3      ASN 809  36.330 -25.809 -23.050
    5   HD21  ASN 809          HD21      ASN 809  35.880 -22.918 -21.350
    6   HD22  ASN 809          HD22      ASN 809  34.409 -22.380 -22.063

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLY 810           H        GLY 810  36.706 -27.547 -19.125
    2    HA3  GLY 810           HA2      GLY 810  37.622 -29.753 -19.083
    3    HA2  GLY 810           HA3      GLY 810  37.720 -29.645 -20.845

  No H/Q in entry =           3
  In of MODEL    7
    1    H    LYS 811           H        LYS 811  38.893 -26.821 -20.244
    2    HA   LYS 811           HA       LYS 811  41.625 -27.862 -19.914
    3    HB2  LYS 811           HB2      LYS 811  42.335 -26.141 -21.527
    4    HB3  LYS 811           HB3      LYS 811  41.270 -27.354 -22.221
    5    HG2  LYS 811           HG2      LYS 811  39.387 -25.788 -22.029
    6    HG3  LYS 811           HG3      LYS 811  40.483 -24.574 -21.374
    7    HD2  LYS 811           HD2      LYS 811  40.714 -25.876 -24.060
    8    HD3  LYS 811           HD3      LYS 811  40.023 -24.277 -23.777
    9    HE2  LYS 811           HE2      LYS 811  42.209 -23.557 -22.805
   10    HE3  LYS 811           HE3      LYS 811  42.877 -25.133 -23.218
   11    HZ1  LYS 811           HZ1      LYS 811  41.829 -23.150 -25.165
   12    HZ3  LYS 811           HZ2      LYS 811  42.475 -24.642 -25.555
   13    HZ2  LYS 811           HZ3      LYS 811  43.447 -23.468 -24.850

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLU 812           H        GLU 812  43.152 -26.508 -18.975
    2    HA   GLU 812           HA       GLU 812  42.054 -24.616 -17.070
    3    HB2  GLU 812           HB2      GLU 812  44.891 -25.576 -17.491
    4    HB3  GLU 812           HB3      GLU 812  44.364 -24.515 -16.194
    5    HG2  GLU 812           HG2      GLU 812  42.892 -26.331 -15.376
    6    HG3  GLU 812           HG3      GLU 812  43.554 -27.383 -16.622

  No H/Q in entry =           6
  In of MODEL    7
    1    H    GLN 813           H        GLN 813  41.538 -22.764 -17.885
    2    HA   GLN 813           HA       GLN 813  43.388 -21.471 -19.734
    3    HB2  GLN 813           HB2      GLN 813  41.112 -21.647 -20.568
    4    HB3  GLN 813           HB3      GLN 813  40.476 -20.897 -19.108
    5    HG2  GLN 813           HG2      GLN 813  41.614 -18.842 -19.662
    6    HG3  GLN 813           HG3      GLN 813  42.281 -19.565 -21.125
    7   HE21  GLN 813          HE21      GLN 813  39.009 -20.161 -20.047
    8   HE22  GLN 813          HE22      GLN 813  38.229 -19.267 -21.292

  No H/Q in entry =           8
  In of MODEL    7
    1    H    THR 814           H        THR 814  44.245 -19.543 -19.233
    2    HA   THR 814           HA       THR 814  44.231 -18.749 -16.455
    3    HB   THR 814           HB       THR 814  45.647 -17.624 -18.861
    4    HG1  THR 814           HG1      THR 814  47.481 -18.802 -17.859
    5   HG22  THR 814          HG21      THR 814  47.191 -16.587 -17.215
    6   HG21  THR 814          HG22      THR 814  46.173 -17.199 -15.911
    7   HG23  THR 814          HG23      THR 814  45.535 -16.002 -17.038

  No H/Q in entry =           7
  In of MODEL    7
    1    H    MET 815           H        MET 815  43.058 -17.138 -15.745
    2    HA   MET 815           HA       MET 815  41.906 -15.256 -17.704
    3    HB2  MET 815           HB2      MET 815  40.537 -16.224 -15.199
    4    HB3  MET 815           HB3      MET 815  39.868 -15.150 -16.418
    5    HG2  MET 815           HG2      MET 815  40.181 -17.108 -18.043
    6    HG3  MET 815           HG3      MET 815  40.467 -18.038 -16.585
    7    HE2  MET 815           HE1      MET 815  36.997 -19.292 -17.556
    8    HE1  MET 815           HE2      MET 815  38.727 -19.630 -17.313
    9    HE3  MET 815           HE3      MET 815  38.207 -18.701 -18.703

  No H/Q in entry =           9
  In of MODEL    7
    1    H    SER 816           H        SER 816  41.391 -13.184 -16.748
    2    HA   SER 816           HA       SER 816  43.262 -12.421 -14.707
    3    HB2  SER 816           HB2      SER 816  41.030 -10.827 -16.025
    4    HB3  SER 816           HB3      SER 816  42.308 -10.163 -15.005
    5    HG   SER 816           HG       SER 816  42.397 -11.128 -17.609

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLU 817           H        GLU 817  42.602 -11.522 -12.715
    2    HA   GLU 817           HA       GLU 817  41.138 -13.082 -11.093
    3    HB2  GLU 817           HB2      GLU 817  42.764 -11.293 -10.551
    4    HB3  GLU 817           HB3      GLU 817  41.468 -10.131 -10.797
    5    HG2  GLU 817           HG2      GLU 817  40.236 -11.063  -8.989
    6    HG3  GLU 817           HG3      GLU 817  41.453 -12.327  -8.759

  No H/Q in entry =           6
  In of MODEL    7
    1    H    CYS 818           H        CYS 818  39.951 -10.122 -12.686
    2    HA   CYS 818           HA       CYS 818  37.415 -10.234 -11.478
    3    HB2  CYS 818           HB2      CYS 818  36.768  -8.551 -13.198
    4    HB3  CYS 818           HB3      CYS 818  38.193  -8.125 -12.262

  No H/Q in entry =           4
  In of MODEL    7
    1    H    GLU 819           H        GLU 819  38.729 -11.607 -14.403
    2    HA   GLU 819           HA       GLU 819  36.249 -12.058 -15.696
    3    HB2  GLU 819           HB2      GLU 819  38.301 -11.917 -16.986
    4    HB3  GLU 819           HB3      GLU 819  38.980 -13.285 -16.132
    5    HG2  GLU 819           HG2      GLU 819  37.365 -14.768 -17.157
    6    HG3  GLU 819           HG3      GLU 819  36.553 -13.401 -17.919

  No H/Q in entry =           6
  In of MODEL    7
    1    H    ALA 820           H        ALA 820  38.530 -14.334 -14.186
    2    HA   ALA 820           HA       ALA 820  36.849 -16.526 -14.265
    3    HB1  ALA 820           HB1      ALA 820  39.226 -16.711 -13.738
    4    HB2  ALA 820           HB2      ALA 820  38.241 -17.526 -12.526
    5    HB3  ALA 820           HB3      ALA 820  38.930 -15.940 -12.176

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLY 821           H        GLY 821  37.221 -13.964 -11.889
    2    HA3  GLY 821           HA2      GLY 821  35.594 -14.970  -9.836
    3    HA2  GLY 821           HA3      GLY 821  36.000 -13.279 -10.097

  No H/Q in entry =           3
  In of MODEL    7
    1    H    ALA 822           H        ALA 822  34.844 -12.903 -12.611
    2    HA   ALA 822           HA       ALA 822  32.155 -12.525 -11.811
    3    HB2  ALA 822           HB1      ALA 822  33.396 -12.120 -14.530
    4    HB1  ALA 822           HB2      ALA 822  33.296 -10.933 -13.216
    5    HB3  ALA 822           HB3      ALA 822  31.824 -11.514 -13.983

  No H/Q in entry =           5
  In of MODEL    7
    1    H    LEU 823           H        LEU 823  33.758 -14.806 -13.998
    2    HA   LEU 823           HA       LEU 823  31.355 -16.001 -14.857
    3    HB2  LEU 823           HB2      LEU 823  34.151 -17.145 -14.724
    4    HB3  LEU 823           HB3      LEU 823  32.800 -18.151 -15.155
    5    HG   LEU 823           HG       LEU 823  33.873 -17.545 -17.174
    6   HD11  LEU 823          HD11      LEU 823  31.419 -17.497 -17.250
    7   HD13  LEU 823          HD12      LEU 823  32.193 -16.480 -18.455
    8   HD12  LEU 823          HD13      LEU 823  31.489 -15.744 -17.020
    9   HD22  LEU 823          HD21      LEU 823  35.136 -15.610 -16.448
   10   HD21  LEU 823          HD22      LEU 823  33.652 -14.664 -16.355
   11   HD23  LEU 823          HD23      LEU 823  34.233 -15.247 -17.916

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ARG 824           H        ARG 824  33.287 -16.512 -11.999
    2    HA   ARG 824           HA       ARG 824  31.702 -18.731 -11.119
    3    HB2  ARG 824           HB2      ARG 824  34.118 -18.320 -10.466
    4    HB3  ARG 824           HB3      ARG 824  33.543 -17.023  -9.434
    5    HG2  ARG 824           HG2      ARG 824  32.362 -18.523  -8.031
    6    HG3  ARG 824           HG3      ARG 824  32.579 -19.859  -9.156
    7    HD2  ARG 824           HD2      ARG 824  34.127 -20.214  -7.414
    8    HD3  ARG 824           HD3      ARG 824  35.043 -19.637  -8.783
    9    HE   ARG 824           HE       ARG 824  34.567 -17.362  -7.434
   10   HH11  ARG 824          HH11      ARG 824  35.964 -20.489  -6.467
   11   HH12  ARG 824          HH12      ARG 824  36.924 -19.843  -5.214
   12   HH21  ARG 824          HH21      ARG 824  35.914 -16.472  -5.642
   13   HH22  ARG 824          HH22      ARG 824  36.877 -17.531  -4.740

  No H/Q in entry =          13
  In of MODEL    7
    1    H    CYS 825           H        CYS 825  31.551 -15.313 -10.801
    2    HA   CYS 825           HA       CYS 825  29.777 -15.201  -8.584
    3    HB2  CYS 825           HB2      CYS 825  31.308 -13.338  -9.594
    4    HB3  CYS 825           HB3      CYS 825  29.999 -13.101 -10.730

  No H/Q in entry =           4
  In of MODEL    7
    1    H    ARG 826           H        ARG 826  29.367 -15.192 -12.098
    2    HA   ARG 826           HA       ARG 826  26.548 -14.739 -12.027
    3    HB2  ARG 826           HB2      ARG 826  26.591 -15.265 -14.421
    4    HB3  ARG 826           HB3      ARG 826  27.802 -14.058 -13.963
    5    HG2  ARG 826           HG2      ARG 826  29.466 -15.891 -13.950
    6    HG3  ARG 826           HG3      ARG 826  28.217 -16.964 -14.572
    7    HD2  ARG 826           HD2      ARG 826  29.179 -14.448 -15.902
    8    HD3  ARG 826           HD3      ARG 826  29.681 -16.088 -16.301
    9    HE   ARG 826           HE       ARG 826  27.242 -16.469 -16.721
   10   HH11  ARG 826          HH11      ARG 826  28.596 -13.226 -17.041
   11   HH12  ARG 826          HH12      ARG 826  27.923 -12.876 -18.554
   12   HH21  ARG 826          HH21      ARG 826  26.186 -15.985 -18.825
   13   HH22  ARG 826          HH22      ARG 826  26.459 -14.481 -19.571

  No H/Q in entry =          13
  In of MODEL    7
    1    H    GLY 827           H        GLY 827  28.497 -17.667 -12.084
    2    HA3  GLY 827           HA2      GLY 827  27.208 -19.604 -11.153
    3    HA2  GLY 827           HA3      GLY 827  25.956 -19.098 -12.294

  No H/Q in entry =           3
  In of MODEL    7
    1    H    GLN 828           H        GLN 828  28.823 -18.656 -13.806
    2    HA   GLN 828           HA       GLN 828  28.441 -20.825 -15.606
    3    HB2  GLN 828           HB2      GLN 828  29.483 -18.697 -16.279
    4    HB3  GLN 828           HB3      GLN 828  30.827 -19.008 -15.196
    5    HG2  GLN 828           HG2      GLN 828  31.444 -19.468 -17.518
    6    HG3  GLN 828           HG3      GLN 828  31.478 -20.926 -16.538
    7   HE21  GLN 828          HE21      GLN 828  29.747 -19.222 -19.048
    8   HE22  GLN 828          HE22      GLN 828  28.843 -20.584 -19.566

  No H/Q in entry =           8
  In of MODEL    7
    1    H    SER 829           H        SER 829  29.770 -22.697 -15.895
    2    HA   SER 829           HA       SER 829  30.706 -23.735 -13.399
    3    HB2  SER 829           HB2      SER 829  31.051 -25.783 -14.929
    4    HB3  SER 829           HB3      SER 829  29.423 -25.262 -14.510
    5    HG   SER 829           HG       SER 829  30.557 -25.476 -16.917

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ILE 830           H        ILE 830  32.660 -23.332 -12.746
    2    HA   ILE 830           HA       ILE 830  34.812 -23.783 -14.586
    3    HB   ILE 830           HB       ILE 830  36.106 -21.842 -13.890
    4   HG12  ILE 830          HG12      ILE 830  35.162 -21.578 -11.595
    5   HG13  ILE 830          HG13      ILE 830  35.305 -20.042 -12.403
    6   HG22  ILE 830          HG21      ILE 830  34.863 -19.985 -14.920
    7   HG21  ILE 830          HG22      ILE 830  33.414 -21.002 -14.884
    8   HG23  ILE 830          HG23      ILE 830  34.806 -21.487 -15.851
    9   HD11  ILE 830          HD11      ILE 830  32.801 -21.649 -12.005
   10   HD13  ILE 830          HD12      ILE 830  32.896 -20.121 -12.882
   11   HD12  ILE 830          HD13      ILE 830  33.274 -20.178 -11.158

  No H/Q in entry =          11
  In of MODEL    7
    1    H    SER 831           H        SER 831  36.709 -24.450 -13.538
    2    HA   SER 831           HA       SER 831  36.370 -25.059 -10.700
    3    HB2  SER 831           HB2      SER 831  37.763 -26.549 -12.894
    4    HB3  SER 831           HB3      SER 831  37.783 -27.008 -11.197
    5    HG   SER 831           HG       SER 831  35.275 -26.663 -11.809

  No H/Q in entry =           5
  In of MODEL    7
    1    H    VAL 832           H        VAL 832  37.618 -23.476  -9.732
    2    HA   VAL 832           HA       VAL 832  39.978 -22.413 -10.943
    3    HB   VAL 832           HB       VAL 832  39.193 -22.301  -8.008
    4   HG11  VAL 832          HG11      VAL 832  41.544 -21.767  -8.408
    5   HG13  VAL 832          HG12      VAL 832  40.655 -20.323  -7.915
    6   HG12  VAL 832          HG13      VAL 832  41.081 -20.566  -9.610
    7   HG21  VAL 832          HG21      VAL 832  37.424 -21.353  -9.405
    8   HG23  VAL 832          HG22      VAL 832  38.605 -20.331 -10.224
    9   HG22  VAL 832          HG23      VAL 832  38.257 -20.081  -8.513

  No H/Q in entry =           9
  In of MODEL    7
    1    H    THR 833           H        THR 833  41.590 -23.731 -11.370
    2    HA   THR 833           HA       THR 833  42.089 -25.951  -9.648
    3    HB   THR 833           HB       THR 833  43.765 -26.466 -11.481
    4    HG1  THR 833           HG1      THR 833  43.743 -25.279 -13.241
    5   HG23  THR 833          HG21      THR 833  42.001 -27.220 -13.029
    6   HG22  THR 833          HG22      THR 833  40.857 -26.154 -12.225
    7   HG21  THR 833          HG23      THR 833  41.547 -27.523 -11.348

  No H/Q in entry =           7
  In of MODEL    7
    1    H    SER 834           H        SER 834  43.517 -22.876 -10.502
    2    HA   SER 834           HA       SER 834  45.211 -23.091  -8.214
    3    HB2  SER 834           HB2      SER 834  46.591 -24.212  -9.926
    4    HB3  SER 834           HB3      SER 834  46.481 -22.785 -10.951
    5    HG   SER 834           HG       SER 834  47.974 -23.257  -8.690

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ILE 835           H        ILE 835  45.897 -21.164  -7.492
    2    HA   ILE 835           HA       ILE 835  44.540 -18.771  -8.507
    3    HB   ILE 835           HB       ILE 835  45.088 -17.729  -6.515
    4   HG12  ILE 835          HG12      ILE 835  47.462 -18.224  -6.210
    5   HG13  ILE 835          HG13      ILE 835  46.596 -18.607  -4.738
    6   HG22  ILE 835          HG21      ILE 835  44.435 -20.547  -5.859
    7   HG21  ILE 835          HG22      ILE 835  43.332 -19.229  -6.258
    8   HG23  ILE 835          HG23      ILE 835  44.265 -19.177  -4.759
    9   HD12  ILE 835          HD11      ILE 835  47.624 -20.540  -6.788
   10   HD11  ILE 835          HD12      ILE 835  46.706 -20.973  -5.341
   11   HD13  ILE 835          HD13      ILE 835  48.301 -20.231  -5.180

  No H/Q in entry =          11
  In of MODEL    7
    1    H    ARG 836           H        ARG 836  47.204 -20.308  -9.454
    2    HA   ARG 836           HA       ARG 836  48.578 -17.789 -10.053
    3    HB2  ARG 836           HB2      ARG 836  50.594 -18.980 -10.363
    4    HB3  ARG 836           HB3      ARG 836  49.887 -19.602  -8.889
    5    HG2  ARG 836           HG2      ARG 836  49.208 -21.603  -9.967
    6    HG3  ARG 836           HG3      ARG 836  49.696 -20.962 -11.548
    7    HD2  ARG 836           HD2      ARG 836  51.928 -20.727 -10.798
    8    HD3  ARG 836           HD3      ARG 836  51.463 -21.285  -9.195
    9    HE   ARG 836           HE       ARG 836  50.736 -23.321 -10.852
   10   HH11  ARG 836          HH11      ARG 836  53.789 -21.556 -10.455
   11   HH12  ARG 836          HH12      ARG 836  54.766 -22.939 -10.607
   12   HH21  ARG 836          HH21      ARG 836  52.100 -25.212 -11.117
   13   HH22  ARG 836          HH22      ARG 836  53.803 -25.046 -10.989

  No H/Q in entry =          13
  In of MODEL    7
    1    HA   PRO 837           HA       PRO 837  47.147 -18.424 -14.156
    2    HB2  PRO 837           HB2      PRO 837  49.164 -17.386 -15.651
    3    HB3  PRO 837           HB3      PRO 837  48.054 -16.387 -14.710
    4    HG2  PRO 837           HG2      PRO 837  50.826 -17.270 -14.031
    5    HG3  PRO 837           HG3      PRO 837  50.078 -15.681 -13.817
    6    HD2  PRO 837           HD2      PRO 837  50.348 -17.436 -11.794
    7    HD3  PRO 837           HD3      PRO 837  48.991 -16.299 -11.904

  No H/Q in entry =           7
  In of MODEL    7
    1    H    CYS 838           H        CYS 838  47.385 -19.794 -15.970
    2    HA   CYS 838           HA       CYS 838  49.542 -21.708 -15.736
    3    HB2  CYS 838           HB2      CYS 838  46.763 -21.943 -16.829
    4    HB3  CYS 838           HB3      CYS 838  48.005 -23.059 -17.370

  No H/Q in entry =           4
  In of MODEL    7
    1    H    ALA 839           H        ALA 839  49.937 -22.733 -18.140
    2    HA   ALA 839           HA       ALA 839  50.837 -20.501 -19.723
    3    HB2  ALA 839           HB1      ALA 839  52.322 -22.435 -19.365
    4    HB3  ALA 839           HB2      ALA 839  51.983 -22.186 -21.078
    5    HB1  ALA 839           HB3      ALA 839  51.162 -23.472 -20.194

  No H/Q in entry =           5
  In of MODEL    7
    1    H    ALA 840           H        ALA 840  48.398 -20.173 -19.743
    2    HA   ALA 840           HA       ALA 840  47.406 -21.111 -22.357
    3    HB3  ALA 840           HB1      ALA 840  45.125 -20.768 -21.504
    4    HB1  ALA 840           HB2      ALA 840  45.788 -20.310 -19.931
    5    HB2  ALA 840           HB3      ALA 840  46.004 -21.950 -20.534

  No H/Q in entry =           5
  In of MODEL    7
    1    H    GLU 841           H        GLU 841  48.612 -18.582 -20.578
    2    HA   GLU 841           HA       GLU 841  47.171 -16.502 -22.070
    3    HB2  GLU 841           HB2      GLU 841  48.250 -14.924 -20.535
    4    HB3  GLU 841           HB3      GLU 841  47.370 -16.160 -19.645
    5    HG2  GLU 841           HG2      GLU 841  49.336 -17.230 -18.961
    6    HG3  GLU 841           HG3      GLU 841  50.310 -16.400 -20.171

  No H/Q in entry =           6
  In of MODEL    7
    1    H    THR 842           H        THR 842  49.544 -18.475 -22.644
    2    HA   THR 842           HA       THR 842  51.674 -16.754 -23.367
    3    HB   THR 842           HB       THR 842  52.387 -19.087 -24.359
    4    HG1  THR 842           HG1      THR 842  50.647 -20.327 -24.175
    5   HG23  THR 842          HG21      THR 842  53.393 -18.013 -22.362
    6   HG22  THR 842          HG22      THR 842  53.186 -19.749 -22.121
    7   HG21  THR 842          HG23      THR 842  52.056 -18.617 -21.383

  No H/Q in entry =           7
  In of MODEL    7
    1    H    GLN 843           H        GLN 843  51.621 -15.619 -25.195
    2    HA   GLN 843           HA       GLN 843  50.550 -16.842 -27.570
    3    HB2  GLN 843           HB2      GLN 843  49.457 -14.697 -28.223
    4    HB3  GLN 843           HB3      GLN 843  48.704 -15.467 -26.837
    5    HG2  GLN 843           HG2      GLN 843  49.792 -13.885 -25.345
    6    HG3  GLN 843           HG3      GLN 843  50.637 -13.163 -26.712
    7   HE21  GLN 843          HE21      GLN 843  49.744 -11.156 -26.332
    8   HE22  GLN 843          HE22      GLN 843  48.096 -10.803 -26.687

  No H/Q in entry =           8
  In of MODEL    8
    1    H1   GLY 689           H3       GLY 689  61.996  12.061  -0.570
    2    H2   GLY 689           H2       GLY 689  62.919  13.378  -0.070
    3    H3   GLY 689           H1       GLY 689  61.433  13.630  -0.847
    4    HA2  GLY 689           HA2      GLY 689  63.830  12.401  -2.020
    5    HA3  GLY 689           HA3      GLY 689  63.240  14.028  -2.358

  No H/Q in entry =           5
  In of MODEL    8
    1    H    SER 690           H        SER 690  62.936  13.594  -4.575
    2    HA   SER 690           HA       SER 690  60.963  11.574  -5.185
    3    HB2  SER 690           HB2      SER 690  59.791  13.774  -4.861
    4    HB3  SER 690           HB3      SER 690  60.806  14.463  -6.117
    5    HG   SER 690           HG       SER 690  59.069  13.885  -7.197

  No H/Q in entry =           5
  In of MODEL    8
    1    H    HIS 691           H        HIS 691  60.972  11.122  -7.487
    2    HA   HIS 691           HA       HIS 691  63.512  11.770  -8.760
    3    HB2  HIS 691           HB2      HIS 691  63.570   9.419  -9.702
    4    HB3  HIS 691           HB3      HIS 691  63.793   9.491  -7.966
    5    HD1  HIS 691           HD1      HIS 691  61.833   7.864 -10.564
    6    HD2  HIS 691           HD2      HIS 691  61.367   8.687  -6.524
    7    HE1  HIS 691           HE1      HIS 691  60.031   6.330  -9.768
    8    HE2  HIS 691           HE2      HIS 691  59.559   7.101  -7.423

  No H/Q in entry =           8
  In of MODEL    8
    1    H    MET 692           H        MET 692  63.432  12.197 -10.884
    2    HA   MET 692           HA       MET 692  60.830  12.978 -11.886
    3    HB2  MET 692           HB2      MET 692  62.024  14.092 -13.670
    4    HB3  MET 692           HB3      MET 692  62.803  14.460 -12.135
    5    HG2  MET 692           HG2      MET 692  64.559  12.867 -12.609
    6    HG3  MET 692           HG3      MET 692  63.759  12.381 -14.102
    7    HE2  MET 692           HE1      MET 692  65.949  12.757 -15.519
    8    HE1  MET 692           HE2      MET 692  66.795  13.138 -14.020
    9    HE3  MET 692           HE3      MET 692  66.942  14.212 -15.410

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ASN 693           H        ASN 693  62.937  10.311 -12.287
    2    HA   ASN 693           HA       ASN 693  61.286   9.432 -14.516
    3    HB2  ASN 693           HB2      ASN 693  63.195   8.530 -15.736
    4    HB3  ASN 693           HB3      ASN 693  63.433  10.251 -15.475
    5   HD21  ASN 693          HD21      ASN 693  64.538   7.032 -14.672
    6   HD22  ASN 693          HD22      ASN 693  66.000   7.510 -13.912

  No H/Q in entry =           6
  In of MODEL    8
    1    HA   PRO 694           HA       PRO 694  61.847   5.583 -12.283
    2    HB2  PRO 694           HB2      PRO 694  60.097   4.118 -13.657
    3    HB3  PRO 694           HB3      PRO 694  59.525   5.461 -12.663
    4    HG2  PRO 694           HG2      PRO 694  59.710   5.259 -15.614
    5    HG3  PRO 694           HG3      PRO 694  58.634   6.254 -14.621
    6    HD2  PRO 694           HD2      PRO 694  61.105   7.018 -15.887
    7    HD3  PRO 694           HD3      PRO 694  60.012   8.017 -14.910

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LEU 695           H        LEU 695  61.779   3.125 -13.571
    2    HA   LEU 695           HA       LEU 695  64.137   3.263 -15.247
    3    HB2  LEU 695           HB2      LEU 695  62.727   0.976 -13.881
    4    HB3  LEU 695           HB3      LEU 695  63.918   0.684 -15.126
    5    HG   LEU 695           HG       LEU 695  65.644   1.767 -13.743
    6   HD13  LEU 695          HD11      LEU 695  65.235   2.385 -11.449
    7   HD12  LEU 695          HD12      LEU 695  63.524   1.999 -11.620
    8   HD11  LEU 695          HD13      LEU 695  64.221   3.343 -12.526
    9   HD21  LEU 695          HD21      LEU 695  65.302  -0.633 -13.557
   10   HD23  LEU 695          HD22      LEU 695  64.105  -0.370 -12.291
   11   HD22  LEU 695          HD23      LEU 695  65.791   0.061 -12.011

  No H/Q in entry =          11
  In of MODEL    8
    1    H    THR 696           H        THR 696  63.579   3.910 -17.163
    2    HA   THR 696           HA       THR 696  61.288   2.763 -18.491
    3    HB   THR 696           HB       THR 696  61.965   4.505 -20.260
    4    HG1  THR 696           HG1      THR 696  63.138   6.256 -19.081
    5   HG21  THR 696          HG21      THR 696  60.071   4.780 -18.714
    6   HG23  THR 696          HG22      THR 696  60.905   6.312 -18.984
    7   HG22  THR 696          HG23      THR 696  61.172   5.412 -17.491

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLN 697           H        GLN 697  64.799   2.974 -18.846
    2    HA   GLN 697           HA       GLN 697  64.659   1.152 -21.098
    3    HB2  GLN 697           HB2      GLN 697  67.046   2.409 -19.746
    4    HB3  GLN 697           HB3      GLN 697  67.107   1.349 -21.152
    5    HG2  GLN 697           HG2      GLN 697  65.617   2.978 -22.333
    6    HG3  GLN 697           HG3      GLN 697  65.855   4.072 -20.972
    7   HE21  GLN 697          HE21      GLN 697  68.306   1.932 -22.267
    8   HE22  GLN 697          HE22      GLN 697  69.298   3.184 -22.872

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ALA 698           H        ALA 698  64.118  -0.710 -20.552
    2    HA   ALA 698           HA       ALA 698  63.966  -2.714 -19.677
    3    HB3  ALA 698           HB1      ALA 698  66.357  -2.113 -17.908
    4    HB1  ALA 698           HB2      ALA 698  66.451  -2.854 -19.505
    5    HB2  ALA 698           HB3      ALA 698  65.642  -3.703 -18.187

  No H/Q in entry =           5
  In of MODEL    8
    1    H    VAL 699           H        VAL 699  62.043  -2.063 -19.048
    2    HA   VAL 699           HA       VAL 699  61.595  -1.001 -16.392
    3    HB   VAL 699           HB       VAL 699  59.562  -2.038 -18.388
    4   HG12  VAL 699          HG11      VAL 699  57.961  -0.620 -17.179
    5   HG11  VAL 699          HG12      VAL 699  59.227  -0.220 -16.015
    6   HG13  VAL 699          HG13      VAL 699  58.661  -1.881 -16.163
    7   HG23  VAL 699          HG21      VAL 699  60.535   0.788 -18.028
    8   HG22  VAL 699          HG22      VAL 699  59.191   0.293 -19.058
    9   HG21  VAL 699          HG23      VAL 699  60.830  -0.245 -19.425

  No H/Q in entry =           9
  In of MODEL    8
    1    HA   PRO 700           HA       PRO 700  61.396  -5.274 -15.038
    2    HB2  PRO 700           HB2      PRO 700  61.267  -4.767 -12.381
    3    HB3  PRO 700           HB3      PRO 700  62.772  -4.785 -13.303
    4    HG2  PRO 700           HG2      PRO 700  61.191  -2.476 -12.287
    5    HG3  PRO 700           HG3      PRO 700  62.940  -2.612 -12.516
    6    HD2  PRO 700           HD2      PRO 700  61.174  -1.302 -14.229
    7    HD3  PRO 700           HD3      PRO 700  62.814  -1.829 -14.647

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LYS 701           H        LYS 701  59.742  -6.429 -14.943
    2    HA   LYS 701           HA       LYS 701  57.178  -5.252 -14.221
    3    HB2  LYS 701           HB2      LYS 701  57.886  -7.718 -15.786
    4    HB3  LYS 701           HB3      LYS 701  56.260  -7.377 -15.220
    5    HG2  LYS 701           HG2      LYS 701  56.189  -5.353 -16.544
    6    HG3  LYS 701           HG3      LYS 701  57.853  -5.622 -17.079
    7    HD2  LYS 701           HD2      LYS 701  57.259  -7.645 -18.135
    8    HD3  LYS 701           HD3      LYS 701  55.607  -7.572 -17.514
    9    HE2  LYS 701           HE2      LYS 701  56.851  -5.597 -19.446
   10    HE3  LYS 701           HE3      LYS 701  55.774  -6.904 -19.910
   11    HZ3  LYS 701           HZ1      LYS 701  54.604  -4.829 -19.769
   12    HZ2  LYS 701           HZ2      LYS 701  55.095  -4.586 -18.189
   13    HZ1  LYS 701           HZ3      LYS 701  54.020  -5.837 -18.549

  No H/Q in entry =          13
  In of MODEL    8
    1    H    CYS 702           H        CYS 702  56.303  -5.767 -12.379
    2    HA   CYS 702           HA       CYS 702  57.539  -7.923 -10.851
    3    HB2  CYS 702           HB2      CYS 702  55.680  -5.772  -9.801
    4    HB3  CYS 702           HB3      CYS 702  56.769  -6.803  -8.900

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLN 703           H        GLN 703  56.214  -9.525 -10.002
    2    HA   GLN 703           HA       GLN 703  53.856 -10.046 -11.498
    3    HB2  GLN 703           HB2      GLN 703  55.041 -11.440  -9.102
    4    HB3  GLN 703           HB3      GLN 703  53.681 -12.052 -10.024
    5    HG2  GLN 703           HG2      GLN 703  56.449 -11.560 -11.104
    6    HG3  GLN 703           HG3      GLN 703  55.813 -13.131 -10.625
    7   HE21  GLN 703          HE21      GLN 703  56.099 -13.990 -12.713
    8   HE22  GLN 703          HE22      GLN 703  55.094 -13.519 -14.034

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ARG 704           H        ARG 704  51.885 -10.814 -10.207
    2    HA   ARG 704           HA       ARG 704  50.562  -8.545  -9.284
    3    HB2  ARG 704           HB2      ARG 704  49.892 -11.423  -8.776
    4    HB3  ARG 704           HB3      ARG 704  48.795 -10.073  -8.545
    5    HG2  ARG 704           HG2      ARG 704  50.053 -10.809 -11.164
    6    HG3  ARG 704           HG3      ARG 704  48.453 -11.325 -10.627
    7    HD2  ARG 704           HD2      ARG 704  47.730  -9.023 -10.555
    8    HD3  ARG 704           HD3      ARG 704  49.351  -8.484 -10.979
    9    HE   ARG 704           HE       ARG 704  48.835 -10.144 -12.989
   10   HH11  ARG 704          HH11      ARG 704  46.924  -7.408 -11.740
   11   HH12  ARG 704          HH12      ARG 704  46.181  -7.108 -13.241
   12   HH21  ARG 704          HH21      ARG 704  47.760  -9.688 -15.040
   13   HH22  ARG 704          HH22      ARG 704  46.631  -8.427 -15.105

  No H/Q in entry =          13
  In of MODEL    8
    1    H    TRP 705           H        TRP 705  52.323 -10.952  -7.479
    2    HA   TRP 705           HA       TRP 705  51.455  -9.902  -4.898
    3    HB2  TRP 705           HB2      TRP 705  52.679 -11.914  -4.029
    4    HB3  TRP 705           HB3      TRP 705  51.325 -12.281  -5.094
    5    HD1  TRP 705           HD1      TRP 705  55.112 -12.632  -4.831
    6    HE1  TRP 705           HE1      TRP 705  55.964 -14.057  -6.749
    7    HE3  TRP 705           HE3      TRP 705  50.799 -12.981  -7.575
    8    HZ2  TRP 705           HZ2      TRP 705  54.961 -15.244  -9.119
    9    HZ3  TRP 705           HZ3      TRP 705  50.840 -14.290  -9.657
   10    HH2  TRP 705           HH2      TRP 705  52.876 -15.402 -10.410

  No H/Q in entry =          10
  In of MODEL    8
    1    H    GLU 706           H        GLU 706  53.506  -8.858  -7.025
    2    HA   GLU 706           HA       GLU 706  55.620  -8.343  -5.092
    3    HB2  GLU 706           HB2      GLU 706  55.823  -8.656  -8.096
    4    HB3  GLU 706           HB3      GLU 706  57.146  -8.092  -7.057
    5    HG2  GLU 706           HG2      GLU 706  57.067 -10.291  -5.949
    6    HG3  GLU 706           HG3      GLU 706  55.816 -10.789  -7.091

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS 707           H        LYS 707  56.528  -6.256  -5.250
    2    HA   LYS 707           HA       LYS 707  54.898  -4.316  -6.687
    3    HB2  LYS 707           HB2      LYS 707  54.951  -2.767  -4.727
    4    HB3  LYS 707           HB3      LYS 707  53.989  -4.208  -4.460
    5    HG2  LYS 707           HG2      LYS 707  55.750  -5.172  -3.103
    6    HG3  LYS 707           HG3      LYS 707  56.796  -3.796  -3.444
    7    HD2  LYS 707           HD2      LYS 707  55.244  -2.300  -2.328
    8    HD3  LYS 707           HD3      LYS 707  54.133  -3.635  -2.032
    9    HE2  LYS 707           HE2      LYS 707  55.767  -4.718  -0.602
   10    HE3  LYS 707           HE3      LYS 707  56.948  -3.464  -0.965
   11    HZ1  LYS 707           HZ1      LYS 707  54.351  -2.982   0.421
   12    HZ3  LYS 707           HZ2      LYS 707  55.592  -1.854   0.163
   13    HZ2  LYS 707           HZ3      LYS 707  55.855  -3.167   1.186

  No H/Q in entry =          13
  In of MODEL    8
    1    H    LEU 708           H        LEU 708  55.932  -2.344  -7.135
    2    HA   LEU 708           HA       LEU 708  58.781  -2.761  -7.529
    3    HB2  LEU 708           HB2      LEU 708  57.388  -2.317  -9.493
    4    HB3  LEU 708           HB3      LEU 708  56.846  -0.811  -8.788
    5    HG   LEU 708           HG       LEU 708  59.184   0.043  -8.950
    6   HD13  LEU 708          HD11      LEU 708  60.375  -2.074  -8.935
    7   HD12  LEU 708          HD12      LEU 708  60.769  -1.142 -10.377
    8   HD11  LEU 708          HD13      LEU 708  59.654  -2.505 -10.485
    9   HD21  LEU 708          HD21      LEU 708  57.945  -0.912 -11.525
   10   HD23  LEU 708          HD22      LEU 708  59.144   0.372 -11.366
   11   HD22  LEU 708          HD23      LEU 708  57.540   0.570 -10.660

  No H/Q in entry =          11
  In of MODEL    8
    1    H    GLN 709           H        GLN 709  59.808  -2.073  -5.760
    2    HA   GLN 709           HA       GLN 709  59.585   0.772  -5.105
    3    HB2  GLN 709           HB2      GLN 709  59.731   0.414  -2.748
    4    HB3  GLN 709           HB3      GLN 709  58.411  -0.600  -3.304
    5    HG2  GLN 709           HG2      GLN 709  59.879  -2.554  -3.201
    6    HG3  GLN 709           HG3      GLN 709  61.209  -1.534  -2.725
    7   HE21  GLN 709          HE21      GLN 709  61.304  -0.705  -0.650
    8   HE22  GLN 709          HE22      GLN 709  60.290  -1.267   0.618

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ASN 710           H        ASN 710  61.530   1.655  -4.478
    2    HA   ASN 710           HA       ASN 710  63.802   1.909  -4.359
    3    HB2  ASN 710           HB2      ASN 710  63.432  -0.004  -2.618
    4    HB3  ASN 710           HB3      ASN 710  63.909  -1.069  -3.909
    5   HD21  ASN 710          HD21      ASN 710  65.517  -1.760  -2.566
    6   HD22  ASN 710          HD22      ASN 710  66.969  -0.842  -2.375

  No H/Q in entry =           6
  In of MODEL    8
    1    H    SER 711           H        SER 711  62.336   1.120  -6.772
    2    HA   SER 711           HA       SER 711  62.652   0.826  -8.967
    3    HB2  SER 711           HB2      SER 711  65.569   1.009  -8.221
    4    HB3  SER 711           HB3      SER 711  64.945   1.097  -9.873
    5    HG   SER 711           HG       SER 711  63.532   2.820  -8.756

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ARG 712           H        ARG 712  62.597  -1.525  -7.049
    2    HA   ARG 712           HA       ARG 712  63.358  -3.475  -9.072
    3    HB2  ARG 712           HB2      ARG 712  64.264  -5.004  -7.423
    4    HB3  ARG 712           HB3      ARG 712  65.174  -3.506  -7.403
    5    HG2  ARG 712           HG2      ARG 712  64.208  -2.835  -5.336
    6    HG3  ARG 712           HG3      ARG 712  62.939  -4.035  -5.491
    7    HD2  ARG 712           HD2      ARG 712  65.831  -4.758  -5.257
    8    HD3  ARG 712           HD3      ARG 712  64.734  -4.674  -3.858
    9    HE   ARG 712           HE       ARG 712  64.042  -6.408  -6.128
   10   HH11  ARG 712          HH11      ARG 712  65.174  -6.265  -2.736
   11   HH12  ARG 712          HH12      ARG 712  64.748  -7.871  -2.437
   12   HH21  ARG 712          HH21      ARG 712  63.462  -8.547  -5.650
   13   HH22  ARG 712          HH22      ARG 712  63.783  -9.223  -4.120

  No H/Q in entry =          13
  In of MODEL    8
    1    H    CYS 713           H        CYS 713  62.418  -5.632  -8.398
    2    HA   CYS 713           HA       CYS 713  59.694  -5.169  -7.461
    3    HB2  CYS 713           HB2      CYS 713  60.885  -7.494  -8.993
    4    HB3  CYS 713           HB3      CYS 713  59.208  -7.391  -8.468

  No H/Q in entry =           4
  In of MODEL    8
    1    H    VAL 714           H        VAL 714  59.276  -5.665  -5.488
    2    HA   VAL 714           HA       VAL 714  60.753  -7.839  -4.162
    3    HB   VAL 714           HB       VAL 714  60.387  -6.704  -2.020
    4   HG12  VAL 714          HG11      VAL 714  61.777  -4.712  -2.294
    5   HG11  VAL 714          HG12      VAL 714  61.567  -4.825  -4.040
    6   HG13  VAL 714          HG13      VAL 714  62.417  -6.101  -3.171
    7   HG23  VAL 714          HG21      VAL 714  59.422  -4.443  -1.898
    8   HG22  VAL 714          HG22      VAL 714  58.265  -5.635  -2.490
    9   HG21  VAL 714          HG23      VAL 714  59.049  -4.531  -3.622

  No H/Q in entry =           9
  In of MODEL    8
    1    H    CYS 715           H        CYS 715  59.206  -8.550  -2.203
    2    HA   CYS 715           HA       CYS 715  56.732  -9.218  -3.542
    3    HB2  CYS 715           HB2      CYS 715  58.085 -10.195  -1.068
    4    HB3  CYS 715           HB3      CYS 715  56.362 -10.466  -1.271

  No H/Q in entry =           4
  In of MODEL    8
    1    H    LYS 716           H        LYS 716  54.751  -8.782  -2.769
    2    HA   LYS 716           HA       LYS 716  54.363  -6.261  -1.507
    3    HB2  LYS 716           HB2      LYS 716  52.982  -7.375  -3.341
    4    HB3  LYS 716           HB3      LYS 716  52.373  -8.456  -2.110
    5    HG2  LYS 716           HG2      LYS 716  51.371  -6.546  -0.951
    6    HG3  LYS 716           HG3      LYS 716  51.970  -5.475  -2.224
    7    HD2  LYS 716           HD2      LYS 716  50.713  -6.885  -3.868
    8    HD3  LYS 716           HD3      LYS 716  49.998  -7.734  -2.504
    9    HE2  LYS 716           HE2      LYS 716  48.473  -6.025  -3.282
   10    HE3  LYS 716           HE3      LYS 716  49.076  -5.604  -1.681
   11    HZ3  LYS 716           HZ1      LYS 716  50.620  -4.043  -2.695
   12    HZ2  LYS 716           HZ2      LYS 716  49.048  -3.706  -3.201
   13    HZ1  LYS 716           HZ3      LYS 716  50.094  -4.495  -4.241

  No H/Q in entry =          13
  In of MODEL    8
    1    H    MET 717           H        MET 717  52.602  -6.315   0.379
    2    HA   MET 717           HA       MET 717  53.482  -8.333   2.300
    3    HB2  MET 717           HB2      MET 717  52.508  -5.510   2.778
    4    HB3  MET 717           HB3      MET 717  52.844  -6.666   4.056
    5    HG2  MET 717           HG2      MET 717  54.844  -5.554   2.092
    6    HG3  MET 717           HG3      MET 717  54.685  -5.111   3.789
    7    HE3  MET 717           HE1      MET 717  55.846  -8.398   5.603
    8    HE2  MET 717           HE2      MET 717  54.192  -7.927   5.217
    9    HE1  MET 717           HE3      MET 717  55.337  -6.723   5.820

  No H/Q in entry =           9
  In of MODEL    8
    1    HA   PRO 718           HA       PRO 718  49.427 -10.054   2.298
    2    HB2  PRO 718           HB2      PRO 718  49.527 -10.129   5.265
    3    HB3  PRO 718           HB3      PRO 718  49.290 -11.451   4.118
    4    HG2  PRO 718           HG2      PRO 718  51.613 -11.146   5.399
    5    HG3  PRO 718           HG3      PRO 718  51.570 -11.674   3.703
    6    HD2  PRO 718           HD2      PRO 718  52.223  -9.004   4.866
    7    HD3  PRO 718           HD3      PRO 718  52.958  -9.860   3.493

  No H/Q in entry =           7
  In of MODEL    8
    1    H    TYR 719           H        TYR 719  49.949  -7.626   4.792
    2    HA   TYR 719           HA       TYR 719  47.151  -7.004   5.065
    3    HB2  TYR 719           HB2      TYR 719  47.900  -5.244   6.618
    4    HB3  TYR 719           HB3      TYR 719  48.660  -6.787   6.992
    5    HD1  TYR 719           HD1      TYR 719  49.222  -3.339   5.965
    6    HD2  TYR 719           HD2      TYR 719  51.043  -7.144   6.434
    7    HE1  TYR 719           HE1      TYR 719  51.440  -2.290   5.832
    8    HE2  TYR 719           HE2      TYR 719  53.248  -6.126   6.314
    9    HH   TYR 719           HH       TYR 719  53.708  -2.767   6.514

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLU 720           H        GLU 720  49.245  -6.355   2.660
    2    HA   GLU 720           HA       GLU 720  48.330  -3.609   2.173
    3    HB2  GLU 720           HB2      GLU 720  50.782  -4.249   2.080
    4    HB3  GLU 720           HB3      GLU 720  50.400  -5.241   0.689
    5    HG2  GLU 720           HG2      GLU 720  49.540  -3.150  -0.421
    6    HG3  GLU 720           HG3      GLU 720  50.247  -2.249   0.921

  No H/Q in entry =           6
  In of MODEL    8
    1    H    CYS 721           H        CYS 721  47.509  -6.753   1.558
    2    HA   CYS 721           HA       CYS 721  46.915  -6.662  -1.210
    3    HB2  CYS 721           HB2      CYS 721  46.207  -8.591   0.968
    4    HB3  CYS 721           HB3      CYS 721  45.547  -8.729  -0.657

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLY 722           H        GLY 722  44.878  -6.926  -2.174
    2    HA3  GLY 722           HA2      GLY 722  42.541  -6.121  -0.711
    3    HA2  GLY 722           HA3      GLY 722  43.084  -5.004  -1.960

  No H/Q in entry =           3
  In of MODEL    8
    1    HA   PRO 723           HA       PRO 723  40.570  -7.132  -4.823
    2    HB2  PRO 723           HB2      PRO 723  42.011  -6.667  -7.132
    3    HB3  PRO 723           HB3      PRO 723  40.919  -5.504  -6.379
    4    HG2  PRO 723           HG2      PRO 723  43.893  -5.715  -6.173
    5    HG3  PRO 723           HG3      PRO 723  42.880  -4.267  -6.337
    6    HD2  PRO 723           HD2      PRO 723  43.929  -4.990  -3.986
    7    HD3  PRO 723           HD3      PRO 723  42.314  -4.264  -4.085

  No H/Q in entry =           7
  In of MODEL    8
    1    H    SER 724           H        SER 724  40.539  -9.309  -4.579
    2    HA   SER 724           HA       SER 724  42.000 -11.040  -6.268
    3    HB2  SER 724           HB2      SER 724  43.092 -12.258  -4.262
    4    HB3  SER 724           HB3      SER 724  43.896 -10.836  -4.922
    5    HG   SER 724           HG       SER 724  42.462  -9.761  -3.233

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU 725           H        LEU 725  41.230 -13.151  -6.255
    2    HA   LEU 725           HA       LEU 725  38.576 -13.580  -5.334
    3    HB2  LEU 725           HB2      LEU 725  40.679 -15.268  -6.648
    4    HB3  LEU 725           HB3      LEU 725  39.231 -16.011  -6.026
    5    HG   LEU 725           HG       LEU 725  39.032 -13.766  -8.011
    6   HD13  LEU 725          HD11      LEU 725  40.533 -15.515  -8.967
    7   HD12  LEU 725          HD12      LEU 725  38.964 -15.492  -9.772
    8   HD11  LEU 725          HD13      LEU 725  39.320 -16.736  -8.573
    9   HD22  LEU 725          HD21      LEU 725  36.956 -14.868  -8.543
   10   HD21  LEU 725          HD22      LEU 725  37.035 -14.507  -6.816
   11   HD23  LEU 725          HD23      LEU 725  37.326 -16.153  -7.397

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ASP 726           H        ASP 726  37.861 -14.514  -3.514
    2    HA   ASP 726           HA       ASP 726  39.775 -15.287  -1.522
    3    HB2  ASP 726           HB2      ASP 726  36.751 -15.239  -1.416
    4    HB3  ASP 726           HB3      ASP 726  37.758 -15.803  -0.091

  No H/Q in entry =           4
  In of MODEL    8
    1    H    VAL 727           H        VAL 727  40.198 -17.206  -0.769
    2    HA   VAL 727           HA       VAL 727  38.999 -19.554  -2.010
    3    HB   VAL 727           HB       VAL 727  41.264 -20.534  -2.443
    4   HG11  VAL 727          HG11      VAL 727  40.723 -17.983  -3.960
    5   HG13  VAL 727          HG12      VAL 727  40.049 -19.572  -4.318
    6   HG12  VAL 727          HG13      VAL 727  41.779 -19.284  -4.501
    7   HG21  VAL 727          HG21      VAL 727  42.572 -19.157  -0.911
    8   HG23  VAL 727          HG22      VAL 727  42.270 -17.735  -1.905
    9   HG22  VAL 727          HG23      VAL 727  43.241 -19.066  -2.541

  No H/Q in entry =           9
  In of MODEL    8
    1    H    CYS 728           H        CYS 728  40.066 -21.564  -0.824
    2    HA   CYS 728           HA       CYS 728  40.584 -20.676   1.899
    3    HB2  CYS 728           HB2      CYS 728  38.283 -21.794   1.422
    4    HB3  CYS 728           HB3      CYS 728  39.193 -23.297   1.359

  No H/Q in entry =           4
  In of MODEL    8
    1    H    ALA 729           H        ALA 729  42.226 -21.695   2.944
    2    HA   ALA 729           HA       ALA 729  43.691 -23.605   1.306
    3    HB1  ALA 729           HB1      ALA 729  44.863 -21.223   2.686
    4    HB3  ALA 729           HB2      ALA 729  44.598 -21.367   0.946
    5    HB2  ALA 729           HB3      ALA 729  45.748 -22.436   1.760

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLN 730           H        GLN 730  45.181 -24.790   2.450
    2    HA   GLN 730           HA       GLN 730  44.530 -25.102   5.269
    3    HB2  GLN 730           HB2      GLN 730  44.194 -27.105   3.858
    4    HB3  GLN 730           HB3      GLN 730  45.858 -26.996   3.344
    5    HG2  GLN 730           HG2      GLN 730  46.672 -27.477   5.493
    6    HG3  GLN 730           HG3      GLN 730  45.078 -27.374   6.219
    7   HE21  GLN 730          HE21      GLN 730  45.066 -29.512   6.988
    8   HE22  GLN 730          HE22      GLN 730  45.074 -30.872   5.936

  No H/Q in entry =           8
  In of MODEL    8
    1    H    ASP 731           H        ASP 731  45.871 -24.316   6.551
    2    HA   ASP 731           HA       ASP 731  48.421 -23.281   5.927
    3    HB2  ASP 731           HB2      ASP 731  47.200 -22.354   7.780
    4    HB3  ASP 731           HB3      ASP 731  46.971 -23.943   8.461

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLU 732           H        GLU 732  50.298 -24.424   5.740
    2    HA   GLU 732           HA       GLU 732  50.132 -27.232   6.180
    3    HB2  GLU 732           HB2      GLU 732  52.359 -25.534   5.143
    4    HB3  GLU 732           HB3      GLU 732  52.498 -27.286   5.314
    5    HG2  GLU 732           HG2      GLU 732  50.416 -27.393   3.823
    6    HG3  GLU 732           HG3      GLU 732  50.732 -25.682   3.520

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ARG 733           H        ARG 733  50.820 -24.820   8.336
    2    HA   ARG 733           HA       ARG 733  52.865 -26.251   9.723
    3    HB2  ARG 733           HB2      ARG 733  51.245 -23.817  10.422
    4    HB3  ARG 733           HB3      ARG 733  52.565 -24.474  11.373
    5    HG2  ARG 733           HG2      ARG 733  52.789 -23.400   8.570
    6    HG3  ARG 733           HG3      ARG 733  53.249 -22.549  10.048
    7    HD2  ARG 733           HD2      ARG 733  54.957 -24.220  10.507
    8    HD3  ARG 733           HD3      ARG 733  54.471 -25.139   9.083
    9    HE   ARG 733           HE       ARG 733  55.075 -22.514   8.354
   10   HH11  ARG 733          HH11      ARG 733  56.697 -25.457   9.422
   11   HH12  ARG 733          HH12      ARG 733  58.142 -25.159   8.573
   12   HH21  ARG 733          HH21      ARG 733  57.097 -22.081   7.174
   13   HH22  ARG 733          HH22      ARG 733  58.382 -23.188   7.278

  No H/Q in entry =          13
  In of MODEL    8
    1    H    SER 734           H        SER 734  49.578 -25.161  10.602
    2    HA   SER 734           HA       SER 734  49.508 -27.317  12.557
    3    HB2  SER 734           HB2      SER 734  47.577 -25.040  12.106
    4    HB3  SER 734           HB3      SER 734  47.612 -26.119  13.500
    5    HG   SER 734           HG       SER 734  49.295 -25.137  14.265

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LYS 735           H        LYS 735  48.766 -27.007   9.406
    2    HA   LYS 735           HA       LYS 735  47.541 -28.105   7.862
    3    HB2  LYS 735           HB2      LYS 735  47.113 -30.133  10.070
    4    HB3  LYS 735           HB3      LYS 735  46.820 -30.414   8.359
    5    HG2  LYS 735           HG2      LYS 735  49.482 -29.902   9.695
    6    HG3  LYS 735           HG3      LYS 735  48.920 -31.420   9.003
    7    HD2  LYS 735           HD2      LYS 735  49.442 -28.871   7.450
    8    HD3  LYS 735           HD3      LYS 735  50.534 -30.245   7.544
    9    HE2  LYS 735           HE2      LYS 735  47.737 -30.304   6.388
   10    HE3  LYS 735           HE3      LYS 735  49.229 -30.227   5.457
   11    HZ3  LYS 735           HZ1      LYS 735  48.380 -32.471   5.579
   12    HZ2  LYS 735           HZ2      LYS 735  48.408 -32.448   7.246
   13    HZ1  LYS 735           HZ3      LYS 735  49.857 -32.374   6.377

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ARG 736           H        ARG 736  46.341 -26.129   9.292
    2    HA   ARG 736           HA       ARG 736  43.570 -26.945   9.811
    3    HB2  ARG 736           HB2      ARG 736  43.420 -24.605  10.780
    4    HB3  ARG 736           HB3      ARG 736  44.511 -25.703  11.622
    5    HG2  ARG 736           HG2      ARG 736  46.413 -24.709  10.379
    6    HG3  ARG 736           HG3      ARG 736  45.285 -23.577   9.645
    7    HD2  ARG 736           HD2      ARG 736  44.897 -22.501  11.696
    8    HD3  ARG 736           HD3      ARG 736  45.655 -23.808  12.615
    9    HE   ARG 736           HE       ARG 736  47.634 -22.965  10.960
   10   HH11  ARG 736          HH11      ARG 736  45.585 -21.243  13.277
   11   HH12  ARG 736          HH12      ARG 736  46.794 -20.142  13.727
   12   HH21  ARG 736          HH21      ARG 736  49.279 -21.439  11.588
   13   HH22  ARG 736          HH22      ARG 736  48.930 -20.249  12.756

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ILE 737           H        ILE 737  41.865 -26.113   8.668
    2    HA   ILE 737           HA       ILE 737  42.479 -24.953   6.095
    3    HB   ILE 737           HB       ILE 737  39.781 -25.551   7.342
    4   HG12  ILE 737          HG12      ILE 737  41.197 -27.607   7.214
    5   HG13  ILE 737          HG13      ILE 737  39.782 -27.677   6.170
    6   HG21  ILE 737          HG21      ILE 737  39.812 -24.004   5.449
    7   HG23  ILE 737          HG22      ILE 737  38.962 -25.507   5.097
    8   HG22  ILE 737          HG23      ILE 737  40.591 -25.246   4.463
    9   HD11  ILE 737          HD11      ILE 737  41.188 -27.071   4.279
   10   HD13  ILE 737          HD12      ILE 737  41.700 -28.583   5.052
   11   HD12  ILE 737          HD13      ILE 737  42.603 -27.087   5.339

  No H/Q in entry =          11
  In of MODEL    8
    1    H    LEU 738           H        LEU 738  42.541 -22.752   5.866
    2    HA   LEU 738           HA       LEU 738  40.728 -21.227   7.522
    3    HB2  LEU 738           HB2      LEU 738  42.359 -19.519   7.944
    4    HB3  LEU 738           HB3      LEU 738  42.869 -21.038   8.665
    5    HG   LEU 738           HG       LEU 738  44.322 -21.103   6.362
    6   HD13  LEU 738          HD11      LEU 738  45.097 -18.999   5.747
    7   HD12  LEU 738          HD12      LEU 738  44.061 -18.212   6.938
    8   HD11  LEU 738          HD13      LEU 738  43.335 -19.071   5.570
    9   HD23  LEU 738          HD21      LEU 738  46.139 -20.096   7.588
   10   HD22  LEU 738          HD22      LEU 738  45.259 -21.269   8.586
   11   HD21  LEU 738          HD23      LEU 738  45.007 -19.529   8.820

  No H/Q in entry =          11
  In of MODEL    8
    1    HA   PRO 739           HA       PRO 739  39.720 -19.208   3.750
    2    HB2  PRO 739           HB2      PRO 739  38.748 -16.866   4.707
    3    HB3  PRO 739           HB3      PRO 739  37.884 -18.409   4.871
    4    HG2  PRO 739           HG2      PRO 739  39.528 -16.932   6.874
    5    HG3  PRO 739           HG3      PRO 739  37.982 -17.768   7.092
    6    HD2  PRO 739           HD2      PRO 739  40.391 -18.863   7.774
    7    HD3  PRO 739           HD3      PRO 739  38.983 -19.830   7.278

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LEU 740           H        LEU 740  40.903 -18.152   2.288
    2    HA   LEU 740           HA       LEU 740  42.604 -15.942   3.106
    3    HB2  LEU 740           HB2      LEU 740  43.498 -18.396   1.626
    4    HB3  LEU 740           HB3      LEU 740  44.298 -16.867   1.366
    5    HG   LEU 740           HG       LEU 740  44.138 -18.350   3.989
    6   HD11  LEU 740          HD11      LEU 740  45.579 -19.404   2.328
    7   HD13  LEU 740          HD12      LEU 740  46.449 -18.766   3.708
    8   HD12  LEU 740          HD13      LEU 740  46.475 -17.890   2.149
    9   HD21  LEU 740          HD21      LEU 740  45.570 -15.797   3.245
   10   HD23  LEU 740          HD22      LEU 740  45.749 -16.667   4.765
   11   HD22  LEU 740          HD23      LEU 740  44.203 -15.932   4.356

  No H/Q in entry =          11
  In of MODEL    8
    1    H    THR 741           H        THR 741  43.667 -15.211   0.891
    2    HA   THR 741           HA       THR 741  41.649 -15.185  -1.186
    3    HB   THR 741           HB       THR 741  43.111 -12.664  -0.384
    4    HG1  THR 741           HG1      THR 741  40.523 -13.366   0.634
    5   HG22  THR 741          HG21      THR 741  40.393 -13.170  -1.574
    6   HG21  THR 741          HG22      THR 741  41.843 -12.737  -2.474
    7   HG23  THR 741          HG23      THR 741  41.139 -11.591  -1.333

  No H/Q in entry =           7
  In of MODEL    8
    1    H    VAL 742           H        VAL 742  42.714 -14.918  -3.274
    2    HA   VAL 742           HA       VAL 742  45.144 -16.205  -3.460
    3    HB   VAL 742           HB       VAL 742  43.763 -16.269  -5.422
    4   HG11  VAL 742          HG11      VAL 742  42.632 -14.201  -5.163
    5   HG13  VAL 742          HG12      VAL 742  43.254 -14.533  -6.781
    6   HG12  VAL 742          HG13      VAL 742  44.088 -13.353  -5.754
    7   HG21  VAL 742          HG21      VAL 742  46.151 -16.351  -5.922
    8   HG23  VAL 742          HG22      VAL 742  46.129 -14.592  -6.126
    9   HG22  VAL 742          HG23      VAL 742  45.205 -15.614  -7.221

  No H/Q in entry =           9
  In of MODEL    8
    1    H    CYS 743           H        CYS 743  44.764 -12.701  -3.320
    2    HA   CYS 743           HA       CYS 743  47.451 -12.085  -3.890
    3    HB2  CYS 743           HB2      CYS 743  45.708 -10.304  -3.693
    4    HB3  CYS 743           HB3      CYS 743  45.671 -10.572  -1.954

  No H/Q in entry =           4
  In of MODEL    8
    1    H    LYS 744           H        LYS 744  45.873 -12.493  -0.731
    2    HA   LYS 744           HA       LYS 744  48.037 -12.267   0.956
    3    HB2  LYS 744           HB2      LYS 744  45.702 -14.158   1.210
    4    HB3  LYS 744           HB3      LYS 744  46.800 -13.717   2.503
    5    HG2  LYS 744           HG2      LYS 744  46.018 -11.380   2.334
    6    HG3  LYS 744           HG3      LYS 744  44.905 -11.865   1.053
    7    HD2  LYS 744           HD2      LYS 744  43.789 -13.402   2.591
    8    HD3  LYS 744           HD3      LYS 744  44.904 -12.945   3.876
    9    HE2  LYS 744           HE2      LYS 744  42.847 -11.781   4.216
   10    HE3  LYS 744           HE3      LYS 744  44.058 -10.617   3.697
   11    HZ2  LYS 744           HZ1      LYS 744  41.835 -10.379   2.622
   12    HZ1  LYS 744           HZ2      LYS 744  42.066 -11.829   1.828
   13    HZ3  LYS 744           HZ3      LYS 744  43.093 -10.521   1.530

  No H/Q in entry =          13
  In of MODEL    8
    1    H    MET 745           H        MET 745  46.719 -15.215  -0.457
    2    HA   MET 745           HA       MET 745  48.551 -17.076   0.510
    3    HB2  MET 745           HB2      MET 745  46.735 -18.076  -0.395
    4    HB3  MET 745           HB3      MET 745  46.610 -16.982  -1.742
    5    HG2  MET 745           HG2      MET 745  47.193 -19.063  -2.691
    6    HG3  MET 745           HG3      MET 745  48.669 -18.138  -2.673
    7    HE2  MET 745           HE1      MET 745  47.741 -21.664   0.118
    8    HE1  MET 745           HE2      MET 745  46.672 -21.036  -1.133
    9    HE3  MET 745           HE3      MET 745  46.949 -20.107   0.343

  No H/Q in entry =           9
  In of MODEL    8
    1    H    HIS 746           H        HIS 746  48.758 -15.163  -2.481
    2    HA   HIS 746           HA       HIS 746  51.158 -16.553  -3.270
    3    HB2  HIS 746           HB2      HIS 746  49.614 -14.338  -4.352
    4    HB3  HIS 746           HB3      HIS 746  51.337 -14.334  -4.789
    5    HD1  HIS 746           HD1      HIS 746  52.111 -16.448  -6.221
    6    HD2  HIS 746           HD2      HIS 746  48.040 -16.029  -5.610
    7    HE1  HIS 746           HE1      HIS 746  51.029 -17.869  -7.976
    8    HE2  HIS 746           HE2      HIS 746  48.553 -17.329  -7.735

  No H/Q in entry =           8
  In of MODEL    8
    1    H    VAL 747           H        VAL 747  50.463 -13.507  -1.736
    2    HA   VAL 747           HA       VAL 747  53.080 -12.569  -1.686
    3    HB   VAL 747           HB       VAL 747  50.642 -11.988  -0.008
    4   HG11  VAL 747          HG11      VAL 747  52.640 -11.641   1.401
    5   HG13  VAL 747          HG12      VAL 747  51.868 -10.117   0.978
    6   HG12  VAL 747          HG13      VAL 747  53.335 -10.625   0.139
    7   HG22  VAL 747          HG21      VAL 747  50.607 -11.221  -2.293
    8   HG21  VAL 747          HG22      VAL 747  52.183 -10.489  -2.097
    9   HG23  VAL 747          HG23      VAL 747  50.793  -9.834  -1.211

  No H/Q in entry =           9
  In of MODEL    8
    1    H    LEU 748           H        LEU 748  51.232 -14.354   0.783
    2    HA   LEU 748           HA       LEU 748  53.442 -14.569   2.487
    3    HB2  LEU 748           HB2      LEU 748  52.147 -16.306   3.721
    4    HB3  LEU 748           HB3      LEU 748  51.218 -14.866   3.395
    5    HG   LEU 748           HG       LEU 748  50.143 -16.154   1.498
    6   HD12  LEU 748          HD11      LEU 748  51.342 -18.506   2.941
    7   HD11  LEU 748          HD12      LEU 748  51.726 -17.981   1.301
    8   HD13  LEU 748          HD13      LEU 748  50.111 -18.582   1.680
    9   HD21  LEU 748          HD21      LEU 748  49.715 -17.040   4.341
   10   HD23  LEU 748          HD22      LEU 748  48.578 -17.273   3.016
   11   HD22  LEU 748          HD23      LEU 748  48.985 -15.643   3.546

  No H/Q in entry =          11
  In of MODEL    8
    1    H    HIS 749           H        HIS 749  52.487 -16.375  -0.266
    2    HA   HIS 749           HA       HIS 749  54.050 -18.685   0.248
    3    HB2  HIS 749           HB2      HIS 749  52.071 -18.249  -1.462
    4    HB3  HIS 749           HB3      HIS 749  53.399 -17.855  -2.546
    5    HD1  HIS 749           HD1      HIS 749  54.441 -19.817  -3.728
    6    HD2  HIS 749           HD2      HIS 749  52.263 -20.924  -0.378
    7    HE1  HIS 749           HE1      HIS 749  54.389 -22.303  -3.774
    8    HE2  HIS 749           HE2      HIS 749  53.384 -22.933  -1.552

  No H/Q in entry =           8
  In of MODEL    8
    1    H    CYS 750           H        CYS 750  54.688 -15.568  -1.339
    2    HA   CYS 750           HA       CYS 750  57.269 -16.580  -2.124
    3    HB2  CYS 750           HB2      CYS 750  57.671 -14.509  -3.278
    4    HB3  CYS 750           HB3      CYS 750  56.031 -15.016  -3.641

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLN 751           H        GLN 751  55.829 -14.756   0.468
    2    HA   GLN 751           HA       GLN 751  58.236 -13.752   1.563
    3    HB2  GLN 751           HB2      GLN 751  55.599 -14.419   2.878
    4    HB3  GLN 751           HB3      GLN 751  56.930 -13.643   3.706
    5    HG2  GLN 751           HG2      GLN 751  55.513 -12.520   1.309
    6    HG3  GLN 751           HG3      GLN 751  55.126 -12.087   2.960
    7   HE21  GLN 751          HE21      GLN 751  55.884 -10.261   0.960
    8   HE22  GLN 751          HE22      GLN 751  57.382  -9.546   1.389

  No H/Q in entry =           8
  In of MODEL    8
    1    H    GLY 752           H        GLY 752  57.092 -16.887   1.248
    2    HA3  GLY 752           HA2      GLY 752  58.676 -18.661   1.655
    3    HA2  GLY 752           HA3      GLY 752  59.188 -17.794   3.092

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ARG 753           H        ARG 753  55.783 -18.092   2.461
    2    HA   ARG 753           HA       ARG 753  55.635 -20.028   4.666
    3    HB2  ARG 753           HB2      ARG 753  53.452 -18.251   3.545
    4    HB3  ARG 753           HB3      ARG 753  53.319 -19.284   4.956
    5    HG2  ARG 753           HG2      ARG 753  55.137 -16.883   4.724
    6    HG3  ARG 753           HG3      ARG 753  53.560 -16.882   5.495
    7    HD2  ARG 753           HD2      ARG 753  55.239 -17.058   7.224
    8    HD3  ARG 753           HD3      ARG 753  54.400 -18.600   7.105
    9    HE   ARG 753           HE       ARG 753  56.699 -18.655   5.487
   10   HH11  ARG 753          HH11      ARG 753  55.858 -18.767   8.906
   11   HH12  ARG 753          HH12      ARG 753  57.275 -19.570   9.381
   12   HH21  ARG 753          HH21      ARG 753  58.592 -19.773   6.093
   13   HH22  ARG 753          HH22      ARG 753  58.900 -20.130   7.732

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ASN 754           H        ASN 754  54.124 -21.817   4.449
    2    HA   ASN 754           HA       ASN 754  53.667 -22.520   1.630
    3    HB2  ASN 754           HB2      ASN 754  54.301 -24.524   3.816
    4    HB3  ASN 754           HB3      ASN 754  54.198 -24.807   2.098
    5   HD21  ASN 754          HD21      ASN 754  56.182 -23.639   4.644
    6   HD22  ASN 754          HD22      ASN 754  57.636 -23.444   3.744

  No H/Q in entry =           6
  In of MODEL    8
    1    H    TYR 755           H        TYR 755  51.654 -23.090   1.147
    2    HA   TYR 755           HA       TYR 755  49.796 -23.930   3.206
    3    HB2  TYR 755           HB2      TYR 755  49.502 -21.514   1.450
    4    HB3  TYR 755           HB3      TYR 755  48.096 -22.391   2.020
    5    HD1  TYR 755           HD1      TYR 755  51.211 -20.810   3.387
    6    HD2  TYR 755           HD2      TYR 755  47.077 -21.582   3.915
    7    HE1  TYR 755           HE1      TYR 755  51.208 -19.374   5.376
    8    HE2  TYR 755           HE2      TYR 755  47.057 -20.156   5.898
    9    HH   TYR 755           HH       TYR 755  49.587 -18.033   6.629

  No H/Q in entry =           9
  In of MODEL    8
    1    H    THR 756           H        THR 756  48.084 -25.093   2.319
    2    HA   THR 756           HA       THR 756  48.507 -26.037  -0.430
    3    HB   THR 756           HB       THR 756  47.126 -27.320   1.938
    4    HG1  THR 756           HG1      THR 756  49.711 -27.346   0.975
    5   HG23  THR 756          HG21      THR 756  46.185 -28.057  -0.165
    6   HG22  THR 756          HG22      THR 756  47.119 -29.362   0.581
    7   HG21  THR 756          HG23      THR 756  47.793 -28.444  -0.781

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LEU 757           H        LEU 757  46.673 -26.061  -1.869
    2    HA   LEU 757           HA       LEU 757  44.474 -24.365  -1.008
    3    HB2  LEU 757           HB2      LEU 757  45.304 -25.371  -3.731
    4    HB3  LEU 757           HB3      LEU 757  43.773 -24.579  -3.462
    5    HG   LEU 757           HG       LEU 757  45.315 -23.020  -4.414
    6   HD11  LEU 757          HD11      LEU 757  43.727 -22.142  -2.827
    7   HD13  LEU 757          HD12      LEU 757  45.225 -21.222  -2.804
    8   HD12  LEU 757          HD13      LEU 757  44.882 -22.372  -1.512
    9   HD23  LEU 757          HD21      LEU 757  47.389 -22.329  -3.274
   10   HD22  LEU 757          HD22      LEU 757  47.432 -24.031  -3.736
   11   HD21  LEU 757          HD23      LEU 757  47.125 -23.581  -2.061

  No H/Q in entry =          11
  In of MODEL    8
    1    H    THR 758           H        THR 758  42.816 -25.318  -0.064
    2    HA   THR 758           HA       THR 758  42.286 -28.074  -0.719
    3    HB   THR 758           HB       THR 758  40.755 -27.828   1.339
    4    HG1  THR 758           HG1      THR 758  41.789 -26.012   2.672
    5   HG21  THR 758          HG21      THR 758  42.948 -28.985   1.324
    6   HG23  THR 758          HG22      THR 758  42.657 -28.141   2.840
    7   HG22  THR 758          HG23      THR 758  43.742 -27.441   1.637

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLY 759           H        GLY 759  39.972 -25.767   0.378
    2    HA3  GLY 759           HA2      GLY 759  38.673 -25.187  -1.982
    3    HA2  GLY 759           HA3      GLY 759  37.976 -26.702  -1.387

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ARG 760           H        ARG 760  36.462 -24.455  -1.680
    2    HA   ARG 760           HA       ARG 760  36.385 -22.899   0.706
    3    HB2  ARG 760           HB2      ARG 760  34.353 -21.884  -0.187
    4    HB3  ARG 760           HB3      ARG 760  35.576 -21.994  -1.437
    5    HG2  ARG 760           HG2      ARG 760  33.632 -22.576  -2.559
    6    HG3  ARG 760           HG3      ARG 760  34.323 -24.144  -2.141
    7    HD2  ARG 760           HD2      ARG 760  32.828 -24.229  -0.160
    8    HD3  ARG 760           HD3      ARG 760  32.092 -22.717  -0.675
    9    HE   ARG 760           HE       ARG 760  31.946 -24.500  -2.794
   10   HH11  ARG 760          HH11      ARG 760  30.610 -24.226   0.494
   11   HH12  ARG 760          HH12      ARG 760  29.187 -25.078   0.138
   12   HH21  ARG 760          HH21      ARG 760  30.014 -25.688  -3.277
   13   HH22  ARG 760          HH22      ARG 760  28.824 -25.946  -2.096

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ASP 761           H        ASP 761  35.104 -25.915  -0.210
    2    HA   ASP 761           HA       ASP 761  32.904 -26.058   1.569
    3    HB2  ASP 761           HB2      ASP 761  33.103 -27.540  -0.361
    4    HB3  ASP 761           HB3      ASP 761  34.556 -28.259   0.316

  No H/Q in entry =           4
  In of MODEL    8
    1    H    SER 762           H        SER 762  36.299 -26.471   1.962
    2    HA   SER 762           HA       SER 762  36.226 -28.085   4.286
    3    HB2  SER 762           HB2      SER 762  38.426 -26.308   3.247
    4    HB3  SER 762           HB3      SER 762  38.602 -27.700   4.317
    5    HG   SER 762           HG       SER 762  37.924 -29.024   2.652

  No H/Q in entry =           5
  In of MODEL    8
    1    H    CYS 763           H        CYS 763  35.683 -24.741   3.750
    2    HA   CYS 763           HA       CYS 763  35.703 -24.213   6.646
    3    HB2  CYS 763           HB2      CYS 763  36.924 -22.110   6.262
    4    HB3  CYS 763           HB3      CYS 763  37.877 -23.493   5.737

  No H/Q in entry =           4
  In of MODEL    8
    1    H    THR 764           H        THR 764  35.105 -21.585   6.591
    2    HA   THR 764           HA       THR 764  32.726 -21.322   4.928
    3    HB   THR 764           HB       THR 764  33.430 -19.954   7.542
    4    HG1  THR 764           HG1      THR 764  32.027 -22.284   6.898
    5   HG21  THR 764          HG21      THR 764  30.827 -20.105   5.999
    6   HG23  THR 764          HG22      THR 764  31.875 -18.690   6.112
    7   HG22  THR 764          HG23      THR 764  31.056 -19.299   7.554

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LEU 765           H        LEU 765  33.241 -20.154   3.255
    2    HA   LEU 765           HA       LEU 765  35.477 -18.346   3.311
    3    HB2  LEU 765           HB2      LEU 765  34.544 -19.960   1.396
    4    HB3  LEU 765           HB3      LEU 765  33.552 -18.543   1.075
    5    HG   LEU 765           HG       LEU 765  35.572 -17.202   0.715
    6   HD12  LEU 765          HD11      LEU 765  37.736 -18.363   0.519
    7   HD11  LEU 765          HD12      LEU 765  36.960 -19.835   1.129
    8   HD13  LEU 765          HD13      LEU 765  37.086 -18.421   2.158
    9   HD21  LEU 765          HD21      LEU 765  35.451 -19.729  -0.933
   10   HD23  LEU 765          HD22      LEU 765  36.218 -18.217  -1.416
   11   HD22  LEU 765          HD23      LEU 765  34.472 -18.283  -1.185

  No H/Q in entry =          11
  In of MODEL    8
    1    HA   PRO 766           HA       PRO 766  33.070 -14.796   4.451
    2    HB2  PRO 766           HB2      PRO 766  34.429 -12.877   2.962
    3    HB3  PRO 766           HB3      PRO 766  34.873 -13.429   4.579
    4    HG2  PRO 766           HG2      PRO 766  35.985 -14.211   1.931
    5    HG3  PRO 766           HG3      PRO 766  36.798 -14.042   3.499
    6    HD2  PRO 766           HD2      PRO 766  36.184 -16.435   2.431
    7    HD3  PRO 766           HD3      PRO 766  36.184 -16.181   4.174

  No H/Q in entry =           7
  In of MODEL    8
    1    H    ALA 767           H        ALA 767  33.784 -15.204   1.011
    2    HA   ALA 767           HA       ALA 767  31.036 -14.546   0.414
    3    HB1  ALA 767           HB1      ALA 767  32.145 -12.373   0.320
    4    HB3  ALA 767           HB2      ALA 767  31.598 -12.882  -1.279
    5    HB2  ALA 767           HB3      ALA 767  33.305 -13.010  -0.846

  No H/Q in entry =           5
  In of MODEL    8
    1    H    SER 768           H        SER 768  30.378 -16.088  -0.836
    2    HA   SER 768           HA       SER 768  32.035 -16.814  -3.131
    3    HB2  SER 768           HB2      SER 768  32.282 -18.665  -1.510
    4    HB3  SER 768           HB3      SER 768  30.536 -18.812  -1.390
    5    HG   SER 768           HG       SER 768  30.648 -20.111  -2.985

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA 769           H        ALA 769  28.841 -17.999  -2.077
    2    HA   ALA 769           HA       ALA 769  27.680 -17.237  -4.637
    3    HB2  ALA 769           HB1      ALA 769  27.199 -19.431  -3.637
    4    HB1  ALA 769           HB2      ALA 769  25.726 -18.443  -3.773
    5    HB3  ALA 769           HB3      ALA 769  26.560 -18.587  -2.221

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLU 770           H        GLU 770  28.470 -15.505  -2.329
    2    HA   GLU 770           HA       GLU 770  25.945 -14.247  -1.552
    3    HB2  GLU 770           HB2      GLU 770  28.724 -14.119  -0.507
    4    HB3  GLU 770           HB3      GLU 770  27.320 -13.313   0.239
    5    HG2  GLU 770           HG2      GLU 770  26.333 -15.427   0.695
    6    HG3  GLU 770           HG3      GLU 770  27.578 -16.243  -0.250

  No H/Q in entry =           6
  In of MODEL    8
    1    H    LYS 771           H        LYS 771  25.474 -12.343  -2.416
    2    HA   LYS 771           HA       LYS 771  27.623 -10.778  -3.604
    3    HB2  LYS 771           HB2      LYS 771  24.773 -10.681  -4.590
    4    HB3  LYS 771           HB3      LYS 771  26.224 -10.164  -5.415
    5    HG2  LYS 771           HG2      LYS 771  25.461 -13.018  -4.863
    6    HG3  LYS 771           HG3      LYS 771  25.297 -12.185  -6.404
    7    HD2  LYS 771           HD2      LYS 771  27.583 -12.167  -6.777
    8    HD3  LYS 771           HD3      LYS 771  27.963 -12.330  -5.055
    9    HE2  LYS 771           HE2      LYS 771  27.179 -14.502  -5.004
   10    HE3  LYS 771           HE3      LYS 771  26.617 -14.468  -6.689
   11    HZ2  LYS 771           HZ1      LYS 771  29.418 -14.449  -5.661
   12    HZ1  LYS 771           HZ2      LYS 771  29.016 -14.095  -7.268
   13    HZ3  LYS 771           HZ3      LYS 771  28.685 -15.608  -6.635

  No H/Q in entry =          13
  In of MODEL    8
    1    H    ALA 772           H        ALA 772  27.447  -8.537  -2.884
    2    HA   ALA 772           HA       ALA 772  25.016  -7.843  -1.429
    3    HB2  ALA 772           HB1      ALA 772  26.627  -8.632   0.239
    4    HB3  ALA 772           HB2      ALA 772  26.321  -6.901   0.408
    5    HB1  ALA 772           HB3      ALA 772  27.808  -7.462  -0.354

  No H/Q in entry =           5
  In of MODEL    8
    1    H    CYS 773           H        CYS 773  24.313  -5.886  -1.934
    2    HA   CYS 773           HA       CYS 773  25.664  -4.289  -3.862
    3    HB2  CYS 773           HB2      CYS 773  23.209  -4.347  -3.724
    4    HB3  CYS 773           HB3      CYS 773  23.273  -3.671  -2.104

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLY 774           H        GLY 774  27.470  -3.364  -3.346
    2    HA3  GLY 774           HA2      GLY 774  28.293  -1.312  -2.267
    3    HA2  GLY 774           HA3      GLY 774  27.627  -1.964  -0.772

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ALA 775           H        ALA 775  28.562  -4.735  -1.886
    2    HA   ALA 775           HA       ALA 775  31.417  -4.398  -1.701
    3    HB2  ALA 775           HB1      ALA 775  29.950  -6.099   0.307
    4    HB1  ALA 775           HB2      ALA 775  30.726  -4.555   0.655
    5    HB3  ALA 775           HB3      ALA 775  31.700  -5.940   0.163

  No H/Q in entry =           5
  In of MODEL    8
    1    H    CYS 776           H        CYS 776  31.697  -5.213  -3.594
    2    HA   CYS 776           HA       CYS 776  32.344  -7.842  -3.987
    3    HB2  CYS 776           HB2      CYS 776  30.617  -8.650  -5.581
    4    HB3  CYS 776           HB3      CYS 776  29.863  -8.311  -4.032

  No H/Q in entry =           4
  In of MODEL    8
    1    HA   PRO 777           HA       PRO 777  32.597  -4.220  -7.254
    2    HB2  PRO 777           HB2      PRO 777  34.476  -2.536  -6.512
    3    HB3  PRO 777           HB3      PRO 777  32.936  -2.566  -5.640
    4    HG2  PRO 777           HG2      PRO 777  35.576  -3.747  -4.866
    5    HG3  PRO 777           HG3      PRO 777  34.406  -2.873  -3.863
    6    HD2  PRO 777           HD2      PRO 777  34.649  -5.641  -4.048
    7    HD3  PRO 777           HD3      PRO 777  33.248  -4.769  -3.404

  No H/Q in entry =           7
  In of MODEL    8
    1    H    LEU 778           H        LEU 778  34.115  -6.715  -6.970
    2    HA   LEU 778           HA       LEU 778  36.678  -6.147  -8.261
    3    HB2  LEU 778           HB2      LEU 778  35.972  -7.935  -6.365
    4    HB3  LEU 778           HB3      LEU 778  35.700  -8.911  -7.788
    5    HG   LEU 778           HG       LEU 778  37.816  -9.479  -7.019
    6   HD12  LEU 778          HD11      LEU 778  39.402  -8.777  -8.714
    7   HD11  LEU 778          HD12      LEU 778  38.259  -7.540  -9.258
    8   HD13  LEU 778          HD13      LEU 778  37.835  -9.253  -9.367
    9   HD22  LEU 778          HD21      LEU 778  38.201  -7.784  -5.461
   10   HD21  LEU 778          HD22      LEU 778  38.342  -6.558  -6.713
   11   HD23  LEU 778          HD23      LEU 778  39.584  -7.815  -6.559

  No H/Q in entry =          11
  In of MODEL    8
    1    H    TRP 779           H        TRP 779  33.917  -8.315  -8.660
    2    HA   TRP 779           HA       TRP 779  34.049  -8.119 -11.595
    3    HB2  TRP 779           HB2      TRP 779  33.030 -10.509 -11.449
    4    HB3  TRP 779           HB3      TRP 779  34.758 -10.327 -11.166
    5    HD1  TRP 779           HD1      TRP 779  31.467 -10.889  -9.158
    6    HE1  TRP 779           HE1      TRP 779  32.114 -11.925  -6.892
    7    HE3  TRP 779           HE3      TRP 779  36.545 -10.799  -9.610
    8    HZ2  TRP 779           HZ2      TRP 779  34.505 -12.610  -5.487
    9    HZ3  TRP 779           HZ3      TRP 779  37.915 -11.663  -7.779
   10    HH2  TRP 779           HH2      TRP 779  36.892 -12.550  -5.767

  No H/Q in entry =          10
  In of MODEL    8
    1    H    GLY 780           H        GLY 780  32.386  -7.000  -9.106
    2    HA3  GLY 780           HA2      GLY 780  29.892  -7.336 -10.440
    3    HA2  GLY 780           HA3      GLY 780  29.974  -7.766  -8.717

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LYS 781           H        LYS 781  28.299  -5.922  -9.709
    2    HA   LYS 781           HA       LYS 781  29.219  -3.453  -8.480
    3    HB2  LYS 781           HB2      LYS 781  28.194  -3.701 -11.288
    4    HB3  LYS 781           HB3      LYS 781  28.249  -2.194 -10.372
    5    HG2  LYS 781           HG2      LYS 781  30.721  -2.441 -10.254
    6    HG3  LYS 781           HG3      LYS 781  30.591  -3.890 -11.251
    7    HD2  LYS 781           HD2      LYS 781  31.187  -1.999 -12.634
    8    HD3  LYS 781           HD3      LYS 781  29.550  -2.531 -13.026
    9    HE2  LYS 781           HE2      LYS 781  29.563  -0.101 -12.913
   10    HE3  LYS 781           HE3      LYS 781  28.678  -0.775 -11.540
   11    HZ2  LYS 781           HZ1      LYS 781  30.279   1.085 -10.989
   12    HZ1  LYS 781           HZ2      LYS 781  31.521  -0.030 -11.300
   13    HZ3  LYS 781           HZ3      LYS 781  30.435  -0.324 -10.089

  No H/Q in entry =          13
  In of MODEL    8
    1    H    CYS 782           H        CYS 782  27.412  -2.212  -7.843
    2    HA   CYS 782           HA       CYS 782  24.933  -3.737  -7.990
    3    HB2  CYS 782           HB2      CYS 782  25.733  -3.011  -5.717
    4    HB3  CYS 782           HB3      CYS 782  25.594  -1.341  -6.241

  No H/Q in entry =           4
  In of MODEL    8
    1    H    ASP 783           H        ASP 783  24.658  -3.229 -10.178
    2    HA   ASP 783           HA       ASP 783  24.014  -0.420 -10.691
    3    HB2  ASP 783           HB2      ASP 783  24.356  -0.762 -13.014
    4    HB3  ASP 783           HB3      ASP 783  25.688  -1.594 -12.234

  No H/Q in entry =           4
  In of MODEL    8
    1    H    ALA 784           H        ALA 784  22.796  -3.617 -10.643
    2    HA   ALA 784           HA       ALA 784  20.099  -2.587 -11.038
    3    HB1  ALA 784           HB1      ALA 784  20.648  -4.590 -12.369
    4    HB2  ALA 784           HB2      ALA 784  19.450  -4.983 -11.135
    5    HB3  ALA 784           HB3      ALA 784  21.138  -5.435 -10.900

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLU 785           H        GLU 785  19.853  -1.593  -9.161
    2    HA   GLU 785           HA       GLU 785  20.972  -2.338  -6.732
    3    HB2  GLU 785           HB2      GLU 785  18.703  -0.467  -7.306
    4    HB3  GLU 785           HB3      GLU 785  19.475  -0.650  -5.735
    5    HG2  GLU 785           HG2      GLU 785  21.604   0.027  -6.700
    6    HG3  GLU 785           HG3      GLU 785  20.827   0.224  -8.269

  No H/Q in entry =           6
  In of MODEL    8
    1    H    SER 786           H        SER 786  20.465  -3.523  -5.193
    2    HA   SER 786           HA       SER 786  17.875  -4.255  -4.368
    3    HB2  SER 786           HB2      SER 786  19.767  -6.404  -5.448
    4    HB3  SER 786           HB3      SER 786  18.241  -6.702  -4.620
    5    HG   SER 786           HG       SER 786  17.944  -5.026  -6.700

  No H/Q in entry =           5
  In of MODEL    8
    1    H    SER 787           H        SER 787  18.622  -6.145  -2.509
    2    HA   SER 787           HA       SER 787  20.674  -4.857  -0.998
    3    HB2  SER 787           HB2      SER 787  19.338  -7.544  -0.551
    4    HB3  SER 787           HB3      SER 787  20.276  -6.641   0.639
    5    HG   SER 787           HG       SER 787  18.662  -4.891   0.100

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LYS 788           H        LYS 788  20.433  -7.586  -3.131
    2    HA   LYS 788           HA       LYS 788  23.158  -8.451  -2.709
    3    HB2  LYS 788           HB2      LYS 788  22.733 -10.081  -4.420
    4    HB3  LYS 788           HB3      LYS 788  21.283 -10.007  -3.438
    5    HG2  LYS 788           HG2      LYS 788  20.133  -8.711  -5.120
    6    HG3  LYS 788           HG3      LYS 788  21.613  -8.554  -6.064
    7    HD2  LYS 788           HD2      LYS 788  21.638 -11.051  -6.268
    8    HD3  LYS 788           HD3      LYS 788  20.046 -11.069  -5.514
    9    HE2  LYS 788           HE2      LYS 788  20.769  -9.667  -8.094
   10    HE3  LYS 788           HE3      LYS 788  19.939 -11.209  -7.971
   11    HZ1  LYS 788           HZ1      LYS 788  18.869  -8.627  -6.935
   12    HZ3  LYS 788           HZ2      LYS 788  18.059 -10.114  -6.951
   13    HZ2  LYS 788           HZ3      LYS 788  18.462  -9.348  -8.386

  No H/Q in entry =          13
  In of MODEL    8
    1    H    CYS 789           H        CYS 789  24.555  -8.566  -4.795
    2    HA   CYS 789           HA       CYS 789  24.062  -6.223  -6.460
    3    HB2  CYS 789           HB2      CYS 789  26.483  -5.942  -6.725
    4    HB3  CYS 789           HB3      CYS 789  26.051  -5.861  -5.027

  No H/Q in entry =           4
  In of MODEL    8
    1    H    VAL 790           H        VAL 790  25.380  -6.617  -8.640
    2    HA   VAL 790           HA       VAL 790  24.967  -9.412  -9.308
    3    HB   VAL 790           HB       VAL 790  24.224  -8.648 -11.597
    4   HG11  VAL 790          HG11      VAL 790  22.485  -7.829  -9.281
    5   HG13  VAL 790          HG12      VAL 790  22.611  -9.449  -9.970
    6   HG12  VAL 790          HG13      VAL 790  21.930  -8.130 -10.926
    7   HG23  VAL 790          HG21      VAL 790  23.325  -6.361 -11.795
    8   HG22  VAL 790          HG22      VAL 790  25.073  -6.373 -11.545
    9   HG21  VAL 790          HG23      VAL 790  23.994  -5.976 -10.207

  No H/Q in entry =           9
  In of MODEL    8
    1    H    CYS 791           H        CYS 791  26.305 -10.179 -10.949
    2    HA   CYS 791           HA       CYS 791  28.742  -8.656 -10.948
    3    HB2  CYS 791           HB2      CYS 791  28.272 -11.542 -11.608
    4    HB3  CYS 791           HB3      CYS 791  29.847 -10.740 -11.578

  No H/Q in entry =           4
  In of MODEL    8
    1    H    ARG 792           H        ARG 792  29.642  -7.894 -12.684
    2    HA   ARG 792           HA       ARG 792  28.011  -7.804 -15.044
    3    HB2  ARG 792           HB2      ARG 792  30.364  -6.248 -14.059
    4    HB3  ARG 792           HB3      ARG 792  30.002  -6.223 -15.786
    5    HG2  ARG 792           HG2      ARG 792  28.024  -5.478 -13.620
    6    HG3  ARG 792           HG3      ARG 792  29.014  -4.314 -14.507
    7    HD2  ARG 792           HD2      ARG 792  28.030  -5.030 -16.609
    8    HD3  ARG 792           HD3      ARG 792  27.079  -6.254 -15.791
    9    HE   ARG 792           HE       ARG 792  26.005  -4.248 -14.627
   10   HH11  ARG 792          HH11      ARG 792  27.358  -4.009 -17.924
   11   HH12  ARG 792          HH12      ARG 792  26.145  -2.975 -18.493
   12   HH21  ARG 792          HH21      ARG 792  24.304  -2.867 -15.471
   13   HH22  ARG 792          HH22      ARG 792  24.354  -2.328 -17.085

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLU 793           H        GLU 793  29.522  -7.724 -17.176
    2    HA   GLU 793           HA       GLU 793  30.130 -10.450 -17.471
    3    HB2  GLU 793           HB2      GLU 793  30.750  -8.196 -19.377
    4    HB3  GLU 793           HB3      GLU 793  30.754  -9.913 -19.752
    5    HG2  GLU 793           HG2      GLU 793  28.396  -8.306 -18.873
    6    HG3  GLU 793           HG3      GLU 793  28.709  -8.884 -20.520

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ALA 794           H        ALA 794  32.125 -11.289 -18.351
    2    HA   ALA 794           HA       ALA 794  34.024 -11.010 -16.312
    3    HB2  ALA 794           HB1      ALA 794  33.440 -13.105 -17.499
    4    HB3  ALA 794           HB2      ALA 794  35.153 -12.789 -17.370
    5    HB1  ALA 794           HB3      ALA 794  34.322 -12.506 -18.907

  No H/Q in entry =           5
  In of MODEL    8
    1    H    SER 795           H        SER 795  33.846  -9.849 -19.591
    2    HA   SER 795           HA       SER 795  36.441  -8.625 -19.207
    3    HB2  SER 795           HB2      SER 795  34.848  -8.988 -21.750
    4    HB3  SER 795           HB3      SER 795  36.506  -8.373 -21.647
    5    HG   SER 795           HG       SER 795  36.132 -10.698 -20.303

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLU 796           H        GLU 796  33.717  -7.792 -18.183
    2    HA   GLU 796           HA       GLU 796  33.746  -4.982 -19.081
    3    HB2  GLU 796           HB2      GLU 796  31.704  -6.274 -19.835
    4    HB3  GLU 796           HB3      GLU 796  31.367  -6.634 -18.150
    5    HG2  GLU 796           HG2      GLU 796  29.914  -4.864 -18.898
    6    HG3  GLU 796           HG3      GLU 796  31.060  -4.218 -17.729

  No H/Q in entry =           6
  In of MODEL    8
    1    H    CYS 797           H        CYS 797  35.274  -6.295 -17.048
    2    HA   CYS 797           HA       CYS 797  33.955  -5.610 -14.546
    3    HB2  CYS 797           HB2      CYS 797  35.633  -6.830 -13.469
    4    HB3  CYS 797           HB3      CYS 797  35.269  -7.772 -14.915

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLU 798           H        GLU 798  35.156  -4.247 -12.991
    2    HA   GLU 798           HA       GLU 798  36.618  -2.181 -14.442
    3    HB2  GLU 798           HB2      GLU 798  36.026  -0.713 -12.536
    4    HB3  GLU 798           HB3      GLU 798  34.652  -1.322 -13.439
    5    HG2  GLU 798           HG2      GLU 798  34.182  -2.949 -11.717
    6    HG3  GLU 798           HG3      GLU 798  35.633  -2.468 -10.835

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU 799           H        GLU 799  37.016  -4.542 -11.969
    2    HA   GLU 799           HA       GLU 799  39.351  -3.141 -10.923
    3    HB2  GLU 799           HB2      GLU 799  37.578  -3.846  -9.337
    4    HB3  GLU 799           HB3      GLU 799  37.841  -5.508  -9.831
    5    HG2  GLU 799           HG2      GLU 799  38.889  -4.960  -7.687
    6    HG3  GLU 799           HG3      GLU 799  40.069  -5.479  -8.896

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLU 800           H        GLU 800  41.311  -4.325 -10.615
    2    HA   GLU 800           HA       GLU 800  41.650  -6.605 -12.391
    3    HB2  GLU 800           HB2      GLU 800  43.517  -4.235 -12.202
    4    HB3  GLU 800           HB3      GLU 800  43.804  -5.693 -13.132
    5    HG2  GLU 800           HG2      GLU 800  41.803  -5.158 -14.494
    6    HG3  GLU 800           HG3      GLU 800  41.655  -3.644 -13.605

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLY 801           H        GLY 801  41.621  -7.846 -10.620
    2    HA3  GLY 801           HA2      GLY 801  43.502  -7.582  -8.445
    3    HA2  GLY 801           HA3      GLY 801  42.477  -8.974  -8.747

  No H/Q in entry =           3
  In of MODEL    8
    1    H    PHE 802           H        PHE 802  43.699 -10.745  -8.941
    2    HA   PHE 802           HA       PHE 802  46.342 -10.570 -10.123
    3    HB2  PHE 802           HB2      PHE 802  44.915 -12.593  -8.425
    4    HB3  PHE 802           HB3      PHE 802  46.349 -13.043  -9.333
    5    HD1  PHE 802           HD1      PHE 802  47.720 -13.547  -7.480
    6    HD2  PHE 802           HD2      PHE 802  45.853  -9.738  -7.767
    7    HE1  PHE 802           HE1      PHE 802  49.182 -12.703  -5.706
    8    HE2  PHE 802           HE2      PHE 802  47.300  -8.881  -6.013
    9    HZ   PHE 802           HZ       PHE 802  48.981 -10.366  -4.957

  No H/Q in entry =           9
  In of MODEL    8
    1    H    SER 803           H        SER 803  46.894 -12.752 -11.209
    2    HA   SER 803           HA       SER 803  44.865 -13.393 -13.213
    3    HB2  SER 803           HB2      SER 803  46.884 -14.068 -14.592
    4    HB3  SER 803           HB3      SER 803  46.787 -12.336 -14.243
    5    HG   SER 803           HG       SER 803  48.230 -14.210 -12.721

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ILE 804           H        ILE 804  44.096 -15.397 -12.995
    2    HA   ILE 804           HA       ILE 804  45.654 -17.336 -11.441
    3    HB   ILE 804           HB       ILE 804  43.687 -18.192 -10.333
    4   HG12  ILE 804          HG12      ILE 804  41.947 -17.851 -12.091
    5   HG13  ILE 804          HG13      ILE 804  41.433 -17.252 -10.522
    6   HG22  ILE 804          HG21      ILE 804  43.737 -15.197 -10.113
    7   HG21  ILE 804          HG22      ILE 804  44.751 -16.333  -9.225
    8   HG23  ILE 804          HG23      ILE 804  43.006 -16.283  -8.938
    9   HD12  ILE 804          HD11      ILE 804  42.322 -15.610 -12.877
   10   HD11  ILE 804          HD12      ILE 804  41.968 -14.965 -11.274
   11   HD13  ILE 804          HD13      ILE 804  40.700 -15.755 -12.207

  No H/Q in entry =          11
  In of MODEL    8
    1    H    CYS 805           H        CYS 805  44.461 -19.640 -11.713
    2    HA   CYS 805           HA       CYS 805  44.268 -20.066 -14.621
    3    HB2  CYS 805           HB2      CYS 805  46.354 -20.918 -13.630
    4    HB3  CYS 805           HB3      CYS 805  45.409 -21.839 -12.467

  No H/Q in entry =           4
  In of MODEL    8
    1    H    VAL 806           H        VAL 806  42.315 -20.822 -15.217
    2    HA   VAL 806           HA       VAL 806  40.738 -22.288 -13.223
    3    HB   VAL 806           HB       VAL 806  39.604 -20.369 -15.226
    4   HG11  VAL 806          HG11      VAL 806  38.406 -21.615 -12.778
    5   HG13  VAL 806          HG12      VAL 806  38.051 -21.996 -14.452
    6   HG12  VAL 806          HG13      VAL 806  37.624 -20.406 -13.800
    7   HG23  VAL 806          HG21      VAL 806  39.267 -18.745 -13.407
    8   HG22  VAL 806          HG22      VAL 806  40.957 -19.016 -13.806
    9   HG21  VAL 806          HG23      VAL 806  40.266 -19.753 -12.352

  No H/Q in entry =           9
  In of MODEL    8
    1    H    GLU 807           H        GLU 807  40.083 -24.188 -13.974
    2    HA   GLU 807           HA       GLU 807  40.438 -24.921 -16.751
    3    HB2  GLU 807           HB2      GLU 807  41.027 -26.466 -14.848
    4    HB3  GLU 807           HB3      GLU 807  39.319 -26.555 -14.487
    5    HG2  GLU 807           HG2      GLU 807  38.876 -27.484 -16.691
    6    HG3  GLU 807           HG3      GLU 807  40.599 -27.352 -17.053

  No H/Q in entry =           6
  In of MODEL    8
    1    H    VAL 808           H        VAL 808  39.062 -24.284 -18.059
    2    HA   VAL 808           HA       VAL 808  36.206 -24.673 -17.562
    3    HB   VAL 808           HB       VAL 808  37.391 -22.277 -18.890
    4   HG13  VAL 808          HG11      VAL 808  35.195 -21.290 -18.773
    5   HG12  VAL 808          HG12      VAL 808  34.571 -22.813 -18.103
    6   HG11  VAL 808          HG13      VAL 808  35.285 -22.773 -19.732
    7   HG23  VAL 808          HG21      VAL 808  36.597 -20.970 -16.919
    8   HG22  VAL 808          HG22      VAL 808  38.019 -21.978 -16.724
    9   HG21  VAL 808          HG23      VAL 808  36.468 -22.528 -16.082

  No H/Q in entry =           9
  In of MODEL    8
    1    H    ASN 809           H        ASN 809  35.221 -25.373 -19.494
    2    HA   ASN 809           HA       ASN 809  35.028 -26.207 -21.602
    3    HB2  ASN 809           HB2      ASN 809  37.258 -24.249 -22.105
    4    HB3  ASN 809           HB3      ASN 809  36.699 -25.303 -23.373
    5   HD21  ASN 809          HD21      ASN 809  36.145 -22.476 -21.531
    6   HD22  ASN 809          HD22      ASN 809  34.744 -21.915 -22.351

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLY 810           H        GLY 810  36.955 -27.254 -19.518
    2    HA3  GLY 810           HA2      GLY 810  37.972 -29.381 -19.519
    3    HA2  GLY 810           HA3      GLY 810  38.082 -29.251 -21.279

  No H/Q in entry =           3
  In of MODEL    8
    1    H    LYS 811           H        LYS 811  39.214 -26.414 -20.531
    2    HA   LYS 811           HA       LYS 811  41.955 -27.415 -20.133
    3    HB2  LYS 811           HB2      LYS 811  42.698 -25.624 -21.665
    4    HB3  LYS 811           HB3      LYS 811  41.683 -26.830 -22.443
    5    HG2  LYS 811           HG2      LYS 811  39.756 -25.289 -22.218
    6    HG3  LYS 811           HG3      LYS 811  40.849 -24.072 -21.564
    7    HD2  LYS 811           HD2      LYS 811  41.071 -25.362 -24.263
    8    HD3  LYS 811           HD3      LYS 811  40.386 -23.765 -23.965
    9    HE2  LYS 811           HE2      LYS 811  42.585 -23.043 -23.035
   10    HE3  LYS 811           HE3      LYS 811  43.232 -24.630 -23.434
   11    HZ2  LYS 811           HZ1      LYS 811  43.785 -23.004 -25.149
   12    HZ1  LYS 811           HZ2      LYS 811  42.142 -22.710 -25.417
   13    HZ3  LYS 811           HZ3      LYS 811  42.782 -24.213 -25.748

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLU 812           H        GLU 812  43.401 -26.053 -19.045
    2    HA   GLU 812           HA       GLU 812  42.117 -24.258 -17.159
    3    HB2  GLU 812           HB2      GLU 812  44.954 -25.271 -17.329
    4    HB3  GLU 812           HB3      GLU 812  44.339 -24.223 -16.060
    5    HG2  GLU 812           HG2      GLU 812  42.791 -25.934 -15.375
    6    HG3  GLU 812           HG3      GLU 812  43.368 -27.010 -16.652

  No H/Q in entry =           6
  In of MODEL    8
    1    H    GLN 813           H        GLN 813  41.636 -22.402 -18.081
    2    HA   GLN 813           HA       GLN 813  43.664 -21.080 -19.684
    3    HB2  GLN 813           HB2      GLN 813  41.470 -21.147 -20.661
    4    HB3  GLN 813           HB3      GLN 813  40.734 -20.458 -19.214
    5    HG2  GLN 813           HG2      GLN 813  41.916 -18.382 -19.610
    6    HG3  GLN 813           HG3      GLN 813  42.709 -19.061 -21.026
    7   HE21  GLN 813          HE21      GLN 813  39.349 -19.696 -20.285
    8   HE22  GLN 813          HE22      GLN 813  38.700 -18.743 -21.559

  No H/Q in entry =           8
  In of MODEL    8
    1    H    THR 814           H        THR 814  44.593 -19.185 -19.083
    2    HA   THR 814           HA       THR 814  44.537 -18.530 -16.280
    3    HB   THR 814           HB       THR 814  45.971 -17.248 -18.591
    4    HG1  THR 814           HG1      THR 814  47.764 -18.504 -17.713
    5   HG22  THR 814          HG21      THR 814  46.492 -17.063 -15.613
    6   HG21  THR 814          HG22      THR 814  45.815 -15.790 -16.623
    7   HG23  THR 814          HG23      THR 814  47.483 -16.319 -16.874

  No H/Q in entry =           7
  In of MODEL    8
    1    H    MET 815           H        MET 815  43.211 -17.057 -15.492
    2    HA   MET 815           HA       MET 815  41.983 -15.197 -17.401
    3    HB2  MET 815           HB2      MET 815  40.686 -16.270 -14.905
    4    HB3  MET 815           HB3      MET 815  39.953 -15.240 -16.125
    5    HG2  MET 815           HG2      MET 815  40.500 -17.253 -17.719
    6    HG3  MET 815           HG3      MET 815  40.651 -18.078 -16.176
    7    HE1  MET 815           HE1      MET 815  38.654 -18.636 -18.609
    8    HE3  MET 815           HE2      MET 815  37.246 -19.193 -17.707
    9    HE2  MET 815           HE3      MET 815  38.873 -19.719 -17.236

  No H/Q in entry =           9
  In of MODEL    8
    1    H    SER 816           H        SER 816  41.295 -13.243 -16.470
    2    HA   SER 816           HA       SER 816  43.067 -12.294 -14.397
    3    HB2  SER 816           HB2      SER 816  40.793 -10.907 -15.859
    4    HB3  SER 816           HB3      SER 816  41.996 -10.120 -14.833
    5    HG   SER 816           HG       SER 816  42.228 -11.163 -17.400

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLU 817           H        GLU 817  42.299 -11.572 -12.371
    2    HA   GLU 817           HA       GLU 817  40.780 -13.128 -10.819
    3    HB2  GLU 817           HB2      GLU 817  42.133 -10.962 -10.349
    4    HB3  GLU 817           HB3      GLU 817  40.556 -10.190 -10.446
    5    HG2  GLU 817           HG2      GLU 817  40.627 -10.642  -8.201
    6    HG3  GLU 817           HG3      GLU 817  39.925 -12.148  -8.827

  No H/Q in entry =           6
  In of MODEL    8
    1    H    CYS 818           H        CYS 818  39.584 -10.242 -12.481
    2    HA   CYS 818           HA       CYS 818  36.967 -10.405 -11.403
    3    HB2  CYS 818           HB2      CYS 818  36.466  -8.543 -12.776
    4    HB3  CYS 818           HB3      CYS 818  38.090  -8.312 -12.131

  No H/Q in entry =           4
  In of MODEL    8
    1    H    GLU 819           H        GLU 819  38.503 -11.656 -14.248
    2    HA   GLU 819           HA       GLU 819  36.175 -12.080 -15.795
    3    HB2  GLU 819           HB2      GLU 819  38.397 -11.917 -16.810
    4    HB3  GLU 819           HB3      GLU 819  38.917 -13.316 -15.881
    5    HG2  GLU 819           HG2      GLU 819  37.605 -14.770 -17.202
    6    HG3  GLU 819           HG3      GLU 819  36.804 -13.421 -18.006

  No H/Q in entry =           6
  In of MODEL    8
    1    H    ALA 820           H        ALA 820  38.328 -14.238 -14.017
    2    HA   ALA 820           HA       ALA 820  36.827 -16.532 -14.186
    3    HB3  ALA 820           HB1      ALA 820  38.635 -15.642 -11.957
    4    HB1  ALA 820           HB2      ALA 820  39.109 -16.519 -13.416
    5    HB2  ALA 820           HB3      ALA 820  38.074 -17.292 -12.211

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLY 821           H        GLY 821  36.839 -13.914 -11.802
    2    HA3  GLY 821           HA2      GLY 821  35.071 -14.998  -9.910
    3    HA2  GLY 821           HA3      GLY 821  35.439 -13.292 -10.112

  No H/Q in entry =           3
  In of MODEL    8
    1    H    ALA 822           H        ALA 822  34.458 -12.847 -12.674
    2    HA   ALA 822           HA       ALA 822  31.704 -12.513 -12.189
    3    HB1  ALA 822           HB1      ALA 822  33.176 -12.417 -14.827
    4    HB2  ALA 822           HB2      ALA 822  32.978 -11.056 -13.727
    5    HB3  ALA 822           HB3      ALA 822  31.573 -11.748 -14.530

  No H/Q in entry =           5
  In of MODEL    8
    1    H    LEU 823           H        LEU 823  33.556 -14.860 -13.966
    2    HA   LEU 823           HA       LEU 823  31.387 -16.214 -15.098
    3    HB2  LEU 823           HB2      LEU 823  34.141 -17.233 -14.426
    4    HB3  LEU 823           HB3      LEU 823  32.986 -18.057 -15.463
    5    HG   LEU 823           HG       LEU 823  34.181 -15.342 -16.006
    6   HD12  LEU 823          HD11      LEU 823  35.369 -16.410 -17.827
    7   HD11  LEU 823          HD12      LEU 823  34.813 -17.996 -17.267
    8   HD13  LEU 823          HD13      LEU 823  35.861 -16.989 -16.251
    9   HD21  LEU 823          HD21      LEU 823  32.319 -17.048 -17.659
   10   HD23  LEU 823          HD22      LEU 823  33.186 -15.625 -18.238
   11   HD22  LEU 823          HD23      LEU 823  31.993 -15.458 -16.958

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ARG 824           H        ARG 824  33.123 -16.756 -12.009
    2    HA   ARG 824           HA       ARG 824  31.628 -18.975 -11.116
    3    HB2  ARG 824           HB2      ARG 824  32.879 -16.764  -9.484
    4    HB3  ARG 824           HB3      ARG 824  32.425 -18.352  -8.902
    5    HG2  ARG 824           HG2      ARG 824  34.179 -19.367 -10.247
    6    HG3  ARG 824           HG3      ARG 824  34.595 -17.781 -10.918
    7    HD2  ARG 824           HD2      ARG 824  36.109 -18.399  -9.150
    8    HD3  ARG 824           HD3      ARG 824  35.118 -17.028  -8.648
    9    HE   ARG 824           HE       ARG 824  34.169 -19.651  -7.983
   10   HH11  ARG 824          HH11      ARG 824  35.746 -16.695  -6.814
   11   HH12  ARG 824          HH12      ARG 824  35.589 -17.051  -5.164
   12   HH21  ARG 824          HH21      ARG 824  33.986 -20.163  -5.659
   13   HH22  ARG 824          HH22      ARG 824  34.574 -19.073  -4.499

  No H/Q in entry =          13
  In of MODEL    8
    1    H    CYS 825           H        CYS 825  30.830 -15.683 -11.446
    2    HA   CYS 825           HA       CYS 825  28.847 -15.759  -9.333
    3    HB2  CYS 825           HB2      CYS 825  30.448 -13.807  -9.730
    4    HB3  CYS 825           HB3      CYS 825  29.476 -13.479 -11.150

  No H/Q in entry =           4
  In of MODEL    8
    1    H    ARG 826           H        ARG 826  29.040 -15.602 -12.844
    2    HA   ARG 826           HA       ARG 826  26.242 -14.989 -13.181
    3    HB2  ARG 826           HB2      ARG 826  26.677 -15.203 -15.570
    4    HB3  ARG 826           HB3      ARG 826  27.848 -14.147 -14.781
    5    HG2  ARG 826           HG2      ARG 826  29.471 -15.938 -14.790
    6    HG3  ARG 826           HG3      ARG 826  28.298 -17.023 -15.528
    7    HD2  ARG 826           HD2      ARG 826  29.328 -14.474 -16.747
    8    HD3  ARG 826           HD3      ARG 826  29.869 -16.094 -17.160
    9    HE   ARG 826           HE       ARG 826  27.470 -16.506 -17.758
   10   HH11  ARG 826          HH11      ARG 826  28.818 -13.281 -17.911
   11   HH12  ARG 826          HH12      ARG 826  28.002 -12.780 -19.298
   12   HH21  ARG 826          HH21      ARG 826  26.271 -15.891 -19.711
   13   HH22  ARG 826          HH22      ARG 826  26.511 -14.345 -20.373

  No H/Q in entry =          13
  In of MODEL    8
    1    H    GLY 827           H        GLY 827  27.995 -17.883 -12.788
    2    HA3  GLY 827           HA2      GLY 827  26.714 -19.925 -12.478
    3    HA2  GLY 827           HA3      GLY 827  25.629 -19.347 -13.738

  No H/Q in entry =           3
  In of MODEL    8
    1    H    GLN 828           H        GLN 828  28.727 -18.646 -14.602
    2    HA   GLN 828           HA       GLN 828  28.843 -20.596 -16.679
    3    HB2  GLN 828           HB2      GLN 828  29.936 -18.389 -16.889
    4    HB3  GLN 828           HB3      GLN 828  30.981 -18.774 -15.541
    5    HG2  GLN 828           HG2      GLN 828  32.224 -19.001 -17.612
    6    HG3  GLN 828           HG3      GLN 828  32.006 -20.569 -16.867
    7   HE21  GLN 828          HE21      GLN 828  29.398 -19.030 -18.625
    8   HE22  GLN 828          HE22      GLN 828  29.445 -20.119 -19.950

  No H/Q in entry =           8
  In of MODEL    8
    1    H    SER 829           H        SER 829  29.996 -22.543 -16.690
    2    HA   SER 829           HA       SER 829  30.721 -23.440 -14.042
    3    HB2  SER 829           HB2      SER 829  30.445 -25.025 -16.605
    4    HB3  SER 829           HB3      SER 829  30.606 -25.669 -14.966
    5    HG   SER 829           HG       SER 829  28.619 -23.815 -15.362

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ILE 830           H        ILE 830  32.630 -23.105 -13.474
    2    HA   ILE 830           HA       ILE 830  34.947 -23.413 -15.270
    3    HB   ILE 830           HB       ILE 830  35.970 -21.425 -14.437
    4   HG12  ILE 830          HG12      ILE 830  35.131 -21.383 -12.067
    5   HG13  ILE 830          HG13      ILE 830  35.027 -19.826 -12.853
    6   HG23  ILE 830          HG21      ILE 830  34.594 -19.629 -15.283
    7   HG22  ILE 830          HG22      ILE 830  33.183 -20.684 -15.189
    8   HG21  ILE 830          HG23      ILE 830  34.503 -21.081 -16.293
    9   HD11  ILE 830          HD11      ILE 830  32.639 -20.151 -13.190
   10   HD13  ILE 830          HD12      ILE 830  33.091 -20.244 -11.491
   11   HD12  ILE 830          HD13      ILE 830  32.737 -21.713 -12.371

  No H/Q in entry =          11
  In of MODEL    8
    1    H    SER 831           H        SER 831  36.813 -23.985 -14.024
    2    HA   SER 831           HA       SER 831  36.221 -24.657 -11.261
    3    HB2  SER 831           HB2      SER 831  37.766 -26.178 -13.324
    4    HB3  SER 831           HB3      SER 831  37.674 -26.583 -11.611
    5    HG   SER 831           HG       SER 831  35.412 -26.330 -13.318

  No H/Q in entry =           5
  In of MODEL    8
    1    H    VAL 832           H        VAL 832  37.388 -23.083 -10.191
    2    HA   VAL 832           HA       VAL 832  39.879 -22.130 -11.240
    3    HB   VAL 832           HB       VAL 832  38.825 -21.834  -8.405
    4   HG13  VAL 832          HG11      VAL 832  40.390 -19.936  -8.254
    5   HG12  VAL 832          HG12      VAL 832  40.951 -20.290  -9.894
    6   HG11  VAL 832          HG13      VAL 832  41.229 -21.452  -8.606
    7   HG21  VAL 832          HG21      VAL 832  38.570 -19.953 -10.755
    8   HG23  VAL 832          HG22      VAL 832  38.075 -19.596  -9.103
    9   HG22  VAL 832          HG23      VAL 832  37.257 -20.871 -10.014

  No H/Q in entry =           9
  In of MODEL    8
    1    H    THR 833           H        THR 833  41.384 -23.613 -11.474
    2    HA   THR 833           HA       THR 833  41.609 -25.717  -9.542
    3    HB   THR 833           HB       THR 833  43.340 -26.513 -11.212
    4    HG1  THR 833           HG1      THR 833  43.524 -25.458 -13.050
    5   HG23  THR 833          HG21      THR 833  41.083 -27.441 -11.152
    6   HG22  THR 833          HG22      THR 833  41.559 -27.193 -12.843
    7   HG21  THR 833          HG23      THR 833  40.485 -26.053 -12.055

  No H/Q in entry =           7
  In of MODEL    8
    1    H    SER 834           H        SER 834  43.327 -22.859 -10.524
    2    HA   SER 834           HA       SER 834  44.984 -23.196  -8.194
    3    HB2  SER 834           HB2      SER 834  46.153 -22.915 -10.960
    4    HB3  SER 834           HB3      SER 834  47.067 -22.655  -9.478
    5    HG   SER 834           HG       SER 834  45.626 -25.009  -9.665

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ILE 835           H        ILE 835  45.579 -21.355  -7.253
    2    HA   ILE 835           HA       ILE 835  44.489 -18.846  -8.287
    3    HB   ILE 835           HB       ILE 835  45.001 -17.858  -6.241
    4   HG12  ILE 835          HG12      ILE 835  47.401 -18.530  -6.060
    5   HG13  ILE 835          HG13      ILE 835  46.544 -18.632  -4.536
    6   HG22  ILE 835          HG21      ILE 835  44.363 -20.705  -5.606
    7   HG21  ILE 835          HG22      ILE 835  43.235 -19.416  -6.015
    8   HG23  ILE 835          HG23      ILE 835  44.153 -19.340  -4.505
    9   HD12  ILE 835          HD11      ILE 835  47.292 -20.913  -6.339
   10   HD11  ILE 835          HD12      ILE 835  46.385 -21.041  -4.826
   11   HD13  ILE 835          HD13      ILE 835  48.059 -20.474  -4.804

  No H/Q in entry =          11
  In of MODEL    8
    1    H    ARG 836           H        ARG 836  47.069 -20.613  -8.963
    2    HA   ARG 836           HA       ARG 836  48.941 -18.434  -9.368
    3    HB2  ARG 836           HB2      ARG 836  49.184 -21.335 -10.179
    4    HB3  ARG 836           HB3      ARG 836  50.440 -20.125 -10.316
    5    HG2  ARG 836           HG2      ARG 836  51.160 -20.893  -8.368
    6    HG3  ARG 836           HG3      ARG 836  49.771 -20.064  -7.646
    7    HD2  ARG 836           HD2      ARG 836  49.894 -22.311  -6.925
    8    HD3  ARG 836           HD3      ARG 836  48.456 -22.081  -7.911
    9    HE   ARG 836           HE       ARG 836  49.606 -23.169  -9.769
   10   HH11  ARG 836          HH11      ARG 836  51.004 -23.820  -6.550
   11   HH12  ARG 836          HH12      ARG 836  51.798 -25.226  -7.067
   12   HH21  ARG 836          HH21      ARG 836  50.715 -25.079 -10.422
   13   HH22  ARG 836          HH22      ARG 836  51.669 -25.931  -9.303

  No H/Q in entry =          13
  In of MODEL    8
    1    HA   PRO 837           HA       PRO 837  47.358 -18.257 -13.590
    2    HB2  PRO 837           HB2      PRO 837  49.423 -17.106 -14.911
    3    HB3  PRO 837           HB3      PRO 837  48.404 -16.194 -13.799
    4    HG2  PRO 837           HG2      PRO 837  51.121 -17.356 -13.338
    5    HG3  PRO 837           HG3      PRO 837  50.470 -15.789 -12.827
    6    HD2  PRO 837           HD2      PRO 837  50.656 -17.978 -11.183
    7    HD3  PRO 837           HD3      PRO 837  49.460 -16.684 -10.971

  No H/Q in entry =           7
  In of MODEL    8
    1    H    CYS 838           H        CYS 838  47.593 -19.415 -15.594
    2    HA   CYS 838           HA       CYS 838  49.596 -21.486 -15.430
    3    HB2  CYS 838           HB2      CYS 838  46.846 -21.477 -16.589
    4    HB3  CYS 838           HB3      CYS 838  48.028 -22.609 -17.225

  No H/Q in entry =           4
  In of MODEL    8
    1    H    ALA 839           H        ALA 839  50.105 -22.371 -17.810
    2    HA   ALA 839           HA       ALA 839  51.162 -20.177 -19.338
    3    HB2  ALA 839           HB1      ALA 839  52.464 -22.234 -19.009
    4    HB3  ALA 839           HB2      ALA 839  52.164 -21.951 -20.723
    5    HB1  ALA 839           HB3      ALA 839  51.225 -23.161 -19.852

  No H/Q in entry =           5
  In of MODEL    8
    1    H    ALA 840           H        ALA 840  48.554 -19.861 -19.307
    2    HA   ALA 840           HA       ALA 840  47.693 -20.389 -22.053
    3    HB3  ALA 840           HB1      ALA 840  46.528 -21.999 -20.602
    4    HB1  ALA 840           HB2      ALA 840  45.413 -20.793 -21.260
    5    HB2  ALA 840           HB3      ALA 840  45.974 -20.659 -19.593

  No H/Q in entry =           5
  In of MODEL    8
    1    H    GLU 841           H        GLU 841  48.913 -18.159 -21.463
    2    HA   GLU 841           HA       GLU 841  47.241 -16.162 -20.421
    3    HB2  GLU 841           HB2      GLU 841  49.847 -16.025 -21.955
    4    HB3  GLU 841           HB3      GLU 841  49.046 -14.628 -21.246
    5    HG2  GLU 841           HG2      GLU 841  49.296 -15.564 -19.028
    6    HG3  GLU 841           HG3      GLU 841  50.014 -17.026 -19.699

  No H/Q in entry =           6
  In of MODEL    8
    1    H    THR 842           H        THR 842  45.677 -15.616 -21.358
    2    HA   THR 842           HA       THR 842  44.257 -16.107 -23.473
    3    HB   THR 842           HB       THR 842  44.515 -13.237 -22.661
    4    HG1  THR 842           HG1      THR 842  42.760 -14.802 -21.235
    5   HG21  THR 842          HG21      THR 842  42.886 -13.762 -24.435
    6   HG23  THR 842          HG22      THR 842  42.074 -13.273 -22.947
    7   HG22  THR 842          HG23      THR 842  42.146 -14.978 -23.393

  No H/Q in entry =           7
  In of MODEL    8
    1    H    GLN 843           H        GLN 843  44.719 -16.333 -25.506
    2    HA   GLN 843           HA       GLN 843  46.168 -14.259 -26.998
    3    HB2  GLN 843           HB2      GLN 843  45.905 -17.228 -27.547
    4    HB3  GLN 843           HB3      GLN 843  46.658 -16.081 -28.640
    5    HG2  GLN 843           HG2      GLN 843  47.613 -16.694 -25.849
    6    HG3  GLN 843           HG3      GLN 843  48.272 -17.400 -27.323
    7   HE21  GLN 843          HE21      GLN 843  49.489 -16.129 -28.675
    8   HE22  GLN 843          HE22      GLN 843  50.148 -14.612 -28.190

  No H/Q in entry =           8
  In of MODEL    9
    1    H1   GLY 689           H2       GLY 689  43.156   5.471 -26.572
    2    H2   GLY 689           H1       GLY 689  44.102   6.846 -26.661
    3    H3   GLY 689           H3       GLY 689  43.960   5.864 -28.026
    4    HA2  GLY 689           HA2      GLY 689  46.077   5.581 -26.944
    5    HA3  GLY 689           HA3      GLY 689  45.120   4.107 -26.822

  No H/Q in entry =           5
  In of MODEL    9
    1    H    SER 690           H        SER 690  46.640   3.765 -24.986
    2    HA   SER 690           HA       SER 690  45.858   5.223 -22.589
    3    HB2  SER 690           HB2      SER 690  45.958   2.197 -22.845
    4    HB3  SER 690           HB3      SER 690  45.646   3.099 -21.367
    5    HG   SER 690           HG       SER 690  44.036   2.833 -23.663

  No H/Q in entry =           5
  In of MODEL    9
    1    H    HIS 691           H        HIS 691  47.632   5.740 -21.429
    2    HA   HIS 691           HA       HIS 691  50.127   4.876 -22.461
    3    HB2  HIS 691           HB2      HIS 691  49.441   6.838 -20.303
    4    HB3  HIS 691           HB3      HIS 691  51.093   6.271 -20.501
    5    HD1  HIS 691           HD1      HIS 691  48.552   8.510 -22.026
    6    HD2  HIS 691           HD2      HIS 691  52.356   7.089 -22.894
    7    HE1  HIS 691           HE1      HIS 691  49.377   9.901 -23.939
    8    HE2  HIS 691           HE2      HIS 691  51.676   9.001 -24.466

  No H/Q in entry =           8
  In of MODEL    9
    1    H    MET 692           H        MET 692  50.055   2.792 -22.202
    2    HA   MET 692           HA       MET 692  50.029   1.461 -19.705
    3    HB2  MET 692           HB2      MET 692  51.013  -0.464 -20.916
    4    HB3  MET 692           HB3      MET 692  49.638   0.215 -21.773
    5    HG2  MET 692           HG2      MET 692  51.117   1.330 -23.334
    6    HG3  MET 692           HG3      MET 692  52.525   0.781 -22.433
    7    HE2  MET 692           HE1      MET 692  53.565  -0.131 -24.715
    8    HE1  MET 692           HE2      MET 692  52.134   0.418 -25.584
    9    HE3  MET 692           HE3      MET 692  52.718  -1.232 -25.802

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ASN 693           H        ASN 693  52.452   3.148 -21.491
    2    HA   ASN 693           HA       ASN 693  54.426   2.419 -19.477
    3    HB2  ASN 693           HB2      ASN 693  56.152   2.966 -21.202
    4    HB3  ASN 693           HB3      ASN 693  55.154   1.582 -21.624
    5   HD21  ASN 693          HD21      ASN 693  56.759   3.535 -23.280
    6   HD22  ASN 693          HD22      ASN 693  55.649   4.166 -24.413

  No H/Q in entry =           6
  In of MODEL    9
    1    HA   PRO 694           HA       PRO 694  54.406   6.903 -18.801
    2    HB2  PRO 694           HB2      PRO 694  55.986   6.315 -16.432
    3    HB3  PRO 694           HB3      PRO 694  54.339   6.942 -16.512
    4    HG2  PRO 694           HG2      PRO 694  54.932   4.453 -15.578
    5    HG3  PRO 694           HG3      PRO 694  53.397   4.862 -16.359
    6    HD2  PRO 694           HD2      PRO 694  55.795   3.486 -17.513
    7    HD3  PRO 694           HD3      PRO 694  54.061   3.128 -17.706

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LEU 695           H        LEU 695  56.933   4.544 -18.761
    2    HA   LEU 695           HA       LEU 695  58.734   6.365 -20.054
    3    HB2  LEU 695           HB2      LEU 695  60.618   5.897 -18.641
    4    HB3  LEU 695           HB3      LEU 695  59.328   6.408 -17.588
    5    HG   LEU 695           HG       LEU 695  60.282   3.563 -17.966
    6   HD12  LEU 695          HD11      LEU 695  61.177   3.790 -15.706
    7   HD11  LEU 695          HD12      LEU 695  60.710   5.493 -15.704
    8   HD13  LEU 695          HD13      LEU 695  61.925   4.913 -16.840
    9   HD23  LEU 695          HD21      LEU 695  58.908   3.045 -15.984
   10   HD22  LEU 695          HD22      LEU 695  57.929   3.601 -17.341
   11   HD21  LEU 695          HD23      LEU 695  58.287   4.700 -16.006

  No H/Q in entry =          11
  In of MODEL    9
    1    H    THR 696           H        THR 696  60.137   5.232 -21.462
    2    HA   THR 696           HA       THR 696  59.455   2.372 -21.694
    3    HB   THR 696           HB       THR 696  60.570   4.036 -23.954
    4    HG1  THR 696           HG1      THR 696  58.693   5.059 -23.478
    5   HG22  THR 696          HG21      THR 696  58.864   1.533 -23.881
    6   HG21  THR 696          HG22      THR 696  60.605   1.575 -24.151
    7   HG23  THR 696          HG23      THR 696  59.519   2.307 -25.327

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLN 697           H        GLN 697  61.924   4.680 -21.205
    2    HA   GLN 697           HA       GLN 697  64.052   2.853 -21.970
    3    HB2  GLN 697           HB2      GLN 697  64.278   5.615 -20.760
    4    HB3  GLN 697           HB3      GLN 697  65.538   4.709 -21.586
    5    HG2  GLN 697           HG2      GLN 697  63.051   5.862 -22.832
    6    HG3  GLN 697           HG3      GLN 697  64.689   6.488 -22.991
    7   HE21  GLN 697          HE21      GLN 697  62.744   5.545 -24.961
    8   HE22  GLN 697          HE22      GLN 697  63.536   4.326 -25.883

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ALA 698           H        ALA 698  64.606   1.391 -20.524
    2    HA   ALA 698           HA       ALA 698  65.128   0.312 -18.651
    3    HB3  ALA 698           HB1      ALA 698  66.726   2.158 -18.278
    4    HB2  ALA 698           HB2      ALA 698  66.107   1.512 -16.758
    5    HB1  ALA 698           HB3      ALA 698  65.483   3.037 -17.386

  No H/Q in entry =           5
  In of MODEL    9
    1    H    VAL 699           H        VAL 699  63.086  -0.598 -18.509
    2    HA   VAL 699           HA       VAL 699  61.326   0.607 -16.473
    3    HB   VAL 699           HB       VAL 699  60.481  -1.266 -18.690
    4   HG11  VAL 699          HG11      VAL 699  59.033  -1.346 -16.754
    5   HG13  VAL 699          HG12      VAL 699  58.202  -0.568 -18.101
    6   HG12  VAL 699          HG13      VAL 699  58.855   0.409 -16.789
    7   HG23  VAL 699          HG21      VAL 699  60.171   1.724 -18.574
    8   HG22  VAL 699          HG22      VAL 699  59.455   0.668 -19.792
    9   HG21  VAL 699          HG23      VAL 699  61.210   0.833 -19.684

  No H/Q in entry =           9
  In of MODEL    9
    1    HA   PRO 700           HA       PRO 700  62.053  -3.519 -14.776
    2    HB2  PRO 700           HB2      PRO 700  62.380  -2.730 -12.209
    3    HB3  PRO 700           HB3      PRO 700  63.663  -2.813 -13.419
    4    HG2  PRO 700           HG2      PRO 700  62.465  -0.461 -12.169
    5    HG3  PRO 700           HG3      PRO 700  63.896  -0.525 -13.213
    6    HD2  PRO 700           HD2      PRO 700  61.116   0.175 -13.892
    7    HD3  PRO 700           HD3      PRO 700  62.607   0.455 -14.820

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LYS 701           H        LYS 701  60.418  -4.732 -14.253
    2    HA   LYS 701           HA       LYS 701  58.504  -3.795 -12.318
    3    HB2  LYS 701           HB2      LYS 701  57.628  -4.684 -15.059
    4    HB3  LYS 701           HB3      LYS 701  56.560  -4.857 -13.675
    5    HG2  LYS 701           HG2      LYS 701  57.721  -2.276 -14.730
    6    HG3  LYS 701           HG3      LYS 701  56.049  -2.826 -14.890
    7    HD2  LYS 701           HD2      LYS 701  55.742  -2.721 -12.480
    8    HD3  LYS 701           HD3      LYS 701  57.428  -2.277 -12.240
    9    HE2  LYS 701           HE2      LYS 701  56.133  -0.319 -12.051
   10    HE3  LYS 701           HE3      LYS 701  57.009  -0.231 -13.575
   11    HZ2  LYS 701           HZ1      LYS 701  54.731   0.479 -13.782
   12    HZ1  LYS 701           HZ2      LYS 701  54.168  -1.001 -13.250
   13    HZ3  LYS 701           HZ3      LYS 701  54.989  -0.886 -14.734

  No H/Q in entry =          13
  In of MODEL    9
    1    H    CYS 702           H        CYS 702  57.119  -5.388 -11.432
    2    HA   CYS 702           HA       CYS 702  58.692  -7.847 -11.047
    3    HB2  CYS 702           HB2      CYS 702  57.164  -6.233  -9.014
    4    HB3  CYS 702           HB3      CYS 702  58.268  -7.576  -8.715

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLN 703           H        GLN 703  57.167  -9.351  -9.605
    2    HA   GLN 703           HA       GLN 703  54.941 -10.052 -11.247
    3    HB2  GLN 703           HB2      GLN 703  55.962 -11.018  -8.578
    4    HB3  GLN 703           HB3      GLN 703  54.534 -11.703  -9.346
    5    HG2  GLN 703           HG2      GLN 703  55.745 -12.957 -10.674
    6    HG3  GLN 703           HG3      GLN 703  56.775 -11.600 -11.177
    7   HE21  GLN 703          HE21      GLN 703  56.446 -12.781  -7.907
    8   HE22  GLN 703          HE22      GLN 703  58.041 -13.424  -7.775

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ARG 704           H        ARG 704  52.745 -10.379 -10.284
    2    HA   ARG 704           HA       ARG 704  51.777  -7.836  -9.555
    3    HB2  ARG 704           HB2      ARG 704  50.477 -10.489  -9.983
    4    HB3  ARG 704           HB3      ARG 704  49.550  -9.155  -9.312
    5    HG2  ARG 704           HG2      ARG 704  49.856  -7.837 -11.207
    6    HG3  ARG 704           HG3      ARG 704  51.100  -8.906 -11.881
    7    HD2  ARG 704           HD2      ARG 704  49.444 -10.579 -12.315
    8    HD3  ARG 704           HD3      ARG 704  48.225  -9.662 -11.412
    9    HE   ARG 704           HE       ARG 704  49.029  -7.956 -13.338
   10   HH11  ARG 704          HH11      ARG 704  47.962 -11.347 -13.667
   11   HH12  ARG 704          HH12      ARG 704  46.958 -11.035 -14.994
   12   HH21  ARG 704          HH21      ARG 704  47.627  -7.570 -15.207
   13   HH22  ARG 704          HH22      ARG 704  46.762  -8.866 -15.897

  No H/Q in entry =          13
  In of MODEL    9
    1    H    TRP 705           H        TRP 705  52.723 -10.467  -7.621
    2    HA   TRP 705           HA       TRP 705  51.417  -9.346  -5.249
    3    HB2  TRP 705           HB2      TRP 705  52.437 -11.368  -4.090
    4    HB3  TRP 705           HB3      TRP 705  51.247 -11.738  -5.327
    5    HD1  TRP 705           HD1      TRP 705  54.934 -12.204  -4.468
    6    HE1  TRP 705           HE1      TRP 705  55.981 -13.766  -6.174
    7    HE3  TRP 705           HE3      TRP 705  51.044 -12.503  -7.772
    8    HZ2  TRP 705           HZ2      TRP 705  55.243 -15.013  -8.627
    9    HZ3  TRP 705           HZ3      TRP 705  51.294 -13.909  -9.759
   10    HH2  TRP 705           HH2      TRP 705  53.354 -15.148 -10.175

  No H/Q in entry =          10
  In of MODEL    9
    1    H    GLU 706           H        GLU 706  53.876  -8.498  -6.986
    2    HA   GLU 706           HA       GLU 706  55.642  -7.905  -4.748
    3    HB2  GLU 706           HB2      GLU 706  56.270  -8.410  -7.644
    4    HB3  GLU 706           HB3      GLU 706  57.454  -7.714  -6.543
    5    HG2  GLU 706           HG2      GLU 706  57.202  -9.826  -5.226
    6    HG3  GLU 706           HG3      GLU 706  56.213 -10.444  -6.549

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS 707           H        LYS 707  56.855  -5.930  -5.112
    2    HA   LYS 707           HA       LYS 707  55.623  -4.020  -6.858
    3    HB2  LYS 707           HB2      LYS 707  55.263  -2.360  -5.080
    4    HB3  LYS 707           HB3      LYS 707  54.299  -3.796  -4.790
    5    HG2  LYS 707           HG2      LYS 707  56.079  -4.529  -3.159
    6    HG3  LYS 707           HG3      LYS 707  56.812  -2.940  -3.364
    7    HD2  LYS 707           HD2      LYS 707  54.037  -3.529  -2.306
    8    HD3  LYS 707           HD3      LYS 707  55.411  -2.940  -1.380
    9    HE2  LYS 707           HE2      LYS 707  55.386  -0.869  -2.735
   10    HE3  LYS 707           HE3      LYS 707  53.972  -1.478  -3.590
   11    HZ1  LYS 707           HZ1      LYS 707  52.751  -1.495  -1.458
   12    HZ3  LYS 707           HZ2      LYS 707  53.337   0.037  -1.826
   13    HZ2  LYS 707           HZ3      LYS 707  54.127  -0.892  -0.687

  No H/Q in entry =          13
  In of MODEL    9
    1    H    LEU 708           H        LEU 708  57.008  -2.420  -7.439
    2    HA   LEU 708           HA       LEU 708  59.792  -3.030  -7.050
    3    HB2  LEU 708           HB2      LEU 708  58.996  -2.452  -9.279
    4    HB3  LEU 708           HB3      LEU 708  58.410  -0.906  -8.701
    5    HG   LEU 708           HG       LEU 708  60.799  -0.320  -8.181
    6   HD13  LEU 708          HD11      LEU 708  61.748  -2.539  -8.096
    7   HD12  LEU 708          HD12      LEU 708  62.553  -1.571  -9.331
    8   HD11  LEU 708          HD13      LEU 708  61.370  -2.792  -9.801
    9   HD22  LEU 708          HD21      LEU 708  61.334   0.228 -10.493
   10   HD21  LEU 708          HD22      LEU 708  59.631   0.523 -10.143
   11   HD23  LEU 708          HD23      LEU 708  60.109  -0.909 -11.055

  No H/Q in entry =          11
  In of MODEL    9
    1    H    GLN 709           H        GLN 709  60.751  -2.312  -5.243
    2    HA   GLN 709           HA       GLN 709  60.752   0.530  -4.776
    3    HB2  GLN 709           HB2      GLN 709  60.211   0.471  -2.459
    4    HB3  GLN 709           HB3      GLN 709  58.971  -0.513  -3.222
    5    HG2  GLN 709           HG2      GLN 709  60.071  -2.529  -2.526
    6    HG3  GLN 709           HG3      GLN 709  61.411  -1.588  -1.860
    7   HE21  GLN 709          HE21      GLN 709  61.097  -2.404   0.200
    8   HE22  GLN 709          HE22      GLN 709  59.751  -1.948   1.167

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ASN 710           H        ASN 710  62.660   1.147  -3.736
    2    HA   ASN 710           HA       ASN 710  64.872   0.990  -3.112
    3    HB2  ASN 710           HB2      ASN 710  63.805  -0.650  -1.475
    4    HB3  ASN 710           HB3      ASN 710  64.261  -1.943  -2.551
    5   HD21  ASN 710          HD21      ASN 710  65.273   0.213  -0.147
    6   HD22  ASN 710          HD22      ASN 710  66.915  -0.343  -0.002

  No H/Q in entry =           6
  In of MODEL    9
    1    H    SER 711           H        SER 711  63.768   0.345  -5.790
    2    HA   SER 711           HA       SER 711  64.414  -0.163  -7.856
    3    HB2  SER 711           HB2      SER 711  67.157  -0.283  -6.597
    4    HB3  SER 711           HB3      SER 711  66.849  -0.201  -8.342
    5    HG   SER 711           HG       SER 711  66.790   1.865  -8.068

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ARG 712           H        ARG 712  63.776  -2.313  -5.843
    2    HA   ARG 712           HA       ARG 712  64.775  -4.580  -7.401
    3    HB2  ARG 712           HB2      ARG 712  65.123  -5.870  -5.378
    4    HB3  ARG 712           HB3      ARG 712  66.088  -4.402  -5.288
    5    HG2  ARG 712           HG2      ARG 712  64.507  -3.384  -3.841
    6    HG3  ARG 712           HG3      ARG 712  63.397  -4.736  -3.969
    7    HD2  ARG 712           HD2      ARG 712  64.516  -5.031  -1.900
    8    HD3  ARG 712           HD3      ARG 712  65.322  -6.145  -2.998
    9    HE   ARG 712           HE       ARG 712  66.513  -3.514  -2.718
   10   HH11  ARG 712          HH11      ARG 712  66.616  -6.913  -1.677
   11   HH12  ARG 712          HH12      ARG 712  68.182  -6.764  -1.009
   12   HH21  ARG 712          HH21      ARG 712  68.615  -3.362  -1.775
   13   HH22  ARG 712          HH22      ARG 712  69.336  -4.739  -1.077

  No H/Q in entry =          13
  In of MODEL    9
    1    H    CYS 713           H        CYS 713  63.432  -6.530  -6.827
    2    HA   CYS 713           HA       CYS 713  60.650  -5.723  -6.654
    3    HB2  CYS 713           HB2      CYS 713  61.985  -8.222  -7.683
    4    HB3  CYS 713           HB3      CYS 713  60.238  -8.051  -7.525

  No H/Q in entry =           4
  In of MODEL    9
    1    H    VAL 714           H        VAL 714  59.715  -5.919  -4.774
    2    HA   VAL 714           HA       VAL 714  60.500  -8.169  -3.069
    3    HB   VAL 714           HB       VAL 714  59.884  -6.826  -1.074
    4   HG13  VAL 714          HG11      VAL 714  61.830  -5.347  -1.005
    5   HG12  VAL 714          HG12      VAL 714  62.009  -5.532  -2.749
    6   HG11  VAL 714          HG13      VAL 714  62.220  -6.927  -1.691
    7   HG21  VAL 714          HG21      VAL 714  59.639  -4.516  -3.013
    8   HG23  VAL 714          HG22      VAL 714  59.622  -4.368  -1.262
    9   HG22  VAL 714          HG23      VAL 714  58.333  -5.248  -2.084

  No H/Q in entry =           9
  In of MODEL    9
    1    H    CYS 715           H        CYS 715  58.735  -8.980  -1.757
    2    HA   CYS 715           HA       CYS 715  56.311  -8.732  -3.273
    3    HB2  CYS 715           HB2      CYS 715  57.103 -10.632  -1.064
    4    HB3  CYS 715           HB3      CYS 715  55.504 -10.622  -1.820

  No H/Q in entry =           4
  In of MODEL    9
    1    H    LYS 716           H        LYS 716  54.421  -8.027  -2.496
    2    HA   LYS 716           HA       LYS 716  54.763  -5.894  -0.604
    3    HB2  LYS 716           HB2      LYS 716  52.475  -5.245  -1.250
    4    HB3  LYS 716           HB3      LYS 716  53.504  -5.537  -2.642
    5    HG2  LYS 716           HG2      LYS 716  52.419  -7.630  -3.075
    6    HG3  LYS 716           HG3      LYS 716  51.506  -7.512  -1.569
    7    HD2  LYS 716           HD2      LYS 716  50.086  -6.885  -3.439
    8    HD3  LYS 716           HD3      LYS 716  50.400  -5.478  -2.428
    9    HE2  LYS 716           HE2      LYS 716  52.218  -4.837  -4.006
   10    HE3  LYS 716           HE3      LYS 716  51.698  -6.147  -5.071
   11    HZ3  LYS 716           HZ1      LYS 716  50.700  -4.098  -5.777
   12    HZ2  LYS 716           HZ2      LYS 716  50.184  -3.769  -4.219
   13    HZ1  LYS 716           HZ3      LYS 716  49.453  -5.021  -5.087

  No H/Q in entry =          13
  In of MODEL    9
    1    H    MET 717           H        MET 717  52.370  -5.682   0.633
    2    HA   MET 717           HA       MET 717  52.250  -8.057   2.253
    3    HB2  MET 717           HB2      MET 717  51.852  -5.176   2.869
    4    HB3  MET 717           HB3      MET 717  51.148  -6.408   3.908
    5    HG2  MET 717           HG2      MET 717  53.190  -7.311   4.481
    6    HG3  MET 717           HG3      MET 717  54.022  -6.556   3.139
    7    HE1  MET 717           HE1      MET 717  54.781  -4.329   2.970
    8    HE3  MET 717           HE2      MET 717  54.441  -2.942   4.033
    9    HE2  MET 717           HE3      MET 717  53.143  -3.710   3.092

  No H/Q in entry =           9
  In of MODEL    9
    1    HA   PRO 718           HA       PRO 718  48.467  -9.012   0.502
    2    HB2  PRO 718           HB2      PRO 718  47.131 -10.275   2.554
    3    HB3  PRO 718           HB3      PRO 718  48.377 -10.996   1.539
    4    HG2  PRO 718           HG2      PRO 718  48.555 -10.031   4.323
    5    HG3  PRO 718           HG3      PRO 718  49.507 -11.255   3.487
    6    HD2  PRO 718           HD2      PRO 718  50.338  -8.674   4.086
    7    HD3  PRO 718           HD3      PRO 718  51.095  -9.763   2.915

  No H/Q in entry =           7
  In of MODEL    9
    1    H    TYR 719           H        TYR 719  48.249  -6.884   3.146
    2    HA   TYR 719           HA       TYR 719  45.407  -6.544   2.902
    3    HB2  TYR 719           HB2      TYR 719  45.726  -4.604   4.475
    4    HB3  TYR 719           HB3      TYR 719  46.266  -6.152   5.091
    5    HD1  TYR 719           HD1      TYR 719  48.615  -6.555   5.554
    6    HD2  TYR 719           HD2      TYR 719  47.345  -2.845   3.912
    7    HE1  TYR 719           HE1      TYR 719  50.768  -5.556   6.156
    8    HE2  TYR 719           HE2      TYR 719  49.506  -1.837   4.498
    9    HH   TYR 719           HH       TYR 719  52.184  -3.701   5.484

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLU 720           H        GLU 720  48.044  -5.502   1.177
    2    HA   GLU 720           HA       GLU 720  46.919  -3.003   0.270
    3    HB2  GLU 720           HB2      GLU 720  49.385  -3.466   0.500
    4    HB3  GLU 720           HB3      GLU 720  49.245  -4.597  -0.826
    5    HG2  GLU 720           HG2      GLU 720  48.501  -2.749  -2.296
    6    HG3  GLU 720           HG3      GLU 720  48.735  -1.630  -0.957

  No H/Q in entry =           6
  In of MODEL    9
    1    H    CYS 721           H        CYS 721  46.461  -6.277  -0.346
    2    HA   CYS 721           HA       CYS 721  46.072  -6.200  -3.146
    3    HB2  CYS 721           HB2      CYS 721  45.218  -8.211  -1.078
    4    HB3  CYS 721           HB3      CYS 721  44.942  -8.408  -2.808

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLY 722           H        GLY 722  44.696  -4.632  -3.709
    2    HA3  GLY 722           HA2      GLY 722  42.035  -4.436  -2.741
    3    HA2  GLY 722           HA3      GLY 722  42.634  -3.776  -4.270

  No H/Q in entry =           3
  In of MODEL    9
    1    HA   PRO 723           HA       PRO 723  40.980  -7.353  -6.357
    2    HB2  PRO 723           HB2      PRO 723  43.006  -8.350  -7.878
    3    HB3  PRO 723           HB3      PRO 723  42.144  -6.866  -8.297
    4    HG2  PRO 723           HG2      PRO 723  44.783  -7.200  -6.930
    5    HG3  PRO 723           HG3      PRO 723  44.323  -6.063  -8.212
    6    HD2  PRO 723           HD2      PRO 723  44.452  -5.345  -5.613
    7    HD3  PRO 723           HD3      PRO 723  43.276  -4.637  -6.742

  No H/Q in entry =           7
  In of MODEL    9
    1    H    SER 724           H        SER 724  40.609  -9.473  -5.629
    2    HA   SER 724           HA       SER 724  42.572 -11.323  -5.044
    3    HB2  SER 724           HB2      SER 724  42.113 -11.473  -2.600
    4    HB3  SER 724           HB3      SER 724  43.022 -10.040  -3.063
    5    HG   SER 724           HG       SER 724  40.212  -9.909  -2.863

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU 725           H        LEU 725  41.694 -12.975  -5.839
    2    HA   LEU 725           HA       LEU 725  38.824 -13.409  -5.741
    3    HB2  LEU 725           HB2      LEU 725  40.362 -13.989  -7.783
    4    HB3  LEU 725           HB3      LEU 725  40.941 -15.237  -6.749
    5    HG   LEU 725           HG       LEU 725  38.885 -16.296  -6.602
    6   HD12  LEU 725          HD11      LEU 725  37.003 -15.707  -8.067
    7   HD11  LEU 725          HD12      LEU 725  37.852 -14.220  -8.493
    8   HD13  LEU 725          HD13      LEU 725  37.332 -14.499  -6.827
    9   HD22  LEU 725          HD21      LEU 725  38.735 -17.133  -8.911
   10   HD21  LEU 725          HD22      LEU 725  40.409 -16.962  -8.364
   11   HD23  LEU 725          HD23      LEU 725  39.688 -15.748  -9.432

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ASP 726           H        ASP 726  37.829 -14.791  -4.293
    2    HA   ASP 726           HA       ASP 726  39.339 -15.843  -2.130
    3    HB2  ASP 726           HB2      ASP 726  36.421 -16.047  -2.831
    4    HB3  ASP 726           HB3      ASP 726  37.092 -17.016  -1.533

  No H/Q in entry =           4
  In of MODEL    9
    1    H    VAL 727           H        VAL 727  40.277 -17.674  -1.827
    2    HA   VAL 727           HA       VAL 727  39.484 -20.065  -3.293
    3    HB   VAL 727           HB       VAL 727  41.892 -20.666  -3.651
    4   HG12  VAL 727          HG11      VAL 727  41.052 -18.109  -5.011
    5   HG11  VAL 727          HG12      VAL 727  40.630 -19.745  -5.513
    6   HG13  VAL 727          HG13      VAL 727  42.308 -19.209  -5.579
    7   HG22  VAL 727          HG21      VAL 727  43.619 -18.912  -3.528
    8   HG21  VAL 727          HG22      VAL 727  42.905 -19.232  -1.948
    9   HG23  VAL 727          HG23      VAL 727  42.426 -17.800  -2.857

  No H/Q in entry =           9
  In of MODEL    9
    1    H    CYS 728           H        CYS 728  40.534 -22.048  -2.202
    2    HA   CYS 728           HA       CYS 728  40.723 -21.462   0.643
    3    HB2  CYS 728           HB2      CYS 728  39.779 -23.943  -0.753
    4    HB3  CYS 728           HB3      CYS 728  39.959 -23.789   0.994

  No H/Q in entry =           4
  In of MODEL    9
    1    H    ALA 729           H        ALA 729  42.318 -22.240   1.861
    2    HA   ALA 729           HA       ALA 729  44.382 -23.733   0.494
    3    HB1  ALA 729           HB1      ALA 729  44.831 -21.172   2.017
    4    HB3  ALA 729           HB2      ALA 729  44.975 -21.373   0.272
    5    HB2  ALA 729           HB3      ALA 729  46.099 -22.197   1.349

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLN 730           H        GLN 730  46.086 -24.254   2.153
    2    HA   GLN 730           HA       GLN 730  44.856 -24.833   4.739
    3    HB2  GLN 730           HB2      GLN 730  44.908 -26.884   3.348
    4    HB3  GLN 730           HB3      GLN 730  46.632 -26.677   3.154
    5    HG2  GLN 730           HG2      GLN 730  47.023 -26.992   5.482
    6    HG3  GLN 730           HG3      GLN 730  45.301 -27.037   5.821
    7   HE21  GLN 730          HE21      GLN 730  47.341 -28.995   6.354
    8   HE22  GLN 730          HE22      GLN 730  46.868 -30.445   5.548

  No H/Q in entry =           8
  In of MODEL    9
    1    H    ASP 731           H        ASP 731  45.959 -24.118   6.280
    2    HA   ASP 731           HA       ASP 731  48.523 -22.890   5.942
    3    HB2  ASP 731           HB2      ASP 731  47.026 -21.822   7.454
    4    HB3  ASP 731           HB3      ASP 731  46.693 -23.329   8.282

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLU 732           H        GLU 732  50.472 -23.672   6.573
    2    HA   GLU 732           HA       GLU 732  50.635 -26.513   7.038
    3    HB2  GLU 732           HB2      GLU 732  52.748 -24.397   6.663
    4    HB3  GLU 732           HB3      GLU 732  53.111 -26.091   6.957
    5    HG2  GLU 732           HG2      GLU 732  51.385 -25.191   4.679
    6    HG3  GLU 732           HG3      GLU 732  53.138 -25.287   4.555

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ARG 733           H        ARG 733  50.956 -23.572   8.888
    2    HA   ARG 733           HA       ARG 733  52.544 -24.541  10.977
    3    HB2  ARG 733           HB2      ARG 733  50.599 -22.262  10.760
    4    HB3  ARG 733           HB3      ARG 733  51.590 -22.559  12.173
    5    HG2  ARG 733           HG2      ARG 733  52.701 -22.091   9.413
    6    HG3  ARG 733           HG3      ARG 733  52.479 -20.819  10.619
    7    HD2  ARG 733           HD2      ARG 733  54.211 -23.282  10.950
    8    HD3  ARG 733           HD3      ARG 733  54.788 -21.655  10.595
    9    HE   ARG 733           HE       ARG 733  53.400 -21.224  12.796
   10   HH11  ARG 733          HH11      ARG 733  55.886 -23.643  12.096
   11   HH12  ARG 733          HH12      ARG 733  56.402 -23.858  13.685
   12   HH21  ARG 733          HH21      ARG 733  54.101 -21.450  15.024
   13   HH22  ARG 733          HH22      ARG 733  55.341 -22.533  15.448

  No H/Q in entry =          13
  In of MODEL    9
    1    H    SER 734           H        SER 734  49.036 -24.029  10.768
    2    HA   SER 734           HA       SER 734  48.770 -25.705  13.142
    3    HB2  SER 734           HB2      SER 734  46.730 -23.906  11.843
    4    HB3  SER 734           HB3      SER 734  46.623 -24.668  13.431
    5    HG   SER 734           HG       SER 734  48.241 -22.555  12.562

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LYS 735           H        LYS 735  48.696 -26.161   9.795
    2    HA   LYS 735           HA       LYS 735  47.717 -27.523   8.388
    3    HB2  LYS 735           HB2      LYS 735  47.583 -29.151  10.913
    4    HB3  LYS 735           HB3      LYS 735  47.136 -29.807   9.342
    5    HG2  LYS 735           HG2      LYS 735  49.837 -28.674  10.064
    6    HG3  LYS 735           HG3      LYS 735  49.437 -30.392   9.933
    7    HD2  LYS 735           HD2      LYS 735  48.628 -29.785   7.558
    8    HD3  LYS 735           HD3      LYS 735  49.483 -28.300   7.805
    9    HE2  LYS 735           HE2      LYS 735  50.986 -30.814   8.311
   10    HE3  LYS 735           HE3      LYS 735  50.724 -30.282   6.653
   11    HZ2  LYS 735           HZ1      LYS 735  52.833 -29.484   7.728
   12    HZ1  LYS 735           HZ2      LYS 735  51.912 -28.435   8.677
   13    HZ3  LYS 735           HZ3      LYS 735  51.845 -28.372   6.983

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ARG 736           H        ARG 736  46.075 -25.556   8.978
    2    HA   ARG 736           HA       ARG 736  43.443 -26.825   9.308
    3    HB2  ARG 736           HB2      ARG 736  42.606 -24.644  10.024
    4    HB3  ARG 736           HB3      ARG 736  43.854 -25.279  11.085
    5    HG2  ARG 736           HG2      ARG 736  45.485 -23.809  10.149
    6    HG3  ARG 736           HG3      ARG 736  44.338 -23.259   8.930
    7    HD2  ARG 736           HD2      ARG 736  44.608 -21.708  10.724
    8    HD3  ARG 736           HD3      ARG 736  42.943 -22.287  10.622
    9    HE   ARG 736           HE       ARG 736  44.152 -23.914  12.462
   10   HH11  ARG 736          HH11      ARG 736  43.770 -20.391  12.208
   11   HH12  ARG 736          HH12      ARG 736  43.632 -20.187  13.892
   12   HH21  ARG 736          HH21      ARG 736  43.963 -23.575  14.766
   13   HH22  ARG 736          HH22      ARG 736  43.748 -21.983  15.339

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ILE 737           H        ILE 737  41.805 -26.282   7.856
    2    HA   ILE 737           HA       ILE 737  42.729 -25.256   5.313
    3    HB   ILE 737           HB       ILE 737  39.919 -26.043   6.112
    4   HG12  ILE 737          HG12      ILE 737  41.497 -27.950   6.499
    5   HG13  ILE 737          HG13      ILE 737  40.305 -28.282   5.254
    6   HG21  ILE 737          HG21      ILE 737  40.113 -24.717   4.088
    7   HG23  ILE 737          HG22      ILE 737  39.599 -26.360   3.704
    8   HG22  ILE 737          HG23      ILE 737  41.272 -25.868   3.419
    9   HD13  ILE 737          HD11      ILE 737  42.482 -29.117   4.616
   10   HD12  ILE 737          HD12      ILE 737  43.179 -27.505   4.817
   11   HD11  ILE 737          HD13      ILE 737  41.970 -27.800   3.557

  No H/Q in entry =          11
  In of MODEL    9
    1    H    LEU 738           H        LEU 738  42.333 -23.193   4.711
    2    HA   LEU 738           HA       LEU 738  40.284 -21.806   6.165
    3    HB2  LEU 738           HB2      LEU 738  41.642 -19.699   6.175
    4    HB3  LEU 738           HB3      LEU 738  42.095 -20.931   7.315
    5    HG   LEU 738           HG       LEU 738  44.196 -21.330   6.109
    6   HD11  LEU 738          HD11      LEU 738  42.994 -19.950   3.865
    7   HD13  LEU 738          HD12      LEU 738  43.649 -21.580   4.002
    8   HD12  LEU 738          HD13      LEU 738  44.733 -20.192   4.087
    9   HD23  LEU 738          HD21      LEU 738  45.166 -19.136   6.093
   10   HD22  LEU 738          HD22      LEU 738  44.113 -19.321   7.490
   11   HD21  LEU 738          HD23      LEU 738  43.564 -18.407   6.087

  No H/Q in entry =          11
  In of MODEL    9
    1    HA   PRO 739           HA       PRO 739  39.571 -19.976   2.141
    2    HB2  PRO 739           HB2      PRO 739  37.974 -17.916   2.918
    3    HB3  PRO 739           HB3      PRO 739  37.370 -19.570   2.776
    4    HG2  PRO 739           HG2      PRO 739  37.996 -17.974   5.177
    5    HG3  PRO 739           HG3      PRO 739  36.851 -19.309   4.983
    6    HD2  PRO 739           HD2      PRO 739  39.407 -19.435   6.152
    7    HD3  PRO 739           HD3      PRO 739  38.383 -20.807   5.691

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LEU 740           H        LEU 740  41.132 -18.879   1.241
    2    HA   LEU 740           HA       LEU 740  42.119 -16.378   2.449
    3    HB2  LEU 740           HB2      LEU 740  43.625 -18.650   1.255
    4    HB3  LEU 740           HB3      LEU 740  44.217 -17.024   1.000
    5    HG   LEU 740           HG       LEU 740  43.916 -18.397   3.720
    6   HD12  LEU 740          HD11      LEU 740  46.245 -18.298   3.773
    7   HD11  LEU 740          HD12      LEU 740  46.313 -17.621   2.126
    8   HD13  LEU 740          HD13      LEU 740  45.664 -19.247   2.418
    9   HD21  LEU 740          HD21      LEU 740  44.896 -15.641   2.973
   10   HD23  LEU 740          HD22      LEU 740  45.024 -16.391   4.561
   11   HD22  LEU 740          HD23      LEU 740  43.438 -15.992   3.910

  No H/Q in entry =          11
  In of MODEL    9
    1    H    THR 741           H        THR 741  43.353 -15.232   0.526
    2    HA   THR 741           HA       THR 741  41.601 -15.479  -1.785
    3    HB   THR 741           HB       THR 741  42.859 -12.930  -1.630
    4    HG1  THR 741           HG1      THR 741  41.188 -13.297   0.585
    5   HG22  THR 741          HG21      THR 741  40.508 -12.180  -1.590
    6   HG21  THR 741          HG22      THR 741  40.017 -13.845  -1.220
    7   HG23  THR 741          HG23      THR 741  40.801 -13.473  -2.755

  No H/Q in entry =           7
  In of MODEL    9
    1    H    VAL 742           H        VAL 742  42.650 -15.014  -3.814
    2    HA   VAL 742           HA       VAL 742  45.126 -16.276  -3.879
    3    HB   VAL 742           HB       VAL 742  43.818 -16.720  -5.756
    4   HG11  VAL 742          HG11      VAL 742  42.450 -14.797  -5.640
    5   HG13  VAL 742          HG12      VAL 742  43.054 -15.201  -7.272
    6   HG12  VAL 742          HG13      VAL 742  43.757 -13.845  -6.375
    7   HG21  VAL 742          HG21      VAL 742  46.233 -16.328  -6.219
    8   HG23  VAL 742          HG22      VAL 742  45.725 -14.758  -6.888
    9   HG22  VAL 742          HG23      VAL 742  45.125 -16.250  -7.609

  No H/Q in entry =           9
  In of MODEL    9
    1    H    CYS 743           H        CYS 743  44.601 -12.761  -4.608
    2    HA   CYS 743           HA       CYS 743  47.319 -12.225  -4.833
    3    HB2  CYS 743           HB2      CYS 743  45.535 -10.514  -5.267
    4    HB3  CYS 743           HB3      CYS 743  45.264 -10.403  -3.530

  No H/Q in entry =           4
  In of MODEL    9
    1    H    LYS 744           H        LYS 744  45.265 -12.456  -2.008
    2    HA   LYS 744           HA       LYS 744  46.946 -11.700   0.051
    3    HB2  LYS 744           HB2      LYS 744  44.432 -12.598  -0.110
    4    HB3  LYS 744           HB3      LYS 744  45.188 -14.083   0.373
    5    HG2  LYS 744           HG2      LYS 744  45.228 -11.513   1.952
    6    HG3  LYS 744           HG3      LYS 744  44.216 -12.910   2.283
    7    HD2  LYS 744           HD2      LYS 744  46.390 -14.207   2.591
    8    HD3  LYS 744           HD3      LYS 744  47.202 -12.644   2.566
    9    HE2  LYS 744           HE2      LYS 744  45.066 -13.523   4.517
   10    HE3  LYS 744           HE3      LYS 744  46.779 -13.325   4.855
   11    HZ2  LYS 744           HZ1      LYS 744  45.404 -11.513   5.646
   12    HZ1  LYS 744           HZ2      LYS 744  44.922 -11.089   4.116
   13    HZ3  LYS 744           HZ3      LYS 744  46.541 -10.923   4.580

  No H/Q in entry =          13
  In of MODEL    9
    1    H    MET 745           H        MET 745  46.239 -15.082  -0.910
    2    HA   MET 745           HA       MET 745  48.218 -16.463   0.462
    3    HB2  MET 745           HB2      MET 745  46.863 -17.894  -0.275
    4    HB3  MET 745           HB3      MET 745  46.367 -17.015  -1.735
    5    HG2  MET 745           HG2      MET 745  47.376 -18.942  -2.612
    6    HG3  MET 745           HG3      MET 745  48.657 -17.781  -2.628
    7    HE1  MET 745           HE1      MET 745  47.218 -20.887  -0.924
    8    HE3  MET 745           HE2      MET 745  47.316 -19.855   0.507
    9    HE2  MET 745           HE3      MET 745  48.379 -21.254   0.340

  No H/Q in entry =           9
  In of MODEL    9
    1    H    HIS 746           H        HIS 746  48.432 -15.210  -2.930
    2    HA   HIS 746           HA       HIS 746  51.003 -16.246  -3.418
    3    HB2  HIS 746           HB2      HIS 746  49.398 -14.093  -4.529
    4    HB3  HIS 746           HB3      HIS 746  51.130 -13.939  -4.896
    5    HD1  HIS 746           HD1      HIS 746  52.040 -16.200  -6.288
    6    HD2  HIS 746           HD2      HIS 746  47.953 -15.484  -6.186
    7    HE1  HIS 746           HE1      HIS 746  51.097 -17.411  -8.271
    8    HE2  HIS 746           HE2      HIS 746  48.648 -16.896  -8.262

  No H/Q in entry =           8
  In of MODEL    9
    1    H    VAL 747           H        VAL 747  50.098 -13.088  -2.081
    2    HA   VAL 747           HA       VAL 747  52.724 -12.137  -1.665
    3    HB   VAL 747           HB       VAL 747  50.037 -11.435  -0.464
    4   HG11  VAL 747          HG11      VAL 747  51.827 -10.909   1.151
    5   HG13  VAL 747          HG12      VAL 747  51.080  -9.464   0.495
    6   HG12  VAL 747          HG13      VAL 747  52.654  -9.978  -0.090
    7   HG21  VAL 747          HG21      VAL 747  50.349 -10.912  -2.800
    8   HG23  VAL 747          HG22      VAL 747  51.830 -10.034  -2.407
    9   HG22  VAL 747          HG23      VAL 747  50.270  -9.438  -1.827

  No H/Q in entry =           9
  In of MODEL    9
    1    H    LEU 748           H        LEU 748  50.359 -13.543   0.429
    2    HA   LEU 748           HA       LEU 748  51.438 -13.933   2.902
    3    HB2  LEU 748           HB2      LEU 748  49.192 -14.351   2.228
    4    HB3  LEU 748           HB3      LEU 748  49.714 -15.445   1.005
    5    HG   LEU 748           HG       LEU 748  48.429 -16.559   2.529
    6   HD11  LEU 748          HD11      LEU 748  51.212 -17.429   2.921
    7   HD13  LEU 748          HD12      LEU 748  49.975 -17.946   1.755
    8   HD12  LEU 748          HD13      LEU 748  49.777 -18.307   3.460
    9   HD22  LEU 748          HD21      LEU 748  48.372 -15.181   4.350
   10   HD21  LEU 748          HD22      LEU 748  50.078 -15.479   4.780
   11   HD23  LEU 748          HD23      LEU 748  48.857 -16.775   4.899

  No H/Q in entry =          11
  In of MODEL    9
    1    H    HIS 749           H        HIS 749  51.770 -15.979   0.057
    2    HA   HIS 749           HA       HIS 749  53.399 -17.997   1.183
    3    HB2  HIS 749           HB2      HIS 749  51.864 -18.048  -0.871
    4    HB3  HIS 749           HB3      HIS 749  53.188 -17.289  -1.733
    5    HD1  HIS 749           HD1      HIS 749  55.367 -18.803  -2.069
    6    HD2  HIS 749           HD2      HIS 749  52.031 -20.654  -0.465
    7    HE1  HIS 749           HE1      HIS 749  55.831 -21.255  -2.250
    8    HE2  HIS 749           HE2      HIS 749  53.701 -22.349  -1.513

  No H/Q in entry =           8
  In of MODEL    9
    1    H    CYS 750           H        CYS 750  54.028 -15.101  -0.758
    2    HA   CYS 750           HA       CYS 750  56.781 -15.741  -1.051
    3    HB2  CYS 750           HB2      CYS 750  55.708 -14.483  -2.807
    4    HB3  CYS 750           HB3      CYS 750  55.351 -13.129  -1.765

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLN 751           H        GLN 751  54.917 -14.018   1.239
    2    HA   GLN 751           HA       GLN 751  56.901 -12.606   2.623
    3    HB2  GLN 751           HB2      GLN 751  54.326 -13.887   3.493
    4    HB3  GLN 751           HB3      GLN 751  55.347 -13.022   4.629
    5    HG2  GLN 751           HG2      GLN 751  54.328 -11.791   2.093
    6    HG3  GLN 751           HG3      GLN 751  53.426 -11.722   3.599
    7   HE21  GLN 751          HE21      GLN 751  54.589  -9.505   2.047
    8   HE22  GLN 751          HE22      GLN 751  55.700  -8.734   3.093

  No H/Q in entry =           8
  In of MODEL    9
    1    H    GLY 752           H        GLY 752  56.509 -15.969   2.273
    2    HA3  GLY 752           HA2      GLY 752  58.452 -17.301   2.883
    3    HA2  GLY 752           HA3      GLY 752  58.504 -16.404   4.394

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ARG 753           H        ARG 753  55.364 -16.810   3.812
    2    HA   ARG 753           HA       ARG 753  55.201 -18.901   5.793
    3    HB2  ARG 753           HB2      ARG 753  52.944 -17.449   4.405
    4    HB3  ARG 753           HB3      ARG 753  52.840 -18.422   5.861
    5    HG2  ARG 753           HG2      ARG 753  54.241 -15.781   5.555
    6    HG3  ARG 753           HG3      ARG 753  52.733 -16.086   6.411
    7    HD2  ARG 753           HD2      ARG 753  53.955 -17.539   7.990
    8    HD3  ARG 753           HD3      ARG 753  55.455 -17.172   7.136
    9    HE   ARG 753           HE       ARG 753  53.958 -14.904   8.082
   10   HH11  ARG 753          HH11      ARG 753  56.657 -17.105   8.731
   11   HH12  ARG 753          HH12      ARG 753  57.326 -16.145   9.951
   12   HH21  ARG 753          HH21      ARG 753  54.910 -13.577   9.752
   13   HH22  ARG 753          HH22      ARG 753  56.324 -14.087  10.539

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ASN 754           H        ASN 754  54.586 -20.918   5.434
    2    HA   ASN 754           HA       ASN 754  54.305 -21.702   2.637
    3    HB2  ASN 754           HB2      ASN 754  54.777 -23.487   5.043
    4    HB3  ASN 754           HB3      ASN 754  54.802 -23.974   3.357
    5   HD21  ASN 754          HD21      ASN 754  56.498 -22.419   5.902
    6   HD22  ASN 754          HD22      ASN 754  58.007 -22.262   5.092

  No H/Q in entry =           6
  In of MODEL    9
    1    H    TYR 755           H        TYR 755  52.403 -22.023   1.923
    2    HA   TYR 755           HA       TYR 755  50.381 -23.220   3.635
    3    HB2  TYR 755           HB2      TYR 755  50.082 -20.775   1.886
    4    HB3  TYR 755           HB3      TYR 755  48.718 -21.766   2.248
    5    HD1  TYR 755           HD1      TYR 755  47.357 -20.510   3.578
    6    HD2  TYR 755           HD2      TYR 755  51.489 -20.561   4.509
    7    HE1  TYR 755           HE1      TYR 755  46.931 -19.126   5.527
    8    HE2  TYR 755           HE2      TYR 755  51.065 -19.189   6.500
    9    HH   TYR 755           HH       TYR 755  49.300 -17.507   7.206

  No H/Q in entry =           9
  In of MODEL    9
    1    H    THR 756           H        THR 756  48.992 -24.513   2.521
    2    HA   THR 756           HA       THR 756  49.911 -25.409  -0.113
    3    HB   THR 756           HB       THR 756  48.285 -26.728   2.079
    4    HG1  THR 756           HG1      THR 756  50.675 -26.202   2.289
    5   HG22  THR 756          HG21      THR 756  48.703 -28.812   0.865
    6   HG21  THR 756          HG22      THR 756  49.568 -27.895  -0.387
    7   HG23  THR 756          HG23      THR 756  47.837 -27.632  -0.127

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LEU 757           H        LEU 757  48.019 -25.866  -1.601
    2    HA   LEU 757           HA       LEU 757  45.715 -24.336  -0.729
    3    HB2  LEU 757           HB2      LEU 757  46.561 -25.051  -3.509
    4    HB3  LEU 757           HB3      LEU 757  44.978 -24.393  -3.132
    5    HG   LEU 757           HG       LEU 757  46.469 -22.563  -1.952
    6   HD11  LEU 757          HD11      LEU 757  48.601 -23.533  -2.464
    7   HD13  LEU 757          HD12      LEU 757  48.415 -21.988  -3.293
    8   HD12  LEU 757          HD13      LEU 757  48.238 -23.497  -4.189
    9   HD21  LEU 757          HD21      LEU 757  44.750 -22.195  -3.539
   10   HD23  LEU 757          HD22      LEU 757  45.805 -22.669  -4.872
   11   HD22  LEU 757          HD23      LEU 757  46.151 -21.203  -3.931

  No H/Q in entry =          11
  In of MODEL    9
    1    H    THR 758           H        THR 758  43.588 -25.123  -1.174
    2    HA   THR 758           HA       THR 758  43.496 -28.016  -1.396
    3    HB   THR 758           HB       THR 758  41.795 -27.971   0.525
    4    HG1  THR 758           HG1      THR 758  42.753 -26.025   1.944
    5   HG22  THR 758          HG21      THR 758  44.686 -27.337   1.166
    6   HG21  THR 758          HG22      THR 758  44.061 -28.929   0.751
    7   HG23  THR 758          HG23      THR 758  43.548 -28.144   2.244

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLY 759           H        GLY 759  40.910 -28.563  -1.189
    2    HA3  GLY 759           HA2      GLY 759  39.813 -27.104  -3.430
    3    HA2  GLY 759           HA3      GLY 759  39.225 -28.627  -2.771

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ARG 760           H        ARG 760  37.596 -26.543  -3.421
    2    HA   ARG 760           HA       ARG 760  36.870 -24.791  -1.353
    3    HB2  ARG 760           HB2      ARG 760  34.738 -24.545  -2.626
    4    HB3  ARG 760           HB3      ARG 760  36.194 -24.318  -3.576
    5    HG2  ARG 760           HG2      ARG 760  34.732 -25.595  -4.976
    6    HG3  ARG 760           HG3      ARG 760  35.937 -26.701  -4.296
    7    HD2  ARG 760           HD2      ARG 760  33.606 -27.624  -4.314
    8    HD3  ARG 760           HD3      ARG 760  34.442 -27.587  -2.750
    9    HE   ARG 760           HE       ARG 760  32.948 -25.265  -3.123
   10   HH11  ARG 760          HH11      ARG 760  32.384 -28.696  -2.376
   11   HH12  ARG 760          HH12      ARG 760  31.031 -28.364  -1.399
   12   HH21  ARG 760          HH21      ARG 760  31.135 -24.877  -1.837
   13   HH22  ARG 760          HH22      ARG 760  30.288 -26.151  -1.077

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ASP 761           H        ASP 761  36.407 -28.062  -1.596
    2    HA   ASP 761           HA       ASP 761  33.956 -28.268  -0.110
    3    HB2  ASP 761           HB2      ASP 761  34.436 -29.858  -1.732
    4    HB3  ASP 761           HB3      ASP 761  36.000 -30.259  -1.034

  No H/Q in entry =           4
  In of MODEL    9
    1    H    SER 762           H        SER 762  37.255 -28.020   0.607
    2    HA   SER 762           HA       SER 762  37.073 -29.321   3.197
    3    HB2  SER 762           HB2      SER 762  39.328 -27.742   1.949
    4    HB3  SER 762           HB3      SER 762  39.443 -28.722   3.408
    5    HG   SER 762           HG       SER 762  39.565 -30.418   2.278

  No H/Q in entry =           5
  In of MODEL    9
    1    H    CYS 763           H        CYS 763  36.390 -26.285   1.983
    2    HA   CYS 763           HA       CYS 763  36.797 -24.885   4.568
    3    HB2  CYS 763           HB2      CYS 763  37.278 -22.943   3.134
    4    HB3  CYS 763           HB3      CYS 763  38.431 -24.263   2.877

  No H/Q in entry =           4
  In of MODEL    9
    1    H    THR 764           H        THR 764  35.489 -22.797   4.475
    2    HA   THR 764           HA       THR 764  33.075 -22.987   2.852
    3    HB   THR 764           HB       THR 764  33.454 -21.589   5.533
    4    HG1  THR 764           HG1      THR 764  33.125 -24.115   5.072
    5   HG21  THR 764          HG21      THR 764  31.801 -20.536   4.039
    6   HG23  THR 764          HG22      THR 764  31.026 -21.272   5.445
    7   HG22  THR 764          HG23      THR 764  30.975 -22.086   3.876

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LEU 765           H        LEU 765  33.280 -21.585   1.223
    2    HA   LEU 765           HA       LEU 765  35.317 -19.554   1.470
    3    HB2  LEU 765           HB2      LEU 765  34.960 -21.203  -0.490
    4    HB3  LEU 765           HB3      LEU 765  33.669 -20.099  -0.937
    5    HG   LEU 765           HG       LEU 765  35.341 -18.259  -1.006
    6   HD13  LEU 765          HD11      LEU 765  36.968 -19.133   0.465
    7   HD12  LEU 765          HD12      LEU 765  37.734 -18.986  -1.133
    8   HD11  LEU 765          HD13      LEU 765  37.161 -20.552  -0.534
    9   HD21  LEU 765          HD21      LEU 765  35.855 -20.633  -2.781
   10   HD23  LEU 765          HD22      LEU 765  36.353 -18.977  -3.119
   11   HD22  LEU 765          HD23      LEU 765  34.635 -19.386  -3.050

  No H/Q in entry =          11
  In of MODEL    9
    1    HA   PRO 766           HA       PRO 766  32.247 -16.471   2.266
    2    HB2  PRO 766           HB2      PRO 766  33.895 -14.323   1.423
    3    HB3  PRO 766           HB3      PRO 766  33.627 -14.875   3.073
    4    HG2  PRO 766           HG2      PRO 766  35.943 -15.204   1.386
    5    HG3  PRO 766           HG3      PRO 766  35.767 -15.566   3.107
    6    HD2  PRO 766           HD2      PRO 766  35.917 -17.387   0.942
    7    HD3  PRO 766           HD3      PRO 766  35.603 -17.784   2.635

  No H/Q in entry =           7
  In of MODEL    9
    1    H    ALA 767           H        ALA 767  34.198 -15.456  -0.637
    2    HA   ALA 767           HA       ALA 767  31.645 -14.946  -1.893
    3    HB3  ALA 767           HB1      ALA 767  32.841 -13.902  -3.668
    4    HB2  ALA 767           HB2      ALA 767  34.387 -14.434  -2.982
    5    HB1  ALA 767           HB3      ALA 767  33.395 -13.242  -2.121

  No H/Q in entry =           5
  In of MODEL    9
    1    H    SER 768           H        SER 768  31.048 -16.964  -1.890
    2    HA   SER 768           HA       SER 768  32.184 -18.640  -3.975
    3    HB2  SER 768           HB2      SER 768  30.452 -20.263  -2.976
    4    HB3  SER 768           HB3      SER 768  31.895 -19.908  -2.020
    5    HG   SER 768           HG       SER 768  30.682 -19.003  -0.570

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA 769           H        ALA 769  29.675 -16.492  -3.241
    2    HA   ALA 769           HA       ALA 769  28.526 -16.664  -5.831
    3    HB3  ALA 769           HB1      ALA 769  26.872 -17.273  -3.363
    4    HB2  ALA 769           HB2      ALA 769  27.188 -18.373  -4.704
    5    HB1  ALA 769           HB3      ALA 769  26.205 -16.934  -4.959

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLU 770           H        GLU 770  26.513 -14.993  -5.593
    2    HA   GLU 770           HA       GLU 770  27.723 -12.482  -5.139
    3    HB2  GLU 770           HB2      GLU 770  25.533 -11.593  -5.757
    4    HB3  GLU 770           HB3      GLU 770  26.066 -12.851  -6.866
    5    HG2  GLU 770           HG2      GLU 770  24.690 -14.465  -5.632
    6    HG3  GLU 770           HG3      GLU 770  24.118 -13.165  -4.617

  No H/Q in entry =           6
  In of MODEL    9
    1    H    LYS 771           H        LYS 771  26.749 -10.746  -3.837
    2    HA   LYS 771           HA       LYS 771  25.513 -11.628  -1.335
    3    HB2  LYS 771           HB2      LYS 771  27.931  -9.803  -1.554
    4    HB3  LYS 771           HB3      LYS 771  27.024 -10.094  -0.074
    5    HG2  LYS 771           HG2      LYS 771  28.557 -12.154  -1.645
    6    HG3  LYS 771           HG3      LYS 771  29.048 -11.426  -0.111
    7    HD2  LYS 771           HD2      LYS 771  27.287 -12.481   1.068
    8    HD3  LYS 771           HD3      LYS 771  26.436 -12.920  -0.402
    9    HE2  LYS 771           HE2      LYS 771  27.439 -14.846   0.440
   10    HE3  LYS 771           HE3      LYS 771  28.265 -14.333  -1.028
   11    HZ3  LYS 771           HZ1      LYS 771  30.052 -13.384   0.338
   12    HZ2  LYS 771           HZ2      LYS 771  29.861 -15.007   0.716
   13    HZ1  LYS 771           HZ3      LYS 771  29.247 -13.823   1.749

  No H/Q in entry =          13
  In of MODEL    9
    1    H    ALA 772           H        ALA 772  25.162  -9.449  -0.038
    2    HA   ALA 772           HA       ALA 772  23.374  -7.900  -1.707
    3    HB3  ALA 772           HB1      ALA 772  22.595  -8.679   0.473
    4    HB1  ALA 772           HB2      ALA 772  22.655  -6.919   0.432
    5    HB2  ALA 772           HB3      ALA 772  23.921  -7.827   1.260

  No H/Q in entry =           5
  In of MODEL    9
    1    H    CYS 773           H        CYS 773  23.394  -5.455  -1.108
    2    HA   CYS 773           HA       CYS 773  25.927  -4.489  -1.952
    3    HB2  CYS 773           HB2      CYS 773  23.784  -3.452  -2.662
    4    HB3  CYS 773           HB3      CYS 773  23.492  -2.963  -0.997

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLY 774           H        GLY 774  27.558  -3.870  -0.717
    2    HA3  GLY 774           HA2      GLY 774  28.108  -2.521   1.362
    3    HA2  GLY 774           HA3      GLY 774  27.116  -3.720   2.193

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ALA 775           H        ALA 775  28.040  -5.811   0.323
    2    HA   ALA 775           HA       ALA 775  30.888  -5.945   0.879
    3    HB3  ALA 775           HB1      ALA 775  29.794  -7.318   2.612
    4    HB1  ALA 775           HB2      ALA 775  30.645  -8.343   1.459
    5    HB2  ALA 775           HB3      ALA 775  28.892  -8.181   1.366

  No H/Q in entry =           5
  In of MODEL    9
    1    H    CYS 776           H        CYS 776  31.550  -5.739  -1.156
    2    HA   CYS 776           HA       CYS 776  30.505  -7.578  -3.126
    3    HB2  CYS 776           HB2      CYS 776  30.585  -4.576  -3.514
    4    HB3  CYS 776           HB3      CYS 776  30.325  -5.764  -4.788

  No H/Q in entry =           4
  In of MODEL    9
    1    HA   PRO 777           HA       PRO 777  34.984  -7.405  -3.513
    2    HB2  PRO 777           HB2      PRO 777  34.724  -9.706  -5.274
    3    HB3  PRO 777           HB3      PRO 777  35.465  -9.621  -3.675
    4    HG2  PRO 777           HG2      PRO 777  33.141 -10.954  -4.204
    5    HG3  PRO 777           HG3      PRO 777  33.553 -10.284  -2.618
    6    HD2  PRO 777           HD2      PRO 777  31.715  -9.224  -4.714
    7    HD3  PRO 777           HD3      PRO 777  31.582  -9.178  -2.940

  No H/Q in entry =           7
  In of MODEL    9
    1    H    LEU 778           H        LEU 778  36.215  -8.172  -5.721
    2    HA   LEU 778           HA       LEU 778  36.404  -6.023  -7.411
    3    HB2  LEU 778           HB2      LEU 778  36.889  -8.914  -8.011
    4    HB3  LEU 778           HB3      LEU 778  37.388  -7.620  -9.065
    5    HG   LEU 778           HG       LEU 778  39.079  -6.916  -7.427
    6   HD13  LEU 778          HD11      LEU 778  39.424  -8.065  -5.319
    7   HD12  LEU 778          HD12      LEU 778  38.125  -9.197  -5.687
    8   HD11  LEU 778          HD13      LEU 778  37.763  -7.504  -5.384
    9   HD23  LEU 778          HD21      LEU 778  39.023  -9.884  -7.830
   10   HD22  LEU 778          HD22      LEU 778  40.476  -8.896  -7.608
   11   HD21  LEU 778          HD23      LEU 778  39.492  -8.722  -9.056

  No H/Q in entry =          11
  In of MODEL    9
    1    H    TRP 779           H        TRP 779  34.673  -8.991  -8.026
    2    HA   TRP 779           HA       TRP 779  33.678  -8.150 -10.584
    3    HB2  TRP 779           HB2      TRP 779  32.658 -10.482 -10.505
    4    HB3  TRP 779           HB3      TRP 779  34.417 -10.383 -10.484
    5    HD1  TRP 779           HD1      TRP 779  31.460 -11.431  -8.291
    6    HE1  TRP 779           HE1      TRP 779  32.350 -12.634  -6.197
    7    HE3  TRP 779           HE3      TRP 779  36.467 -10.597  -8.912
    8    HZ2  TRP 779           HZ2      TRP 779  34.906 -13.150  -4.963
    9    HZ3  TRP 779           HZ3      TRP 779  38.020 -11.459  -7.217
   10    HH2  TRP 779           HH2      TRP 779  37.212 -12.694  -5.291

  No H/Q in entry =          10
  In of MODEL    9
    1    H    GLY 780           H        GLY 780  32.645  -7.408  -7.581
    2    HA3  GLY 780           HA2      GLY 780  29.804  -7.770  -8.235
    3    HA2  GLY 780           HA3      GLY 780  30.438  -7.911  -6.597

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LYS 781           H        LYS 781  28.721  -5.934  -8.368
    2    HA   LYS 781           HA       LYS 781  29.951  -3.576  -7.156
    3    HB2  LYS 781           HB2      LYS 781  28.693  -3.758  -9.870
    4    HB3  LYS 781           HB3      LYS 781  29.231  -2.259  -9.108
    5    HG2  LYS 781           HG2      LYS 781  30.918  -4.595  -9.963
    6    HG3  LYS 781           HG3      LYS 781  30.813  -3.010 -10.740
    7    HD2  LYS 781           HD2      LYS 781  31.829  -1.958  -8.812
    8    HD3  LYS 781           HD3      LYS 781  31.827  -3.493  -7.937
    9    HE2  LYS 781           HE2      LYS 781  33.236  -4.446  -9.669
   10    HE3  LYS 781           HE3      LYS 781  33.337  -2.866 -10.460
   11    HZ3  LYS 781           HZ1      LYS 781  35.267  -3.234  -9.104
   12    HZ2  LYS 781           HZ2      LYS 781  34.325  -3.607  -7.772
   13    HZ1  LYS 781           HZ3      LYS 781  34.342  -2.029  -8.369

  No H/Q in entry =          13
  In of MODEL    9
    1    H    CYS 782           H        CYS 782  28.429  -1.841  -6.842
    2    HA   CYS 782           HA       CYS 782  25.615  -2.607  -6.745
    3    HB2  CYS 782           HB2      CYS 782  26.365  -3.099  -4.504
    4    HB3  CYS 782           HB3      CYS 782  27.238  -1.575  -4.405

  No H/Q in entry =           4
  In of MODEL    9
    1    H    ASP 783           H        ASP 783  24.327  -1.010  -7.419
    2    HA   ASP 783           HA       ASP 783  25.410   1.711  -7.530
    3    HB2  ASP 783           HB2      ASP 783  25.396   0.783  -9.803
    4    HB3  ASP 783           HB3      ASP 783  23.735   0.241  -9.595

  No H/Q in entry =           4
  In of MODEL    9
    1    H    ALA 784           H        ALA 784  23.534   3.317  -7.659
    2    HA   ALA 784           HA       ALA 784  21.813   2.931  -5.478
    3    HB3  ALA 784           HB1      ALA 784  20.793   5.039  -6.104
    4    HB2  ALA 784           HB2      ALA 784  21.524   4.946  -7.702
    5    HB1  ALA 784           HB3      ALA 784  22.545   5.150  -6.276

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLU 785           H        GLU 785  21.441   2.085  -8.825
    2    HA   GLU 785           HA       GLU 785  18.600   1.671  -8.418
    3    HB2  GLU 785           HB2      GLU 785  20.286   1.430 -10.886
    4    HB3  GLU 785           HB3      GLU 785  18.547   1.168 -10.837
    5    HG2  GLU 785           HG2      GLU 785  18.254   3.480 -10.034
    6    HG3  GLU 785           HG3      GLU 785  19.987   3.731 -10.199

  No H/Q in entry =           6
  In of MODEL    9
    1    H    SER 786           H        SER 786  21.224  -0.106  -7.660
    2    HA   SER 786           HA       SER 786  19.693  -2.527  -8.069
    3    HB2  SER 786           HB2      SER 786  22.031  -3.672  -7.939
    4    HB3  SER 786           HB3      SER 786  21.541  -2.916  -9.454
    5    HG   SER 786           HG       SER 786  23.293  -1.889  -9.281

  No H/Q in entry =           5
  In of MODEL    9
    1    H    SER 787           H        SER 787  18.756  -2.943  -6.257
    2    HA   SER 787           HA       SER 787  19.574  -2.085  -3.709
    3    HB2  SER 787           HB2      SER 787  17.751  -4.400  -4.336
    4    HB3  SER 787           HB3      SER 787  17.717  -3.339  -2.922
    5    HG   SER 787           HG       SER 787  17.281  -1.608  -4.399

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LYS 788           H        LYS 788  19.776  -5.190  -5.355
    2    HA   LYS 788           HA       LYS 788  21.401  -6.306  -3.224
    3    HB2  LYS 788           HB2      LYS 788  21.078  -8.428  -4.222
    4    HB3  LYS 788           HB3      LYS 788  19.551  -7.621  -4.486
    5    HG2  LYS 788           HG2      LYS 788  20.166  -7.153  -6.805
    6    HG3  LYS 788           HG3      LYS 788  21.740  -7.911  -6.547
    7    HD2  LYS 788           HD2      LYS 788  20.459 -10.009  -5.885
    8    HD3  LYS 788           HD3      LYS 788  19.023  -9.205  -6.512
    9    HE2  LYS 788           HE2      LYS 788  19.893 -10.620  -8.236
   10    HE3  LYS 788           HE3      LYS 788  20.192  -8.945  -8.689
   11    HZ2  LYS 788           HZ1      LYS 788  22.187 -10.841  -7.534
   12    HZ1  LYS 788           HZ2      LYS 788  22.534  -9.239  -7.889
   13    HZ3  LYS 788           HZ3      LYS 788  22.122 -10.322  -9.129

  No H/Q in entry =          13
  In of MODEL    9
    1    H    CYS 789           H        CYS 789  23.407  -7.625  -4.293
    2    HA   CYS 789           HA       CYS 789  24.802  -5.507  -5.745
    3    HB2  CYS 789           HB2      CYS 789  25.734  -6.364  -3.563
    4    HB3  CYS 789           HB3      CYS 789  25.901  -7.945  -4.304

  No H/Q in entry =           4
  In of MODEL    9
    1    H    VAL 790           H        VAL 790  25.826  -6.008  -7.688
    2    HA   VAL 790           HA       VAL 790  24.862  -8.485  -8.901
    3    HB   VAL 790           HB       VAL 790  23.596  -6.564  -9.733
    4   HG12  VAL 790          HG11      VAL 790  26.233  -5.455 -10.652
    5   HG11  VAL 790          HG12      VAL 790  25.195  -4.783  -9.394
    6   HG13  VAL 790          HG13      VAL 790  24.653  -4.791 -11.077
    7   HG23  VAL 790          HG21      VAL 790  23.961  -6.855 -12.154
    8   HG22  VAL 790          HG22      VAL 790  23.965  -8.389 -11.289
    9   HG21  VAL 790          HG23      VAL 790  25.487  -7.669 -11.810

  No H/Q in entry =           9
  In of MODEL    9
    1    H    CYS 791           H        CYS 791  26.242  -9.558 -10.147
    2    HA   CYS 791           HA       CYS 791  28.996  -8.640 -10.026
    3    HB2  CYS 791           HB2      CYS 791  27.858 -11.396 -10.399
    4    HB3  CYS 791           HB3      CYS 791  29.568 -11.010 -10.590

  No H/Q in entry =           4
  In of MODEL    9
    1    H    ARG 792           H        ARG 792  30.108  -8.149 -11.584
    2    HA   ARG 792           HA       ARG 792  28.978  -7.749 -14.195
    3    HB2  ARG 792           HB2      ARG 792  31.649  -7.240 -12.917
    4    HB3  ARG 792           HB3      ARG 792  31.424  -6.996 -14.652
    5    HG2  ARG 792           HG2      ARG 792  29.663  -5.340 -14.109
    6    HG3  ARG 792           HG3      ARG 792  29.997  -5.588 -12.394
    7    HD2  ARG 792           HD2      ARG 792  32.272  -4.788 -12.691
    8    HD3  ARG 792           HD3      ARG 792  32.026  -4.636 -14.429
    9    HE   ARG 792           HE       ARG 792  30.063  -3.113 -13.317
   10   HH11  ARG 792          HH11      ARG 792  33.625  -3.031 -13.084
   11   HH12  ARG 792          HH12      ARG 792  33.663  -1.361 -12.766
   12   HH21  ARG 792          HH21      ARG 792  30.177  -0.847 -12.923
   13   HH22  ARG 792          HH22      ARG 792  31.668  -0.072 -12.710

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLU 793           H        GLU 793  30.430  -8.498 -16.133
    2    HA   GLU 793           HA       GLU 793  31.329 -11.191 -15.522
    3    HB2  GLU 793           HB2      GLU 793  30.201 -10.074 -18.084
    4    HB3  GLU 793           HB3      GLU 793  30.917 -11.686 -17.951
    5    HG2  GLU 793           HG2      GLU 793  29.308 -12.286 -16.241
    6    HG3  GLU 793           HG3      GLU 793  28.607 -10.681 -16.316

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ALA 794           H        ALA 794  32.901 -11.829 -17.626
    2    HA   ALA 794           HA       ALA 794  35.288 -10.914 -16.523
    3    HB1  ALA 794           HB1      ALA 794  34.864 -12.445 -19.098
    4    HB2  ALA 794           HB2      ALA 794  35.008 -13.135 -17.475
    5    HB3  ALA 794           HB3      ALA 794  36.377 -12.345 -18.192

  No H/Q in entry =           5
  In of MODEL    9
    1    H    SER 795           H        SER 795  33.546  -9.943 -19.356
    2    HA   SER 795           HA       SER 795  35.724  -8.443 -20.342
    3    HB2  SER 795           HB2      SER 795  32.847  -8.430 -21.249
    4    HB3  SER 795           HB3      SER 795  34.217  -7.770 -22.148
    5    HG   SER 795           HG       SER 795  35.125  -9.869 -22.116

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLU 796           H        GLU 796  33.659  -7.820 -17.842
    2    HA   GLU 796           HA       GLU 796  33.513  -4.920 -18.329
    3    HB2  GLU 796           HB2      GLU 796  31.984  -6.718 -16.485
    4    HB3  GLU 796           HB3      GLU 796  31.793  -4.962 -16.530
    5    HG2  GLU 796           HG2      GLU 796  30.939  -5.072 -18.749
    6    HG3  GLU 796           HG3      GLU 796  31.346  -6.785 -18.867

  No H/Q in entry =           6
  In of MODEL    9
    1    H    CYS 797           H        CYS 797  35.389  -7.134 -16.822
    2    HA   CYS 797           HA       CYS 797  35.746  -5.788 -14.335
    3    HB2  CYS 797           HB2      CYS 797  37.181  -8.090 -15.624
    4    HB3  CYS 797           HB3      CYS 797  37.706  -7.380 -14.102

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLU 798           H        GLU 798  36.606  -3.908 -14.267
    2    HA   GLU 798           HA       GLU 798  38.773  -3.187 -16.042
    3    HB2  GLU 798           HB2      GLU 798  38.342  -0.914 -14.697
    4    HB3  GLU 798           HB3      GLU 798  37.438  -1.380 -16.123
    5    HG2  GLU 798           HG2      GLU 798  36.077  -0.467 -14.279
    6    HG3  GLU 798           HG3      GLU 798  35.566  -2.055 -14.824

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU 799           H        GLU 799  38.278  -4.335 -13.001
    2    HA   GLU 799           HA       GLU 799  40.204  -3.124 -11.415
    3    HB2  GLU 799           HB2      GLU 799  38.466  -4.676 -10.613
    4    HB3  GLU 799           HB3      GLU 799  39.312  -6.003 -11.382
    5    HG2  GLU 799           HG2      GLU 799  39.710  -5.939  -8.991
    6    HG3  GLU 799           HG3      GLU 799  41.200  -5.702  -9.900

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLU 800           H        GLU 800  40.531  -5.984 -13.520
    2    HA   GLU 800           HA       GLU 800  42.273  -7.210 -14.216
    3    HB2  GLU 800           HB2      GLU 800  43.639  -4.505 -14.256
    4    HB3  GLU 800           HB3      GLU 800  44.256  -5.948 -15.058
    5    HG2  GLU 800           HG2      GLU 800  42.328  -6.006 -16.513
    6    HG3  GLU 800           HG3      GLU 800  41.608  -4.645 -15.661

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLY 801           H        GLY 801  42.250  -8.254 -12.169
    2    HA3  GLY 801           HA2      GLY 801  44.317  -7.566 -10.245
    3    HA2  GLY 801           HA3      GLY 801  43.129  -8.860 -10.136

  No H/Q in entry =           3
  In of MODEL    9
    1    H    PHE 802           H        PHE 802  44.455 -10.446  -9.652
    2    HA   PHE 802           HA       PHE 802  46.813 -11.068 -11.139
    3    HB2  PHE 802           HB2      PHE 802  45.182 -12.562  -9.113
    4    HB3  PHE 802           HB3      PHE 802  46.508 -13.339  -9.960
    5    HD1  PHE 802           HD1      PHE 802  47.785 -13.760  -8.017
    6    HD2  PHE 802           HD2      PHE 802  46.615  -9.772  -8.949
    7    HE1  PHE 802           HE1      PHE 802  49.353 -12.916  -6.381
    8    HE2  PHE 802           HE2      PHE 802  48.173  -8.931  -7.300
    9    HZ   PHE 802           HZ       PHE 802  49.561 -10.491  -5.998

  No H/Q in entry =           9
  In of MODEL    9
    1    H    SER 803           H        SER 803  46.909 -13.496 -11.832
    2    HA   SER 803           HA       SER 803  44.655 -14.089 -13.563
    3    HB2  SER 803           HB2      SER 803  46.564 -14.913 -15.189
    4    HB3  SER 803           HB3      SER 803  46.087 -13.212 -15.170
    5    HG   SER 803           HG       SER 803  48.223 -14.275 -13.614

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ILE 804           H        ILE 804  43.972 -16.104 -13.390
    2    HA   ILE 804           HA       ILE 804  45.722 -18.042 -12.080
    3    HB   ILE 804           HB       ILE 804  43.938 -18.949 -10.738
    4   HG12  ILE 804          HG12      ILE 804  42.013 -18.471 -12.293
    5   HG13  ILE 804          HG13      ILE 804  41.673 -18.125 -10.608
    6   HG23  ILE 804          HG21      ILE 804  43.483 -17.122  -9.171
    7   HG22  ILE 804          HG22      ILE 804  44.027 -15.971 -10.388
    8   HG21  ILE 804          HG23      ILE 804  45.163 -17.143  -9.724
    9   HD11  ILE 804          HD11      ILE 804  42.027 -15.730 -11.073
   10   HD13  ILE 804          HD12      ILE 804  40.717 -16.443 -12.012
   11   HD12  ILE 804          HD13      ILE 804  42.269 -16.123 -12.777

  No H/Q in entry =          11
  In of MODEL    9
    1    H    CYS 805           H        CYS 805  44.662 -20.305 -12.281
    2    HA   CYS 805           HA       CYS 805  44.019 -20.650 -15.135
    3    HB2  CYS 805           HB2      CYS 805  46.140 -21.684 -14.136
    4    HB3  CYS 805           HB3      CYS 805  45.083 -22.679 -13.137

  No H/Q in entry =           4
  In of MODEL    9
    1    H    VAL 806           H        VAL 806  41.982 -21.307 -15.609
    2    HA   VAL 806           HA       VAL 806  40.498 -22.596 -13.438
    3    HB   VAL 806           HB       VAL 806  39.316 -20.652 -15.389
    4   HG12  VAL 806          HG11      VAL 806  37.393 -20.652 -13.841
    5   HG11  VAL 806          HG12      VAL 806  38.191 -21.929 -12.905
    6   HG13  VAL 806          HG13      VAL 806  37.723 -22.224 -14.567
    7   HG21  VAL 806          HG21      VAL 806  40.162 -20.135 -12.549
    8   HG23  VAL 806          HG22      VAL 806  39.127 -19.065 -13.499
    9   HG22  VAL 806          HG23      VAL 806  40.785 -19.366 -14.014

  No H/Q in entry =           9
  In of MODEL    9
    1    H    GLU 807           H        GLU 807  39.442 -24.357 -13.992
    2    HA   GLU 807           HA       GLU 807  39.567 -25.335 -16.688
    3    HB2  GLU 807           HB2      GLU 807  39.969 -26.827 -14.766
    4    HB3  GLU 807           HB3      GLU 807  38.345 -26.509 -14.183
    5    HG2  GLU 807           HG2      GLU 807  37.431 -27.521 -16.188
    6    HG3  GLU 807           HG3      GLU 807  39.060 -27.868 -16.767

  No H/Q in entry =           6
  In of MODEL    9
    1    H    VAL 808           H        VAL 808  38.166 -24.662 -18.037
    2    HA   VAL 808           HA       VAL 808  35.393 -24.260 -17.263
    3    HB   VAL 808           HB       VAL 808  36.358 -22.083 -17.608
    4   HG11  VAL 808          HG11      VAL 808  37.322 -23.033 -20.295
    5   HG13  VAL 808          HG12      VAL 808  38.319 -22.625 -18.897
    6   HG12  VAL 808          HG13      VAL 808  37.385 -21.368 -19.713
    7   HG22  VAL 808          HG21      VAL 808  34.120 -22.300 -18.437
    8   HG21  VAL 808          HG22      VAL 808  34.729 -22.867 -20.000
    9   HG23  VAL 808          HG23      VAL 808  35.042 -21.208 -19.479

  No H/Q in entry =           9
  In of MODEL    9
    1    H    ASN 809           H        ASN 809  34.077 -25.535 -18.354
    2    HA   ASN 809           HA       ASN 809  33.194 -26.906 -19.944
    3    HB2  ASN 809           HB2      ASN 809  35.123 -25.328 -21.504
    4    HB3  ASN 809           HB3      ASN 809  34.424 -26.737 -22.332
    5   HD21  ASN 809          HD21      ASN 809  32.929 -24.437 -20.044
    6   HD22  ASN 809          HD22      ASN 809  31.806 -23.798 -21.172

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLY 810           H        GLY 810  35.778 -27.423 -18.374
    2    HA3  GLY 810           HA2      GLY 810  36.710 -29.556 -17.983
    3    HA2  GLY 810           HA3      GLY 810  36.360 -29.981 -19.661

  No H/Q in entry =           3
  In of MODEL    9
    1    H    LYS 811           H        LYS 811  37.575 -27.062 -20.062
    2    HA   LYS 811           HA       LYS 811  40.322 -28.091 -20.316
    3    HB2  LYS 811           HB2      LYS 811  38.942 -25.924 -21.881
    4    HB3  LYS 811           HB3      LYS 811  40.583 -26.518 -22.118
    5    HG2  LYS 811           HG2      LYS 811  39.734 -28.700 -22.746
    6    HG3  LYS 811           HG3      LYS 811  38.080 -28.159 -22.460
    7    HD2  LYS 811           HD2      LYS 811  38.576 -28.118 -24.831
    8    HD3  LYS 811           HD3      LYS 811  38.347 -26.475 -24.231
    9    HE2  LYS 811           HE2      LYS 811  40.733 -26.142 -24.136
   10    HE3  LYS 811           HE3      LYS 811  41.030 -27.805 -24.620
   11    HZ1  LYS 811           HZ1      LYS 811  39.950 -27.297 -26.738
   12    HZ3  LYS 811           HZ2      LYS 811  41.275 -26.282 -26.459
   13    HZ2  LYS 811           HZ3      LYS 811  39.708 -25.697 -26.244

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLU 812           H        GLU 812  42.013 -26.668 -19.764
    2    HA   GLU 812           HA       GLU 812  41.144 -24.710 -17.808
    3    HB2  GLU 812           HB2      GLU 812  43.950 -25.694 -18.344
    4    HB3  GLU 812           HB3      GLU 812  43.434 -24.684 -17.001
    5    HG2  GLU 812           HG2      GLU 812  43.275 -26.600 -15.850
    6    HG3  GLU 812           HG3      GLU 812  41.791 -26.848 -16.774

  No H/Q in entry =           6
  In of MODEL    9
    1    H    GLN 813           H        GLN 813  41.152 -22.653 -18.132
    2    HA   GLN 813           HA       GLN 813  42.905 -21.481 -20.181
    3    HB2  GLN 813           HB2      GLN 813  40.772 -21.564 -21.232
    4    HB3  GLN 813           HB3      GLN 813  39.939 -21.067 -19.768
    5    HG2  GLN 813           HG2      GLN 813  40.865 -18.867 -19.956
    6    HG3  GLN 813           HG3      GLN 813  41.791 -19.325 -21.394
    7   HE21  GLN 813          HE21      GLN 813  38.533 -20.372 -20.757
    8   HE22  GLN 813          HE22      GLN 813  37.775 -19.461 -22.004

  No H/Q in entry =           8
  In of MODEL    9
    1    H    THR 814           H        THR 814  43.804 -19.570 -19.560
    2    HA   THR 814           HA       THR 814  43.883 -18.908 -16.794
    3    HB   THR 814           HB       THR 814  44.926 -17.385 -19.165
    4    HG1  THR 814           HG1      THR 814  46.180 -19.008 -19.400
    5   HG23  THR 814          HG21      THR 814  44.963 -16.097 -17.083
    6   HG22  THR 814          HG22      THR 814  46.605 -16.528 -17.568
    7   HG21  THR 814          HG23      THR 814  45.798 -17.421 -16.273

  No H/Q in entry =           7
  In of MODEL    9
    1    H    MET 815           H        MET 815  42.698 -17.389 -15.751
    2    HA   MET 815           HA       MET 815  41.372 -15.321 -17.372
    3    HB2  MET 815           HB2      MET 815  40.069 -16.446 -14.894
    4    HB3  MET 815           HB3      MET 815  39.381 -15.379 -16.109
    5    HG2  MET 815           HG2      MET 815  39.594 -17.312 -17.742
    6    HG3  MET 815           HG3      MET 815  40.062 -18.259 -16.342
    7    HE2  MET 815           HE1      MET 815  36.600 -19.659 -17.194
    8    HE1  MET 815           HE2      MET 815  38.335 -19.969 -16.992
    9    HE3  MET 815           HE3      MET 815  37.781 -18.985 -18.328

  No H/Q in entry =           9
  In of MODEL    9
    1    H    SER 816           H        SER 816  41.006 -13.404 -16.217
    2    HA   SER 816           HA       SER 816  42.979 -12.743 -14.314
    3    HB2  SER 816           HB2      SER 816  40.456 -11.446 -15.160
    4    HB3  SER 816           HB3      SER 816  41.739 -10.596 -14.259
    5    HG   SER 816           HG       SER 816  41.625 -11.530 -16.904

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLU 817           H        GLU 817  42.552 -12.057 -12.223
    2    HA   GLU 817           HA       GLU 817  41.230 -13.710 -10.484
    3    HB2  GLU 817           HB2      GLU 817  43.095 -11.929 -10.232
    4    HB3  GLU 817           HB3      GLU 817  41.746 -10.849  -9.959
    5    HG2  GLU 817           HG2      GLU 817  41.071 -12.099  -7.997
    6    HG3  GLU 817           HG3      GLU 817  42.289 -13.292  -8.338

  No H/Q in entry =           6
  In of MODEL    9
    1    H    CYS 818           H        CYS 818  39.936 -11.072 -12.316
    2    HA   CYS 818           HA       CYS 818  37.667 -10.820 -10.515
    3    HB2  CYS 818           HB2      CYS 818  38.620  -8.686 -11.331
    4    HB3  CYS 818           HB3      CYS 818  38.332  -9.206 -12.990

  No H/Q in entry =           4
  In of MODEL    9
    1    H    GLU 819           H        GLU 819  38.590 -11.583 -13.814
    2    HA   GLU 819           HA       GLU 819  36.228 -12.119 -15.049
    3    HB2  GLU 819           HB2      GLU 819  38.939 -13.317 -15.246
    4    HB3  GLU 819           HB3      GLU 819  37.711 -13.873 -16.297
    5    HG2  GLU 819           HG2      GLU 819  37.463 -11.488 -17.003
    6    HG3  GLU 819           HG3      GLU 819  38.923 -11.172 -16.095

  No H/Q in entry =           6
  In of MODEL    9
    1    H    ALA 820           H        ALA 820  38.319 -14.545 -13.503
    2    HA   ALA 820           HA       ALA 820  36.646 -16.708 -13.767
    3    HB3  ALA 820           HB1      ALA 820  38.592 -16.162 -11.541
    4    HB1  ALA 820           HB2      ALA 820  38.965 -16.897 -13.105
    5    HB2  ALA 820           HB3      ALA 820  37.924 -17.738 -11.956

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLY 821           H        GLY 821  36.858 -14.325 -11.168
    2    HA3  GLY 821           HA2      GLY 821  35.059 -15.596  -9.365
    3    HA2  GLY 821           HA3      GLY 821  35.596 -13.923  -9.289

  No H/Q in entry =           3
  In of MODEL    9
    1    H    ALA 822           H        ALA 822  34.693 -13.149 -11.825
    2    HA   ALA 822           HA       ALA 822  32.063 -12.414 -11.283
    3    HB2  ALA 822           HB1      ALA 822  33.620 -11.169 -12.724
    4    HB3  ALA 822           HB2      ALA 822  32.074 -11.476 -13.496
    5    HB1  ALA 822           HB3      ALA 822  33.492 -12.438 -13.947

  No H/Q in entry =           5
  In of MODEL    9
    1    H    LEU 823           H        LEU 823  33.419 -14.850 -13.426
    2    HA   LEU 823           HA       LEU 823  30.934 -15.806 -14.293
    3    HB2  LEU 823           HB2      LEU 823  33.678 -17.026 -14.330
    4    HB3  LEU 823           HB3      LEU 823  32.300 -17.997 -14.773
    5    HG   LEU 823           HG       LEU 823  33.332 -17.230 -16.780
    6   HD12  LEU 823          HD11      LEU 823  30.850 -15.604 -16.341
    7   HD11  LEU 823          HD12      LEU 823  30.927 -17.288 -16.848
    8   HD13  LEU 823          HD13      LEU 823  31.562 -16.023 -17.897
    9   HD23  LEU 823          HD21      LEU 823  33.618 -14.862 -17.361
   10   HD22  LEU 823          HD22      LEU 823  34.575 -15.297 -15.949
   11   HD21  LEU 823          HD23      LEU 823  33.072 -14.403 -15.752

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ARG 824           H        ARG 824  32.967 -16.804 -11.515
    2    HA   ARG 824           HA       ARG 824  31.375 -18.947 -10.683
    3    HB2  ARG 824           HB2      ARG 824  33.007 -17.051  -8.964
    4    HB3  ARG 824           HB3      ARG 824  32.423 -18.636  -8.469
    5    HG2  ARG 824           HG2      ARG 824  33.843 -19.698 -10.123
    6    HG3  ARG 824           HG3      ARG 824  34.381 -18.119 -10.701
    7    HD2  ARG 824           HD2      ARG 824  36.074 -19.018  -9.321
    8    HD3  ARG 824           HD3      ARG 824  35.298 -17.721  -8.423
    9    HE   ARG 824           HE       ARG 824  34.094 -20.207  -7.944
   10   HH11  ARG 824          HH11      ARG 824  36.850 -18.206  -6.915
   11   HH12  ARG 824          HH12      ARG 824  37.205 -19.066  -5.503
   12   HH21  ARG 824          HH21      ARG 824  34.604 -21.472  -5.955
   13   HH22  ARG 824          HH22      ARG 824  35.936 -21.036  -4.982

  No H/Q in entry =          13
  In of MODEL    9
    1    H    CYS 825           H        CYS 825  31.136 -15.489 -10.118
    2    HA   CYS 825           HA       CYS 825  29.139 -15.672  -8.129
    3    HB2  CYS 825           HB2      CYS 825  30.639 -13.674  -8.408
    4    HB3  CYS 825           HB3      CYS 825  29.748 -13.293  -9.874

  No H/Q in entry =           4
  In of MODEL    9
    1    H    ARG 826           H        ARG 826  28.951 -15.147 -11.673
    2    HA   ARG 826           HA       ARG 826  26.169 -14.634 -11.567
    3    HB2  ARG 826           HB2      ARG 826  26.105 -14.949 -13.990
    4    HB3  ARG 826           HB3      ARG 826  27.374 -13.826 -13.503
    5    HG2  ARG 826           HG2      ARG 826  29.031 -15.354 -14.093
    6    HG3  ARG 826           HG3      ARG 826  27.895 -16.712 -14.136
    7    HD2  ARG 826           HD2      ARG 826  27.859 -14.338 -16.018
    8    HD3  ARG 826           HD3      ARG 826  28.484 -15.948 -16.407
    9    HE   ARG 826           HE       ARG 826  26.106 -16.651 -15.706
   10   HH11  ARG 826          HH11      ARG 826  26.903 -13.870 -17.812
   11   HH12  ARG 826          HH12      ARG 826  25.333 -13.766 -18.420
   12   HH21  ARG 826          HH21      ARG 826  23.980 -16.450 -16.575
   13   HH22  ARG 826          HH22      ARG 826  23.620 -15.208 -17.686

  No H/Q in entry =          13
  In of MODEL    9
    1    H    GLY 827           H        GLY 827  27.934 -17.553 -11.553
    2    HA3  GLY 827           HA2      GLY 827  26.611 -19.459 -10.747
    3    HA2  GLY 827           HA3      GLY 827  25.375 -18.971 -11.901

  No H/Q in entry =           3
  In of MODEL    9
    1    H    GLN 828           H        GLN 828  28.258 -18.437 -13.356
    2    HA   GLN 828           HA       GLN 828  28.010 -20.661 -15.083
    3    HB2  GLN 828           HB2      GLN 828  29.075 -18.537 -15.797
    4    HB3  GLN 828           HB3      GLN 828  30.385 -18.824 -14.659
    5    HG2  GLN 828           HG2      GLN 828  31.065 -19.414 -16.925
    6    HG3  GLN 828           HG3      GLN 828  31.009 -20.840 -15.886
    7   HE21  GLN 828          HE21      GLN 828  29.563 -19.206 -18.540
    8   HE22  GLN 828          HE22      GLN 828  28.538 -20.499 -19.031

  No H/Q in entry =           8
  In of MODEL    9
    1    H    SER 829           H        SER 829  29.322 -22.529 -15.191
    2    HA   SER 829           HA       SER 829  30.406 -23.196 -12.576
    3    HB2  SER 829           HB2      SER 829  29.548 -25.023 -14.817
    4    HB3  SER 829           HB3      SER 829  29.961 -25.497 -13.158
    5    HG   SER 829           HG       SER 829  28.133 -23.489 -13.397

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ILE 830           H        ILE 830  32.423 -22.893 -12.401
    2    HA   ILE 830           HA       ILE 830  34.274 -23.902 -14.388
    3    HB   ILE 830           HB       ILE 830  35.717 -21.939 -14.249
    4   HG12  ILE 830          HG12      ILE 830  34.921 -21.112 -11.996
    5   HG13  ILE 830          HG13      ILE 830  35.147 -19.820 -13.130
    6   HG22  ILE 830          HG21      ILE 830  34.415 -20.332 -15.598
    7   HG21  ILE 830          HG22      ILE 830  32.963 -21.261 -15.184
    8   HG23  ILE 830          HG23      ILE 830  34.251 -22.016 -16.121
    9   HD13  ILE 830          HD11      ILE 830  33.121 -19.409 -11.960
   10   HD12  ILE 830          HD12      ILE 830  32.543 -21.039 -12.275
   11   HD11  ILE 830          HD13      ILE 830  32.687 -19.887 -13.600

  No H/Q in entry =          11
  In of MODEL    9
    1    H    SER 831           H        SER 831  36.194 -24.500 -13.493
    2    HA   SER 831           HA       SER 831  36.211 -24.509 -10.577
    3    HB2  SER 831           HB2      SER 831  37.105 -26.543 -12.578
    4    HB3  SER 831           HB3      SER 831  37.604 -26.571 -10.891
    5    HG   SER 831           HG       SER 831  34.848 -26.335 -11.437

  No H/Q in entry =           5
  In of MODEL    9
    1    H    VAL 832           H        VAL 832  37.621 -22.939 -10.008
    2    HA   VAL 832           HA       VAL 832  39.983 -22.266 -11.459
    3    HB   VAL 832           HB       VAL 832  39.263 -21.823  -8.555
    4   HG11  VAL 832          HG11      VAL 832  41.681 -21.582  -8.938
    5   HG13  VAL 832          HG12      VAL 832  40.963 -20.003  -8.607
    6   HG12  VAL 832          HG13      VAL 832  41.371 -20.463 -10.262
    7   HG21  VAL 832          HG21      VAL 832  37.644 -20.781 -10.024
    8   HG23  VAL 832          HG22      VAL 832  38.928 -19.969 -10.917
    9   HG22  VAL 832          HG23      VAL 832  38.622 -19.544  -9.237

  No H/Q in entry =           9
  In of MODEL    9
    1    H    THR 833           H        THR 833  41.622 -23.588 -11.716
    2    HA   THR 833           HA       THR 833  41.838 -25.906 -10.023
    3    HB   THR 833           HB       THR 833  43.571 -26.605 -11.691
    4    HG1  THR 833           HG1      THR 833  43.255 -25.149 -13.716
    5   HG23  THR 833          HG21      THR 833  41.979 -26.962 -13.519
    6   HG22  THR 833          HG22      THR 833  40.925 -25.722 -12.836
    7   HG21  THR 833          HG23      THR 833  41.217 -27.213 -11.947

  No H/Q in entry =           7
  In of MODEL    9
    1    H    SER 834           H        SER 834  43.686 -23.069 -10.850
    2    HA   SER 834           HA       SER 834  45.310 -23.429  -8.487
    3    HB2  SER 834           HB2      SER 834  46.540 -23.201 -11.243
    4    HB3  SER 834           HB3      SER 834  47.427 -23.146  -9.726
    5    HG   SER 834           HG       SER 834  46.881 -25.231 -11.136

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ILE 835           H        ILE 835  46.400 -21.528  -7.895
    2    HA   ILE 835           HA       ILE 835  45.067 -19.080  -8.744
    3    HB   ILE 835           HB       ILE 835  46.308 -18.012  -6.998
    4   HG12  ILE 835          HG12      ILE 835  47.790 -20.659  -6.688
    5   HG13  ILE 835          HG13      ILE 835  48.433 -19.101  -7.212
    6   HG23  ILE 835          HG21      ILE 835  44.272 -19.125  -6.377
    7   HG22  ILE 835          HG22      ILE 835  45.436 -19.259  -5.058
    8   HG21  ILE 835          HG23      ILE 835  45.136 -20.640  -6.114
    9   HD11  ILE 835          HD11      ILE 835  47.375 -19.696  -4.513
   10   HD13  ILE 835          HD12      ILE 835  48.122 -18.189  -5.073
   11   HD12  ILE 835          HD13      ILE 835  49.073 -19.682  -4.991

  No H/Q in entry =          11
  In of MODEL    9
    1    H    ARG 836           H        ARG 836  47.470 -20.818  -9.818
    2    HA   ARG 836           HA       ARG 836  49.195 -18.678 -10.807
    3    HB2  ARG 836           HB2      ARG 836  49.374 -21.677 -11.111
    4    HB3  ARG 836           HB3      ARG 836  50.618 -20.509 -11.544
    5    HG2  ARG 836           HG2      ARG 836  50.991 -19.944  -9.266
    6    HG3  ARG 836           HG3      ARG 836  49.589 -20.879  -8.742
    7    HD2  ARG 836           HD2      ARG 836  50.658 -22.873  -9.644
    8    HD3  ARG 836           HD3      ARG 836  52.112 -21.925  -9.983
    9    HE   ARG 836           HE       ARG 836  51.895 -21.429  -7.438
   10   HH11  ARG 836          HH11      ARG 836  51.265 -24.546  -8.994
   11   HH12  ARG 836          HH12      ARG 836  51.783 -25.483  -7.681
   12   HH21  ARG 836          HH21      ARG 836  52.607 -22.753  -5.576
   13   HH22  ARG 836          HH22      ARG 836  52.550 -24.446  -5.697

  No H/Q in entry =          13
  In of MODEL    9
    1    HA   PRO 837           HA       PRO 837  46.805 -18.733 -14.655
    2    HB2  PRO 837           HB2      PRO 837  49.354 -18.390 -16.118
    3    HB3  PRO 837           HB3      PRO 837  47.934 -17.354 -16.090
    4    HG2  PRO 837           HG2      PRO 837  50.186 -16.644 -14.835
    5    HG3  PRO 837           HG3      PRO 837  48.587 -16.259 -14.171
    6    HD2  PRO 837           HD2      PRO 837  50.513 -18.392 -13.360
    7    HD3  PRO 837           HD3      PRO 837  49.462 -17.369 -12.358

  No H/Q in entry =           7
  In of MODEL    9
    1    H    CYS 838           H        CYS 838  46.751 -19.838 -16.861
    2    HA   CYS 838           HA       CYS 838  47.706 -22.586 -16.579
    3    HB2  CYS 838           HB2      CYS 838  45.929 -21.341 -18.707
    4    HB3  CYS 838           HB3      CYS 838  46.250 -23.041 -18.522

  No H/Q in entry =           4
  In of MODEL    9
    1    H    ALA 839           H        ALA 839  48.421 -23.505 -18.831
    2    HA   ALA 839           HA       ALA 839  50.386 -21.778 -20.060
    3    HB3  ALA 839           HB1      ALA 839  50.875 -24.160 -19.699
    4    HB2  ALA 839           HB2      ALA 839  50.910 -23.766 -21.419
    5    HB1  ALA 839           HB3      ALA 839  49.512 -24.592 -20.733

  No H/Q in entry =           5
  In of MODEL    9
    1    H    ALA 840           H        ALA 840  47.179 -22.596 -20.389
    2    HA   ALA 840           HA       ALA 840  46.794 -21.956 -23.153
    3    HB1  ALA 840           HB1      ALA 840  44.825 -22.227 -20.901
    4    HB2  ALA 840           HB2      ALA 840  45.287 -23.502 -22.033
    5    HB3  ALA 840           HB3      ALA 840  44.429 -22.071 -22.610

  No H/Q in entry =           5
  In of MODEL    9
    1    H    GLU 841           H        GLU 841  47.665 -20.064 -23.400
    2    HA   GLU 841           HA       GLU 841  46.750 -17.863 -21.819
    3    HB2  GLU 841           HB2      GLU 841  48.827 -17.978 -23.997
    4    HB3  GLU 841           HB3      GLU 841  48.392 -16.524 -23.110
    5    HG2  GLU 841           HG2      GLU 841  49.021 -17.708 -21.012
    6    HG3  GLU 841           HG3      GLU 841  49.629 -19.023 -22.008

  No H/Q in entry =           6
  In of MODEL    9
    1    H    THR 842           H        THR 842  44.919 -17.313 -22.307
    2    HA   THR 842           HA       THR 842  43.785 -17.442 -24.918
    3    HB   THR 842           HB       THR 842  42.419 -17.872 -22.914
    4    HG1  THR 842           HG1      THR 842  40.711 -17.083 -23.766
    5   HG23  THR 842          HG21      THR 842  43.418 -16.267 -21.361
    6   HG22  THR 842          HG22      THR 842  41.674 -16.021 -21.473
    7   HG21  THR 842          HG23      THR 842  42.772 -14.930 -22.316

  No H/Q in entry =           7
  In of MODEL    9
    1    H    GLN 843           H        GLN 843  43.299 -15.790 -26.268
    2    HA   GLN 843           HA       GLN 843  44.552 -13.202 -25.716
    3    HB2  GLN 843           HB2      GLN 843  43.954 -14.520 -28.374
    4    HB3  GLN 843           HB3      GLN 843  44.668 -12.929 -28.165
    5    HG2  GLN 843           HG2      GLN 843  46.614 -13.943 -27.097
    6    HG3  GLN 843           HG3      GLN 843  45.894 -15.536 -27.317
    7   HE21  GLN 843          HE21      GLN 843  47.531 -16.277 -28.603
    8   HE22  GLN 843          HE22      GLN 843  47.798 -15.717 -30.206

  No H/Q in entry =           8
  In of MODEL   10
    1    H1   GLY 689           H1       GLY 689  63.432  20.696 -13.832
    2    H2   GLY 689           H3       GLY 689  63.159  19.072 -14.190
    3    H3   GLY 689           H2       GLY 689  63.560  20.163 -15.425
    4    HA2  GLY 689           HA2      GLY 689  61.210  19.678 -15.468
    5    HA3  GLY 689           HA3      GLY 689  61.533  21.365 -15.081

  No H/Q in entry =           5
  In of MODEL   10
    1    H    SER 690           H        SER 690  59.543  18.956 -14.286
    2    HA   SER 690           HA       SER 690  59.618  19.441 -11.423
    3    HB2  SER 690           HB2      SER 690  57.172  20.009 -13.121
    4    HB3  SER 690           HB3      SER 690  57.251  20.094 -11.366
    5    HG   SER 690           HG       SER 690  58.503  21.712 -13.292

  No H/Q in entry =           5
  In of MODEL   10
    1    H    HIS 691           H        HIS 691  59.606  17.423 -10.633
    2    HA   HIS 691           HA       HIS 691  57.377  15.805 -11.484
    3    HB2  HIS 691           HB2      HIS 691  58.615  13.652 -11.035
    4    HB3  HIS 691           HB3      HIS 691  59.241  14.542 -12.401
    5    HD1  HIS 691           HD1      HIS 691  61.750  14.679 -12.466
    6    HD2  HIS 691           HD2      HIS 691  60.364  13.980  -8.613
    7    HE1  HIS 691           HE1      HIS 691  63.771  14.239 -11.095
    8    HE2  HIS 691           HE2      HIS 691  62.913  13.682  -8.811

  No H/Q in entry =           8
  In of MODEL   10
    1    H    MET 692           H        MET 692  56.415  17.059  -9.963
    2    HA   MET 692           HA       MET 692  57.146  16.748  -7.195
    3    HB2  MET 692           HB2      MET 692  54.786  18.117  -8.492
    4    HB3  MET 692           HB3      MET 692  55.139  18.169  -6.768
    5    HG2  MET 692           HG2      MET 692  57.237  19.306  -7.231
    6    HG3  MET 692           HG3      MET 692  56.926  19.205  -8.960
    7    HE3  MET 692           HE1      MET 692  56.542  23.019  -8.272
    8    HE2  MET 692           HE2      MET 692  57.323  21.777  -9.254
    9    HE1  MET 692           HE3      MET 692  57.684  21.895  -7.534

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ASN 693           H        ASN 693  54.527  15.743  -9.309
    2    HA   ASN 693           HA       ASN 693  53.708  13.892  -7.224
    3    HB2  ASN 693           HB2      ASN 693  51.688  13.436  -8.540
    4    HB3  ASN 693           HB3      ASN 693  51.867  15.165  -8.329
    5   HD21  ASN 693          HD21      ASN 693  52.323  16.422 -10.124
    6   HD22  ASN 693          HD22      ASN 693  52.139  15.836 -11.736

  No H/Q in entry =           6
  In of MODEL   10
    1    HA   PRO 694           HA       PRO 694  55.990  10.574  -9.113
    2    HB2  PRO 694           HB2      PRO 694  53.710   8.908  -8.145
    3    HB3  PRO 694           HB3      PRO 694  55.442   8.706  -7.868
    4    HG2  PRO 694           HG2      PRO 694  53.901   9.623  -5.922
    5    HG3  PRO 694           HG3      PRO 694  55.509  10.317  -6.200
    6    HD2  PRO 694           HD2      PRO 694  52.826  11.410  -6.944
    7    HD3  PRO 694           HD3      PRO 694  54.258  12.243  -6.298

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LEU 695           H        LEU 695  55.958  10.076 -11.195
    2    HA   LEU 695           HA       LEU 695  53.520  10.459 -12.615
    3    HB2  LEU 695           HB2      LEU 695  54.917  10.133 -14.696
    4    HB3  LEU 695           HB3      LEU 695  55.290  11.511 -13.693
    5    HG   LEU 695           HG       LEU 695  57.246  10.169 -12.782
    6   HD11  LEU 695          HD11      LEU 695  56.535   7.939 -13.429
    7   HD13  LEU 695          HD12      LEU 695  58.106   8.336 -14.123
    8   HD12  LEU 695          HD13      LEU 695  56.659   8.379 -15.131
    9   HD21  LEU 695          HD21      LEU 695  57.200  10.849 -15.713
   10   HD23  LEU 695          HD22      LEU 695  58.648  10.632 -14.733
   11   HD22  LEU 695          HD23      LEU 695  57.536  11.956 -14.381

  No H/Q in entry =          11
  In of MODEL   10
    1    H    THR 696           H        THR 696  52.337   9.144 -13.776
    2    HA   THR 696           HA       THR 696  52.544   6.318 -13.140
    3    HB   THR 696           HB       THR 696  50.338   7.770 -14.637
    4    HG1  THR 696           HG1      THR 696  50.551   7.417 -11.809
    5   HG22  THR 696          HG21      THR 696  48.912   6.018 -13.636
    6   HG21  THR 696          HG22      THR 696  50.325   5.333 -12.828
    7   HG23  THR 696          HG23      THR 696  50.214   5.307 -14.587

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLN 697           H        GLN 697  53.874   8.224 -15.334
    2    HA   GLN 697           HA       GLN 697  53.158   7.195 -17.868
    3    HB2  GLN 697           HB2      GLN 697  55.744   8.539 -17.058
    4    HB3  GLN 697           HB3      GLN 697  55.218   8.267 -18.706
    5    HG2  GLN 697           HG2      GLN 697  53.867  10.029 -16.673
    6    HG3  GLN 697           HG3      GLN 697  54.825  10.560 -18.055
    7   HE21  GLN 697          HE21      GLN 697  53.942  10.376 -20.123
    8   HE22  GLN 697          HE22      GLN 697  52.266  10.117 -20.388

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ALA 698           H        ALA 698  55.335   6.094 -15.490
    2    HA   ALA 698           HA       ALA 698  56.381   4.066 -17.334
    3    HB1  ALA 698           HB1      ALA 698  58.108   5.420 -16.249
    4    HB2  ALA 698           HB2      ALA 698  58.200   3.741 -15.719
    5    HB3  ALA 698           HB3      ALA 698  57.477   4.961 -14.670

  No H/Q in entry =           5
  In of MODEL   10
    1    H    VAL 699           H        VAL 699  56.153   1.916 -16.858
    2    HA   VAL 699           HA       VAL 699  54.363   1.290 -14.615
    3    HB   VAL 699           HB       VAL 699  54.580  -0.177 -17.262
    4   HG12  VAL 699          HG11      VAL 699  52.661  -0.558 -14.967
    5   HG11  VAL 699          HG12      VAL 699  53.962  -1.654 -15.436
    6   HG13  VAL 699          HG13      VAL 699  52.588  -1.401 -16.514
    7   HG23  VAL 699          HG21      VAL 699  52.381   1.637 -16.266
    8   HG22  VAL 699          HG22      VAL 699  52.342   0.701 -17.759
    9   HG21  VAL 699          HG23      VAL 699  53.515   2.003 -17.565

  No H/Q in entry =           9
  In of MODEL   10
    1    HA   PRO 700           HA       PRO 700  58.049  -1.093 -13.487
    2    HB2  PRO 700           HB2      PRO 700  56.471  -1.761 -11.133
    3    HB3  PRO 700           HB3      PRO 700  58.044  -0.970 -11.235
    4    HG2  PRO 700           HG2      PRO 700  55.818   0.401 -10.506
    5    HG3  PRO 700           HG3      PRO 700  57.128   1.149 -11.434
    6    HD2  PRO 700           HD2      PRO 700  54.486   0.118 -12.381
    7    HD3  PRO 700           HD3      PRO 700  55.377   1.580 -12.870

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LYS 701           H        LYS 701  58.273  -3.071 -14.188
    2    HA   LYS 701           HA       LYS 701  55.914  -4.743 -14.428
    3    HB2  LYS 701           HB2      LYS 701  58.642  -5.088 -15.646
    4    HB3  LYS 701           HB3      LYS 701  57.379  -6.298 -15.786
    5    HG2  LYS 701           HG2      LYS 701  57.218  -3.455 -16.785
    6    HG3  LYS 701           HG3      LYS 701  57.526  -4.874 -17.788
    7    HD2  LYS 701           HD2      LYS 701  54.987  -4.289 -16.220
    8    HD3  LYS 701           HD3      LYS 701  55.191  -4.137 -17.959
    9    HE2  LYS 701           HE2      LYS 701  55.609  -6.558 -18.124
   10    HE3  LYS 701           HE3      LYS 701  55.412  -6.697 -16.377
   11    HZ2  LYS 701           HZ1      LYS 701  53.301  -5.867 -18.303
   12    HZ1  LYS 701           HZ2      LYS 701  53.111  -5.927 -16.640
   13    HZ3  LYS 701           HZ3      LYS 701  53.391  -7.335 -17.501

  No H/Q in entry =          13
  In of MODEL   10
    1    H    CYS 702           H        CYS 702  55.389  -5.684 -12.750
    2    HA   CYS 702           HA       CYS 702  57.192  -7.551 -11.464
    3    HB2  CYS 702           HB2      CYS 702  55.574  -5.372 -10.125
    4    HB3  CYS 702           HB3      CYS 702  56.053  -6.819  -9.281

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLN 703           H        GLN 703  55.883  -9.220 -10.300
    2    HA   GLN 703           HA       GLN 703  53.530  -9.733 -11.848
    3    HB2  GLN 703           HB2      GLN 703  54.728 -11.213  -9.511
    4    HB3  GLN 703           HB3      GLN 703  53.330 -11.763 -10.423
    5    HG2  GLN 703           HG2      GLN 703  56.104 -11.348 -11.520
    6    HG3  GLN 703           HG3      GLN 703  55.358 -12.898 -11.132
    7   HE21  GLN 703          HE21      GLN 703  55.429 -10.234 -13.354
    8   HE22  GLN 703          HE22      GLN 703  54.497 -10.973 -14.600

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ARG 704           H        ARG 704  51.630 -10.597 -10.494
    2    HA   ARG 704           HA       ARG 704  50.240  -8.363  -9.586
    3    HB2  ARG 704           HB2      ARG 704  49.695 -11.260  -9.101
    4    HB3  ARG 704           HB3      ARG 704  48.543  -9.958  -8.855
    5    HG2  ARG 704           HG2      ARG 704  49.868 -10.455 -11.481
    6    HG3  ARG 704           HG3      ARG 704  48.396 -11.283 -10.995
    7    HD2  ARG 704           HD2      ARG 704  47.817  -9.373 -12.369
    8    HD3  ARG 704           HD3      ARG 704  47.290  -9.121 -10.710
    9    HE   ARG 704           HE       ARG 704  49.809  -7.910 -11.122
   10   HH11  ARG 704          HH11      ARG 704  46.462  -7.539 -12.174
   11   HH12  ARG 704          HH12      ARG 704  46.512  -5.845 -12.203
   12   HH21  ARG 704          HH21      ARG 704  49.856  -5.599 -11.034
   13   HH22  ARG 704          HH22      ARG 704  48.456  -4.698 -11.391

  No H/Q in entry =          13
  In of MODEL   10
    1    H    TRP 705           H        TRP 705  52.127 -10.618  -7.784
    2    HA   TRP 705           HA       TRP 705  51.189  -9.582  -5.222
    3    HB2  TRP 705           HB2      TRP 705  52.521 -11.541  -4.330
    4    HB3  TRP 705           HB3      TRP 705  51.132 -11.957  -5.324
    5    HD1  TRP 705           HD1      TRP 705  54.913 -12.318  -5.164
    6    HE1  TRP 705           HE1      TRP 705  55.710 -13.781  -7.110
    7    HE3  TRP 705           HE3      TRP 705  50.550 -12.639  -7.826
    8    HZ2  TRP 705           HZ2      TRP 705  54.660 -14.943  -9.438
    9    HZ3  TRP 705           HZ3      TRP 705  50.540 -13.950  -9.908
   10    HH2  TRP 705           HH2      TRP 705  52.551 -15.084 -10.695

  No H/Q in entry =          10
  In of MODEL   10
    1    H    GLU 706           H        GLU 706  53.267  -8.474  -7.361
    2    HA   GLU 706           HA       GLU 706  55.349  -7.887  -5.383
    3    HB2  GLU 706           HB2      GLU 706  55.784  -8.403  -8.342
    4    HB3  GLU 706           HB3      GLU 706  57.006  -7.950  -7.168
    5    HG2  GLU 706           HG2      GLU 706  56.718 -10.068  -6.052
    6    HG3  GLU 706           HG3      GLU 706  55.412 -10.490  -7.163

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS 707           H        LYS 707  56.533  -5.948  -5.823
    2    HA   LYS 707           HA       LYS 707  55.559  -4.036  -7.684
    3    HB2  LYS 707           HB2      LYS 707  55.218  -2.234  -5.914
    4    HB3  LYS 707           HB3      LYS 707  53.920  -3.391  -6.119
    5    HG2  LYS 707           HG2      LYS 707  54.415  -4.444  -4.070
    6    HG3  LYS 707           HG3      LYS 707  56.004  -3.691  -3.978
    7    HD2  LYS 707           HD2      LYS 707  54.187  -2.726  -2.452
    8    HD3  LYS 707           HD3      LYS 707  55.103  -1.580  -3.421
    9    HE2  LYS 707           HE2      LYS 707  52.713  -1.040  -3.396
   10    HE3  LYS 707           HE3      LYS 707  53.258  -1.434  -5.020
   11    HZ2  LYS 707           HZ1      LYS 707  51.662  -3.151  -3.184
   12    HZ1  LYS 707           HZ2      LYS 707  52.293  -3.677  -4.681
   13    HZ3  LYS 707           HZ3      LYS 707  51.180  -2.440  -4.626

  No H/Q in entry =          13
  In of MODEL   10
    1    H    LEU 708           H        LEU 708  56.737  -1.945  -7.426
    2    HA   LEU 708           HA       LEU 708  59.555  -2.598  -7.109
    3    HB2  LEU 708           HB2      LEU 708  58.728  -1.686  -9.235
    4    HB3  LEU 708           HB3      LEU 708  58.138  -0.267  -8.399
    5    HG   LEU 708           HG       LEU 708  60.540   0.211  -7.763
    6   HD11  LEU 708          HD11      LEU 708  61.082  -1.899  -9.829
    7   HD13  LEU 708          HD12      LEU 708  61.491  -1.963  -8.114
    8   HD12  LEU 708          HD13      LEU 708  62.276  -0.785  -9.162
    9   HD23  LEU 708          HD21      LEU 708  59.819   0.213 -10.690
   10   HD22  LEU 708          HD22      LEU 708  61.081   1.186  -9.940
   11   HD21  LEU 708          HD23      LEU 708  59.390   1.451  -9.509

  No H/Q in entry =          11
  In of MODEL   10
    1    H    GLN 709           H        GLN 709  60.398  -2.073  -5.197
    2    HA   GLN 709           HA       GLN 709  59.979   0.623  -4.174
    3    HB2  GLN 709           HB2      GLN 709  59.680  -0.006  -1.911
    4    HB3  GLN 709           HB3      GLN 709  58.580  -1.068  -2.775
    5    HG2  GLN 709           HG2      GLN 709  60.181  -2.900  -2.598
    6    HG3  GLN 709           HG3      GLN 709  61.341  -1.818  -1.867
    7   HE21  GLN 709          HE21      GLN 709  61.500  -3.087  -0.055
    8   HE22  GLN 709          HE22      GLN 709  60.282  -3.143   1.159

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ASN 710           H        ASN 710  61.817   1.433  -3.296
    2    HA   ASN 710           HA       ASN 710  64.046   1.627  -2.800
    3    HB2  ASN 710           HB2      ASN 710  63.430  -0.298  -1.198
    4    HB3  ASN 710           HB3      ASN 710  63.969  -1.369  -2.457
    5   HD21  ASN 710          HD21      ASN 710  65.372  -2.203  -0.992
    6   HD22  ASN 710          HD22      ASN 710  66.865  -1.417  -0.639

  No H/Q in entry =           6
  In of MODEL   10
    1    H    SER 711           H        SER 711  63.022   0.961  -5.506
    2    HA   SER 711           HA       SER 711  63.788   0.848  -7.602
    3    HB2  SER 711           HB2      SER 711  65.697   2.220  -6.727
    4    HB3  SER 711           HB3      SER 711  66.575   0.735  -6.389
    5    HG   SER 711           HG       SER 711  66.468   0.287  -8.628

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ARG 712           H        ARG 712  63.327  -1.593  -5.816
    2    HA   ARG 712           HA       ARG 712  64.282  -3.526  -7.782
    3    HB2  ARG 712           HB2      ARG 712  64.712  -5.192  -6.009
    4    HB3  ARG 712           HB3      ARG 712  65.792  -3.818  -5.872
    5    HG2  ARG 712           HG2      ARG 712  64.603  -2.963  -3.999
    6    HG3  ARG 712           HG3      ARG 712  63.278  -4.095  -4.250
    7    HD2  ARG 712           HD2      ARG 712  64.690  -4.794  -2.391
    8    HD3  ARG 712           HD3      ARG 712  64.753  -5.958  -3.705
    9    HE   ARG 712           HE       ARG 712  66.902  -4.522  -4.238
   10   HH11  ARG 712          HH11      ARG 712  65.764  -5.758  -1.109
   11   HH12  ARG 712          HH12      ARG 712  67.325  -5.963  -0.482
   12   HH21  ARG 712          HH21      ARG 712  69.032  -4.825  -3.356
   13   HH22  ARG 712          HH22      ARG 712  69.224  -5.451  -1.783

  No H/Q in entry =          13
  In of MODEL   10
    1    H    CYS 713           H        CYS 713  62.963  -5.553  -7.665
    2    HA   CYS 713           HA       CYS 713  60.232  -4.805  -6.995
    3    HB2  CYS 713           HB2      CYS 713  60.688  -5.562  -9.344
    4    HB3  CYS 713           HB3      CYS 713  61.197  -7.123  -8.697

  No H/Q in entry =           4
  In of MODEL   10
    1    H    VAL 714           H        VAL 714  59.265  -5.691  -5.369
    2    HA   VAL 714           HA       VAL 714  60.277  -8.151  -4.127
    3    HB   VAL 714           HB       VAL 714  59.910  -7.211  -1.883
    4   HG13  VAL 714          HG11      VAL 714  62.158  -7.054  -2.741
    5   HG12  VAL 714          HG12      VAL 714  61.790  -5.641  -1.751
    6   HG11  VAL 714          HG13      VAL 714  61.783  -5.513  -3.510
    7   HG22  VAL 714          HG21      VAL 714  58.190  -5.598  -2.377
    8   HG21  VAL 714          HG22      VAL 714  59.315  -4.636  -3.326
    9   HG23  VAL 714          HG23      VAL 714  59.533  -4.782  -1.575

  No H/Q in entry =           9
  In of MODEL   10
    1    H    CYS 715           H        CYS 715  58.473  -8.693  -2.324
    2    HA   CYS 715           HA       CYS 715  56.028  -8.779  -3.861
    3    HB2  CYS 715           HB2      CYS 715  56.743  -9.985  -1.178
    4    HB3  CYS 715           HB3      CYS 715  55.223 -10.236  -2.023

  No H/Q in entry =           4
  In of MODEL   10
    1    H    LYS 716           H        LYS 716  54.126  -7.922  -3.172
    2    HA   LYS 716           HA       LYS 716  54.283  -5.495  -1.661
    3    HB2  LYS 716           HB2      LYS 716  51.866  -5.299  -2.142
    4    HB3  LYS 716           HB3      LYS 716  52.762  -5.695  -3.600
    5    HG2  LYS 716           HG2      LYS 716  52.111  -8.104  -3.175
    6    HG3  LYS 716           HG3      LYS 716  51.000  -7.481  -1.958
    7    HD2  LYS 716           HD2      LYS 716  50.979  -6.727  -4.890
    8    HD3  LYS 716           HD3      LYS 716  49.912  -7.903  -4.135
    9    HE2  LYS 716           HE2      LYS 716  50.060  -4.966  -3.450
   10    HE3  LYS 716           HE3      LYS 716  48.844  -5.713  -4.478
   11    HZ1  LYS 716           HZ1      LYS 716  48.195  -7.079  -2.561
   12    HZ3  LYS 716           HZ2      LYS 716  47.948  -5.443  -2.324
   13    HZ2  LYS 716           HZ3      LYS 716  49.265  -6.210  -1.573

  No H/Q in entry =          13
  In of MODEL   10
    1    H    MET 717           H        MET 717  52.228  -5.309   0.050
    2    HA   MET 717           HA       MET 717  53.015  -7.369   1.943
    3    HB2  MET 717           HB2      MET 717  51.380  -4.882   2.472
    4    HB3  MET 717           HB3      MET 717  52.093  -5.937   3.679
    5    HG2  MET 717           HG2      MET 717  53.526  -4.111   1.763
    6    HG3  MET 717           HG3      MET 717  53.430  -3.972   3.512
    7    HE1  MET 717           HE1      MET 717  54.726  -5.567   5.199
    8    HE3  MET 717           HE2      MET 717  55.705  -6.944   4.700
    9    HE2  MET 717           HE3      MET 717  53.956  -6.980   4.478

  No H/Q in entry =           9
  In of MODEL   10
    1    HA   PRO 718           HA       PRO 718  49.297  -9.674   1.454
    2    HB2  PRO 718           HB2      PRO 718  49.025 -10.783   3.950
    3    HB3  PRO 718           HB3      PRO 718  50.188 -11.355   2.751
    4    HG2  PRO 718           HG2      PRO 718  50.621  -9.556   5.099
    5    HG3  PRO 718           HG3      PRO 718  51.650 -10.860   4.484
    6    HD2  PRO 718           HD2      PRO 718  52.169  -8.247   4.010
    7    HD3  PRO 718           HD3      PRO 718  52.579  -9.526   2.848

  No H/Q in entry =           7
  In of MODEL   10
    1    H    TYR 719           H        TYR 719  49.534  -7.567   4.223
    2    HA   TYR 719           HA       TYR 719  46.689  -7.465   4.644
    3    HB2  TYR 719           HB2      TYR 719  47.222  -5.731   6.349
    4    HB3  TYR 719           HB3      TYR 719  48.135  -7.214   6.582
    5    HD1  TYR 719           HD1      TYR 719  48.307  -3.665   5.751
    6    HD2  TYR 719           HD2      TYR 719  50.573  -7.243   6.182
    7    HE1  TYR 719           HE1      TYR 719  50.375  -2.344   5.797
    8    HE2  TYR 719           HE2      TYR 719  52.641  -5.922   6.238
    9    HH   TYR 719           HH       TYR 719  52.629  -2.545   6.590

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLU 720           H        GLU 720  48.705  -6.193   2.438
    2    HA   GLU 720           HA       GLU 720  47.393  -3.626   1.994
    3    HB2  GLU 720           HB2      GLU 720  49.826  -3.864   1.896
    4    HB3  GLU 720           HB3      GLU 720  49.685  -5.100   0.660
    5    HG2  GLU 720           HG2      GLU 720  48.488  -3.091  -0.596
    6    HG3  GLU 720           HG3      GLU 720  49.514  -2.153   0.498

  No H/Q in entry =           6
  In of MODEL   10
    1    H    CYS 721           H        CYS 721  46.651  -6.722   1.505
    2    HA   CYS 721           HA       CYS 721  45.743  -6.462  -1.257
    3    HB2  CYS 721           HB2      CYS 721  45.843  -8.844   0.585
    4    HB3  CYS 721           HB3      CYS 721  45.211  -8.856  -1.056

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLY 722           H        GLY 722  43.578  -6.946  -1.741
    2    HA3  GLY 722           HA2      GLY 722  41.682  -7.307   0.370
    3    HA2  GLY 722           HA3      GLY 722  41.566  -5.757  -0.466

  No H/Q in entry =           3
  In of MODEL   10
    1    HA   PRO 723           HA       PRO 723  39.318  -7.663  -3.763
    2    HB2  PRO 723           HB2      PRO 723  41.029  -6.238  -5.714
    3    HB3  PRO 723           HB3      PRO 723  39.287  -6.113  -5.466
    4    HG2  PRO 723           HG2      PRO 723  40.894  -4.145  -4.727
    5    HG3  PRO 723           HG3      PRO 723  39.509  -4.604  -3.720
    6    HD2  PRO 723           HD2      PRO 723  42.403  -5.301  -3.382
    7    HD3  PRO 723           HD3      PRO 723  41.226  -4.751  -2.168

  No H/Q in entry =           7
  In of MODEL   10
    1    H    SER 724           H        SER 724  39.838  -9.788  -3.825
    2    HA   SER 724           HA       SER 724  41.252 -10.833  -5.965
    3    HB2  SER 724           HB2      SER 724  42.853 -12.189  -4.411
    4    HB3  SER 724           HB3      SER 724  43.325 -10.545  -4.838
    5    HG   SER 724           HG       SER 724  42.033 -10.117  -2.776

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU 725           H        LEU 725  41.091 -13.244  -5.859
    2    HA   LEU 725           HA       LEU 725  38.461 -13.920  -4.857
    3    HB2  LEU 725           HB2      LEU 725  40.448 -15.214  -6.571
    4    HB3  LEU 725           HB3      LEU 725  39.562 -16.350  -5.570
    5    HG   LEU 725           HG       LEU 725  37.436 -15.433  -6.579
    6   HD13  LEU 725          HD11      LEU 725  37.477 -14.114  -8.516
    7   HD12  LEU 725          HD12      LEU 725  39.225 -14.138  -8.560
    8   HD11  LEU 725          HD13      LEU 725  38.391 -13.271  -7.259
    9   HD22  LEU 725          HD21      LEU 725  37.678 -16.570  -8.697
   10   HD21  LEU 725          HD22      LEU 725  38.449 -17.497  -7.402
   11   HD23  LEU 725          HD23      LEU 725  39.430 -16.542  -8.524

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ASP 726           H        ASP 726  37.915 -14.889  -2.972
    2    HA   ASP 726           HA       ASP 726  40.079 -15.508  -1.117
    3    HB2  ASP 726           HB2      ASP 726  37.654 -14.415  -0.626
    4    HB3  ASP 726           HB3      ASP 726  37.262 -16.107  -0.411

  No H/Q in entry =           4
  In of MODEL   10
    1    H    VAL 727           H        VAL 727  40.736 -17.519  -0.647
    2    HA   VAL 727           HA       VAL 727  39.156 -19.651  -1.789
    3    HB   VAL 727           HB       VAL 727  41.237 -20.734  -2.619
    4   HG11  VAL 727          HG11      VAL 727  40.522 -18.089  -3.878
    5   HG13  VAL 727          HG12      VAL 727  39.735 -19.638  -4.182
    6   HG12  VAL 727          HG13      VAL 727  41.403 -19.383  -4.690
    7   HG21  VAL 727          HG21      VAL 727  42.850 -19.472  -1.294
    8   HG23  VAL 727          HG22      VAL 727  42.505 -18.027  -2.244
    9   HG22  VAL 727          HG23      VAL 727  43.241 -19.446  -3.005

  No H/Q in entry =           9
  In of MODEL   10
    1    H    CYS 728           H        CYS 728  40.152 -21.899  -1.107
    2    HA   CYS 728           HA       CYS 728  40.766 -21.771   1.757
    3    HB2  CYS 728           HB2      CYS 728  39.906 -24.114   0.045
    4    HB3  CYS 728           HB3      CYS 728  40.195 -24.172   1.774

  No H/Q in entry =           4
  In of MODEL   10
    1    H    ALA 729           H        ALA 729  42.767 -22.020   2.372
    2    HA   ALA 729           HA       ALA 729  44.555 -23.624   0.688
    3    HB1  ALA 729           HB1      ALA 729  45.197 -21.153   2.268
    4    HB3  ALA 729           HB2      ALA 729  45.093 -21.244   0.507
    5    HB2  ALA 729           HB3      ALA 729  46.366 -22.116   1.366

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLN 730           H        GLN 730  46.189 -24.706   1.865
    2    HA   GLN 730           HA       GLN 730  45.416 -25.223   4.629
    3    HB2  GLN 730           HB2      GLN 730  45.412 -27.202   3.195
    4    HB3  GLN 730           HB3      GLN 730  47.089 -26.902   2.770
    5    HG2  GLN 730           HG2      GLN 730  47.770 -27.235   5.059
    6    HG3  GLN 730           HG3      GLN 730  46.108 -27.475   5.562
    7   HE21  GLN 730          HE21      GLN 730  46.421 -29.533   6.299
    8   HE22  GLN 730          HE22      GLN 730  46.806 -30.872   5.273

  No H/Q in entry =           8
  In of MODEL   10
    1    H    ASP 731           H        ASP 731  46.586 -24.566   6.115
    2    HA   ASP 731           HA       ASP 731  49.006 -23.093   5.756
    3    HB2  ASP 731           HB2      ASP 731  47.359 -22.497   7.469
    4    HB3  ASP 731           HB3      ASP 731  47.543 -24.080   8.204

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLU 732           H        GLU 732  51.015 -24.003   5.659
    2    HA   GLU 732           HA       GLU 732  51.224 -26.803   6.201
    3    HB2  GLU 732           HB2      GLU 732  53.194 -24.839   5.065
    4    HB3  GLU 732           HB3      GLU 732  53.595 -26.517   5.418
    5    HG2  GLU 732           HG2      GLU 732  51.458 -25.577   3.533
    6    HG3  GLU 732           HG3      GLU 732  53.024 -26.264   3.093

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ARG 733           H        ARG 733  51.195 -24.535   8.471
    2    HA   ARG 733           HA       ARG 733  53.484 -25.603   9.880
    3    HB2  ARG 733           HB2      ARG 733  51.607 -23.322  10.439
    4    HB3  ARG 733           HB3      ARG 733  52.975 -23.774  11.435
    5    HG2  ARG 733           HG2      ARG 733  53.127 -22.788   8.585
    6    HG3  ARG 733           HG3      ARG 733  53.422 -21.806  10.016
    7    HD2  ARG 733           HD2      ARG 733  55.014 -24.217   9.149
    8    HD3  ARG 733           HD3      ARG 733  55.511 -22.533   9.009
    9    HE   ARG 733           HE       ARG 733  54.971 -23.784  11.618
   10   HH11  ARG 733          HH11      ARG 733  57.097 -21.828   9.539
   11   HH12  ARG 733          HH12      ARG 733  58.263 -21.605  10.739
   12   HH21  ARG 733          HH21      ARG 733  56.585 -23.495  13.232
   13   HH22  ARG 733          HH22      ARG 733  57.992 -22.585  12.885

  No H/Q in entry =          13
  In of MODEL   10
    1    H    SER 734           H        SER 734  50.050 -24.899  10.214
    2    HA   SER 734           HA       SER 734  49.844 -26.776  12.457
    3    HB2  SER 734           HB2      SER 734  49.018 -24.467  12.730
    4    HB3  SER 734           HB3      SER 734  47.888 -24.714  11.411
    5    HG   SER 734           HG       SER 734  47.369 -26.657  13.080

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LYS 735           H        LYS 735  49.357 -26.732   9.118
    2    HA   LYS 735           HA       LYS 735  48.416 -28.047   7.591
    3    HB2  LYS 735           HB2      LYS 735  47.844 -29.991   9.839
    4    HB3  LYS 735           HB3      LYS 735  47.828 -30.362   8.124
    5    HG2  LYS 735           HG2      LYS 735  50.235 -29.532   9.733
    6    HG3  LYS 735           HG3      LYS 735  49.865 -31.164   9.194
    7    HD2  LYS 735           HD2      LYS 735  50.383 -28.804   7.370
    8    HD3  LYS 735           HD3      LYS 735  51.575 -30.013   7.810
    9    HE2  LYS 735           HE2      LYS 735  50.042 -31.746   6.825
   10    HE3  LYS 735           HE3      LYS 735  49.038 -30.426   6.234
   11    HZ3  LYS 735           HZ1      LYS 735  50.519 -31.144   4.507
   12    HZ2  LYS 735           HZ2      LYS 735  51.837 -31.024   5.509
   13    HZ1  LYS 735           HZ3      LYS 735  51.099 -29.626   4.982

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ARG 736           H        ARG 736  46.828 -26.194   9.201
    2    HA   ARG 736           HA       ARG 736  44.152 -27.278   9.165
    3    HB2  ARG 736           HB2      ARG 736  43.514 -25.068  10.095
    4    HB3  ARG 736           HB3      ARG 736  44.743 -25.898  11.045
    5    HG2  ARG 736           HG2      ARG 736  46.466 -24.541   9.985
    6    HG3  ARG 736           HG3      ARG 736  45.219 -23.700   9.075
    7    HD2  ARG 736           HD2      ARG 736  45.345 -23.791  12.070
    8    HD3  ARG 736           HD3      ARG 736  46.066 -22.550  11.046
    9    HE   ARG 736           HE       ARG 736  43.187 -23.100  10.922
   10   HH11  ARG 736          HH11      ARG 736  45.834 -20.785  11.451
   11   HH12  ARG 736          HH12      ARG 736  44.800 -19.463  11.687
   12   HH21  ARG 736          HH21      ARG 736  41.787 -21.245  11.209
   13   HH22  ARG 736          HH22      ARG 736  42.466 -19.714  11.562

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ILE 737           H        ILE 737  42.486 -26.505   7.824
    2    HA   ILE 737           HA       ILE 737  43.372 -25.178   5.385
    3    HB   ILE 737           HB       ILE 737  40.559 -26.066   6.085
    4   HG12  ILE 737          HG12      ILE 737  42.145 -28.008   6.213
    5   HG13  ILE 737          HG13      ILE 737  40.955 -28.168   4.930
    6   HG22  ILE 737          HG21      ILE 737  41.904 -25.679   3.406
    7   HG21  ILE 737          HG22      ILE 737  40.972 -24.447   4.218
    8   HG23  ILE 737          HG23      ILE 737  40.181 -25.946   3.698
    9   HD12  ILE 737          HD11      ILE 737  43.824 -27.337   4.631
   10   HD11  ILE 737          HD12      ILE 737  42.626 -27.416   3.333
   11   HD13  ILE 737          HD13      ILE 737  43.120 -28.895   4.165

  No H/Q in entry =          11
  In of MODEL   10
    1    H    LEU 738           H        LEU 738  43.115 -23.040   5.194
    2    HA   LEU 738           HA       LEU 738  41.034 -21.767   6.780
    3    HB2  LEU 738           HB2      LEU 738  42.400 -19.977   7.550
    4    HB3  LEU 738           HB3      LEU 738  43.208 -21.462   7.998
    5    HG   LEU 738           HG       LEU 738  43.984 -19.549   5.795
    6   HD12  LEU 738          HD11      LEU 738  45.985 -19.182   7.159
    7   HD11  LEU 738          HD12      LEU 738  45.290 -20.204   8.419
    8   HD13  LEU 738          HD13      LEU 738  44.495 -18.697   7.960
    9   HD21  LEU 738          HD21      LEU 738  44.461 -21.814   5.169
   10   HD23  LEU 738          HD22      LEU 738  45.355 -22.074   6.672
   11   HD22  LEU 738          HD23      LEU 738  45.949 -20.914   5.454

  No H/Q in entry =          11
  In of MODEL   10
    1    HA   PRO 739           HA       PRO 739  40.152 -19.500   3.037
    2    HB2  PRO 739           HB2      PRO 739  39.031 -17.292   4.116
    3    HB3  PRO 739           HB3      PRO 739  38.210 -18.864   4.115
    4    HG2  PRO 739           HG2      PRO 739  39.733 -17.535   6.321
    5    HG3  PRO 739           HG3      PRO 739  38.168 -18.371   6.385
    6    HD2  PRO 739           HD2      PRO 739  40.511 -19.579   7.113
    7    HD3  PRO 739           HD3      PRO 739  39.148 -20.466   6.383

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LEU 740           H        LEU 740  41.782 -18.633   1.969
    2    HA   LEU 740           HA       LEU 740  43.106 -16.205   2.954
    3    HB2  LEU 740           HB2      LEU 740  44.402 -18.552   1.590
    4    HB3  LEU 740           HB3      LEU 740  45.134 -16.969   1.690
    5    HG   LEU 740           HG       LEU 740  44.487 -18.754   4.024
    6   HD12  LEU 740          HD11      LEU 740  47.088 -17.982   2.719
    7   HD11  LEU 740          HD12      LEU 740  46.296 -19.552   2.610
    8   HD13  LEU 740          HD13      LEU 740  46.912 -18.987   4.166
    9   HD21  LEU 740          HD21      LEU 740  45.892 -16.081   3.878
   10   HD23  LEU 740          HD22      LEU 740  45.813 -17.110   5.306
   11   HD22  LEU 740          HD23      LEU 740  44.337 -16.400   4.651

  No H/Q in entry =          11
  In of MODEL   10
    1    H    THR 741           H        THR 741  43.298 -14.700   1.404
    2    HA   THR 741           HA       THR 741  41.864 -15.271  -1.037
    3    HB   THR 741           HB       THR 741  43.110 -12.622  -0.482
    4    HG1  THR 741           HG1      THR 741  41.025 -13.752   1.114
    5   HG22  THR 741          HG21      THR 741  40.246 -13.430  -1.005
    6   HG21  THR 741          HG22      THR 741  41.408 -12.984  -2.248
    7   HG23  THR 741          HG23      THR 741  40.901 -11.794  -1.048

  No H/Q in entry =           7
  In of MODEL   10
    1    H    VAL 742           H        VAL 742  42.739 -14.873  -3.087
    2    HA   VAL 742           HA       VAL 742  45.087 -16.052  -3.787
    3    HB   VAL 742           HB       VAL 742  43.806 -13.761  -5.291
    4   HG12  VAL 742          HG11      VAL 742  44.752 -14.710  -7.271
    5   HG11  VAL 742          HG12      VAL 742  45.623 -15.915  -6.310
    6   HG13  VAL 742          HG13      VAL 742  45.992 -14.189  -6.137
    7   HG21  VAL 742          HG21      VAL 742  43.343 -16.706  -5.468
    8   HG23  VAL 742          HG22      VAL 742  42.705 -15.473  -6.570
    9   HG22  VAL 742          HG23      VAL 742  42.214 -15.473  -4.871

  No H/Q in entry =           9
  In of MODEL   10
    1    H    CYS 743           H        CYS 743  44.683 -12.535  -3.399
    2    HA   CYS 743           HA       CYS 743  47.303 -11.877  -4.088
    3    HB2  CYS 743           HB2      CYS 743  45.457 -10.227  -3.966
    4    HB3  CYS 743           HB3      CYS 743  45.469 -10.381  -2.213

  No H/Q in entry =           4
  In of MODEL   10
    1    H    LYS 744           H        LYS 744  45.849 -12.503  -0.921
    2    HA   LYS 744           HA       LYS 744  48.154 -11.847   0.569
    3    HB2  LYS 744           HB2      LYS 744  45.770 -13.542   1.328
    4    HB3  LYS 744           HB3      LYS 744  46.973 -12.895   2.440
    5    HG2  LYS 744           HG2      LYS 744  46.337 -10.616   1.808
    6    HG3  LYS 744           HG3      LYS 744  45.164 -11.248   0.665
    7    HD2  LYS 744           HD2      LYS 744  43.967 -10.535   2.598
    8    HD3  LYS 744           HD3      LYS 744  43.979 -12.294   2.623
    9    HE2  LYS 744           HE2      LYS 744  45.692 -12.313   4.314
   10    HE3  LYS 744           HE3      LYS 744  45.902 -10.566   4.182
   11    HZ1  LYS 744           HZ1      LYS 744  43.428 -11.930   5.142
   12    HZ3  LYS 744           HZ2      LYS 744  43.647 -10.272   4.998
   13    HZ2  LYS 744           HZ3      LYS 744  44.548 -11.118   6.116

  No H/Q in entry =          13
  In of MODEL   10
    1    H    MET 745           H        MET 745  46.771 -14.907  -0.485
    2    HA   MET 745           HA       MET 745  48.703 -16.630   0.641
    3    HB2  MET 745           HB2      MET 745  47.119 -18.063  -0.064
    4    HB3  MET 745           HB3      MET 745  46.370 -16.813  -1.025
    5    HG2  MET 745           HG2      MET 745  46.768 -18.548  -2.542
    6    HG3  MET 745           HG3      MET 745  48.067 -17.410  -2.830
    7    HE2  MET 745           HE1      MET 745  48.490 -21.489  -0.728
    8    HE1  MET 745           HE2      MET 745  47.016 -20.840  -1.453
    9    HE3  MET 745           HE3      MET 745  47.650 -20.136   0.030

  No H/Q in entry =           9
  In of MODEL   10
    1    H    HIS 746           H        HIS 746  48.616 -14.951  -2.476
    2    HA   HIS 746           HA       HIS 746  50.930 -16.343  -3.495
    3    HB2  HIS 746           HB2      HIS 746  49.348 -14.038  -4.423
    4    HB3  HIS 746           HB3      HIS 746  51.029 -14.062  -4.952
    5    HD1  HIS 746           HD1      HIS 746  51.705 -16.184  -6.444
    6    HD2  HIS 746           HD2      HIS 746  47.649 -15.644  -5.776
    7    HE1  HIS 746           HE1      HIS 746  50.558 -17.475  -8.254
    8    HE2  HIS 746           HE2      HIS 746  48.088 -17.205  -7.782

  No H/Q in entry =           8
  In of MODEL   10
    1    H    VAL 747           H        VAL 747  50.403 -13.288  -1.924
    2    HA   VAL 747           HA       VAL 747  53.028 -12.373  -2.040
    3    HB   VAL 747           HB       VAL 747  50.679 -11.702  -0.288
    4   HG11  VAL 747          HG11      VAL 747  52.735 -11.371   1.066
    5   HG13  VAL 747          HG12      VAL 747  51.981  -9.842   0.637
    6   HG12  VAL 747          HG13      VAL 747  53.416 -10.391  -0.233
    7   HG21  VAL 747          HG21      VAL 747  50.652 -11.017  -2.599
    8   HG23  VAL 747          HG22      VAL 747  52.225 -10.254  -2.391
    9   HG22  VAL 747          HG23      VAL 747  50.813  -9.616  -1.532

  No H/Q in entry =           9
  In of MODEL   10
    1    H    LEU 748           H        LEU 748  51.292 -13.990   0.624
    2    HA   LEU 748           HA       LEU 748  53.602 -14.087   2.177
    3    HB2  LEU 748           HB2      LEU 748  52.399 -15.794   3.601
    4    HB3  LEU 748           HB3      LEU 748  51.535 -14.297   3.346
    5    HG   LEU 748           HG       LEU 748  50.143 -15.520   1.657
    6   HD12  LEU 748          HD11      LEU 748  50.043 -17.953   1.828
    7   HD11  LEU 748          HD12      LEU 748  51.465 -17.923   2.870
    8   HD13  LEU 748          HD13      LEU 748  51.590 -17.394   1.193
    9   HD21  LEU 748          HD21      LEU 748  50.095 -16.467   4.513
   10   HD23  LEU 748          HD22      LEU 748  48.762 -16.603   3.369
   11   HD22  LEU 748          HD23      LEU 748  49.330 -15.011   3.876

  No H/Q in entry =          11
  In of MODEL   10
    1    H    HIS 749           H        HIS 749  52.478 -16.157  -0.323
    2    HA   HIS 749           HA       HIS 749  54.147 -18.372   0.173
    3    HB2  HIS 749           HB2      HIS 749  52.173 -18.270  -1.423
    4    HB3  HIS 749           HB3      HIS 749  53.230 -17.426  -2.543
    5    HD1  HIS 749           HD1      HIS 749  55.185 -18.855  -3.631
    6    HD2  HIS 749           HD2      HIS 749  52.524 -20.959  -1.249
    7    HE1  HIS 749           HE1      HIS 749  55.615 -21.247  -4.129
    8    HE2  HIS 749           HE2      HIS 749  54.254 -22.484  -2.449

  No H/Q in entry =           8
  In of MODEL   10
    1    H    CYS 750           H        CYS 750  54.594 -15.384  -1.746
    2    HA   CYS 750           HA       CYS 750  57.147 -16.308  -2.613
    3    HB2  CYS 750           HB2      CYS 750  57.403 -14.125  -3.726
    4    HB3  CYS 750           HB3      CYS 750  55.876 -14.894  -4.127

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLN 751           H        GLN 751  55.956 -14.533   0.112
    2    HA   GLN 751           HA       GLN 751  58.430 -13.399   0.837
    3    HB2  GLN 751           HB2      GLN 751  56.023 -14.106   2.521
    4    HB3  GLN 751           HB3      GLN 751  57.379 -13.138   3.076
    5    HG2  GLN 751           HG2      GLN 751  55.612 -12.409   0.761
    6    HG3  GLN 751           HG3      GLN 751  55.376 -11.830   2.400
    7   HE21  GLN 751          HE21      GLN 751  55.595  -9.732   1.681
    8   HE22  GLN 751          HE22      GLN 751  57.122  -9.024   1.300

  No H/Q in entry =           8
  In of MODEL   10
    1    H    GLY 752           H        GLY 752  57.145 -16.584   1.014
    2    HA3  GLY 752           HA2      GLY 752  59.038 -18.219   1.289
    3    HA2  GLY 752           HA3      GLY 752  59.384 -17.356   2.775

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ARG 753           H        ARG 753  56.098 -17.461   2.408
    2    HA   ARG 753           HA       ARG 753  55.864 -19.508   4.444
    3    HB2  ARG 753           HB2      ARG 753  53.810 -17.736   3.114
    4    HB3  ARG 753           HB3      ARG 753  53.491 -18.819   4.460
    5    HG2  ARG 753           HG2      ARG 753  55.533 -16.637   4.619
    6    HG3  ARG 753           HG3      ARG 753  53.842 -16.336   4.958
    7    HD2  ARG 753           HD2      ARG 753  55.487 -18.450   6.365
    8    HD3  ARG 753           HD3      ARG 753  55.148 -16.854   7.030
    9    HE   ARG 753           HE       ARG 753  52.774 -18.184   6.240
   10   HH11  ARG 753          HH11      ARG 753  55.147 -18.151   8.851
   11   HH12  ARG 753          HH12      ARG 753  54.054 -18.602  10.066
   12   HH21  ARG 753          HH21      ARG 753  51.223 -18.840   7.909
   13   HH22  ARG 753          HH22      ARG 753  51.763 -19.015   9.503

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ASN 754           H        ASN 754  54.772 -21.444   4.169
    2    HA   ASN 754           HA       ASN 754  54.223 -22.140   1.384
    3    HB2  ASN 754           HB2      ASN 754  55.013 -23.977   3.655
    4    HB3  ASN 754           HB3      ASN 754  54.462 -24.534   2.088
    5   HD21  ASN 754          HD21      ASN 754  57.034 -23.243   3.885
    6   HD22  ASN 754          HD22      ASN 754  58.244 -23.318   2.652

  No H/Q in entry =           6
  In of MODEL   10
    1    H    TYR 755           H        TYR 755  52.278 -22.469   0.830
    2    HA   TYR 755           HA       TYR 755  50.411 -23.556   2.723
    3    HB2  TYR 755           HB2      TYR 755  49.987 -21.003   1.184
    4    HB3  TYR 755           HB3      TYR 755  48.660 -22.051   1.695
    5    HD1  TYR 755           HD1      TYR 755  47.813 -21.893   3.882
    6    HD2  TYR 755           HD2      TYR 755  51.520 -20.054   2.992
    7    HE1  TYR 755           HE1      TYR 755  47.829 -20.844   6.101
    8    HE2  TYR 755           HE2      TYR 755  51.535 -18.992   5.199
    9    HH   TYR 755           HH       TYR 755  49.459 -20.052   7.640

  No H/Q in entry =           9
  In of MODEL   10
    1    H    THR 756           H        THR 756  49.239 -24.979   1.892
    2    HA   THR 756           HA       THR 756  49.718 -25.716  -0.863
    3    HB   THR 756           HB       THR 756  48.468 -27.118   1.488
    4    HG1  THR 756           HG1      THR 756  50.416 -27.560   1.900
    5   HG23  THR 756          HG21      THR 756  47.447 -27.878  -0.560
    6   HG22  THR 756          HG22      THR 756  48.498 -29.151   0.096
    7   HG21  THR 756          HG23      THR 756  49.029 -28.158  -1.281

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LEU 757           H        LEU 757  48.050 -25.860  -2.375
    2    HA   LEU 757           HA       LEU 757  45.641 -24.464  -1.673
    3    HB2  LEU 757           HB2      LEU 757  46.709 -25.475  -4.294
    4    HB3  LEU 757           HB3      LEU 757  45.053 -24.929  -4.137
    5    HG   LEU 757           HG       LEU 757  46.288 -23.160  -5.073
    6   HD13  LEU 757          HD11      LEU 757  46.024 -21.381  -3.428
    7   HD12  LEU 757          HD12      LEU 757  45.847 -22.579  -2.160
    8   HD11  LEU 757          HD13      LEU 757  44.651 -22.485  -3.457
    9   HD21  LEU 757          HD21      LEU 757  48.558 -23.847  -4.467
   10   HD23  LEU 757          HD22      LEU 757  48.252 -23.414  -2.786
   11   HD22  LEU 757          HD23      LEU 757  48.278 -22.162  -4.028

  No H/Q in entry =          11
  In of MODEL   10
    1    H    THR 758           H        THR 758  43.766 -25.274  -1.354
    2    HA   THR 758           HA       THR 758  43.432 -28.130  -1.762
    3    HB   THR 758           HB       THR 758  41.931 -27.990   0.338
    4    HG1  THR 758           HG1      THR 758  42.596 -25.458   0.222
    5   HG22  THR 758          HG21      THR 758  44.927 -27.683   0.639
    6   HG21  THR 758          HG22      THR 758  44.076 -29.187   0.291
    7   HG23  THR 758          HG23      THR 758  43.842 -28.385   1.841

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLY 759           H        GLY 759  40.832 -28.464  -1.310
    2    HA3  GLY 759           HA2      GLY 759  39.730 -27.010  -3.527
    3    HA2  GLY 759           HA3      GLY 759  38.968 -28.331  -2.657

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ARG 760           H        ARG 760  37.715 -25.972  -3.454
    2    HA   ARG 760           HA       ARG 760  37.399 -24.035  -1.444
    3    HB2  ARG 760           HB2      ARG 760  35.343 -23.403  -2.637
    4    HB3  ARG 760           HB3      ARG 760  36.645 -23.723  -3.771
    5    HG2  ARG 760           HG2      ARG 760  34.916 -24.814  -4.828
    6    HG3  ARG 760           HG3      ARG 760  35.546 -26.126  -3.827
    7    HD2  ARG 760           HD2      ARG 760  33.834 -25.401  -2.080
    8    HD3  ARG 760           HD3      ARG 760  33.101 -24.438  -3.361
    9    HE   ARG 760           HE       ARG 760  33.487 -27.346  -3.504
   10   HH11  ARG 760          HH11      ARG 760  31.419 -24.489  -4.061
   11   HH12  ARG 760          HH12      ARG 760  30.089 -25.390  -4.606
   12   HH21  ARG 760          HH21      ARG 760  31.614 -28.563  -4.282
   13   HH22  ARG 760          HH22      ARG 760  30.202 -27.754  -4.756

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ASP 761           H        ASP 761  36.437 -27.236  -1.493
    2    HA   ASP 761           HA       ASP 761  34.111 -27.068   0.194
    3    HB2  ASP 761           HB2      ASP 761  35.800 -29.377  -0.759
    4    HB3  ASP 761           HB3      ASP 761  34.373 -29.582   0.244

  No H/Q in entry =           4
  In of MODEL   10
    1    H    SER 762           H        SER 762  37.497 -27.078   0.678
    2    HA   SER 762           HA       SER 762  37.455 -28.581   3.091
    3    HB2  SER 762           HB2      SER 762  39.664 -26.972   1.833
    4    HB3  SER 762           HB3      SER 762  39.847 -28.093   3.183
    5    HG   SER 762           HG       SER 762  39.208 -29.749   1.893

  No H/Q in entry =           5
  In of MODEL   10
    1    H    CYS 763           H        CYS 763  37.128 -25.149   2.427
    2    HA   CYS 763           HA       CYS 763  37.120 -24.786   5.342
    3    HB2  CYS 763           HB2      CYS 763  38.167 -22.675   5.226
    4    HB3  CYS 763           HB3      CYS 763  39.165 -23.746   4.262

  No H/Q in entry =           4
  In of MODEL   10
    1    H    THR 764           H        THR 764  35.972 -22.676   5.917
    2    HA   THR 764           HA       THR 764  33.509 -22.550   4.407
    3    HB   THR 764           HB       THR 764  34.323 -21.057   6.930
    4    HG1  THR 764           HG1      THR 764  33.111 -23.565   6.487
    5   HG21  THR 764          HG21      THR 764  32.422 -20.081   5.701
    6   HG23  THR 764          HG22      THR 764  31.907 -20.764   7.243
    7   HG22  THR 764          HG23      THR 764  31.598 -21.642   5.741

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LEU 765           H        LEU 765  33.802 -21.480   2.619
    2    HA   LEU 765           HA       LEU 765  35.525 -19.170   2.622
    3    HB2  LEU 765           HB2      LEU 765  35.537 -21.172   0.981
    4    HB3  LEU 765           HB3      LEU 765  34.168 -20.342   0.256
    5    HG   LEU 765           HG       LEU 765  35.650 -18.359  -0.072
    6   HD12  LEU 765          HD11      LEU 765  38.025 -18.668   0.185
    7   HD11  LEU 765          HD12      LEU 765  37.713 -20.248   0.944
    8   HD13  LEU 765          HD13      LEU 765  37.163 -18.775   1.720
    9   HD23  LEU 765          HD21      LEU 765  36.624 -20.958  -1.263
   10   HD22  LEU 765          HD22      LEU 765  36.879 -19.340  -1.921
   11   HD21  LEU 765          HD23      LEU 765  35.254 -20.017  -1.854

  No H/Q in entry =          11
  In of MODEL   10
    1    HA   PRO 766           HA       PRO 766  31.880 -16.569   2.548
    2    HB2  PRO 766           HB2      PRO 766  33.151 -14.226   2.023
    3    HB3  PRO 766           HB3      PRO 766  33.102 -14.962   3.628
    4    HG2  PRO 766           HG2      PRO 766  35.299 -14.863   1.638
    5    HG3  PRO 766           HG3      PRO 766  35.382 -14.898   3.407
    6    HD2  PRO 766           HD2      PRO 766  35.838 -17.045   1.713
    7    HD3  PRO 766           HD3      PRO 766  35.466 -17.183   3.435

  No H/Q in entry =           7
  In of MODEL   10
    1    H    ALA 767           H        ALA 767  34.290 -16.481   0.004
    2    HA   ALA 767           HA       ALA 767  32.283 -15.323  -1.769
    3    HB1  ALA 767           HB1      ALA 767  35.215 -15.566  -2.310
    4    HB2  ALA 767           HB2      ALA 767  34.435 -14.151  -1.582
    5    HB3  ALA 767           HB3      ALA 767  34.000 -14.661  -3.232

  No H/Q in entry =           5
  In of MODEL   10
    1    H    SER 768           H        SER 768  31.198 -17.020  -1.725
    2    HA   SER 768           HA       SER 768  31.452 -18.443  -4.169
    3    HB2  SER 768           HB2      SER 768  31.500 -19.952  -1.537
    4    HB3  SER 768           HB3      SER 768  31.033 -20.658  -3.087
    5    HG   SER 768           HG       SER 768  33.508 -19.386  -2.573

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA 769           H        ALA 769  29.790 -16.481  -2.891
    2    HA   ALA 769           HA       ALA 769  27.202 -17.816  -2.973
    3    HB1  ALA 769           HB1      ALA 769  28.047 -15.847  -0.840
    4    HB3  ALA 769           HB2      ALA 769  27.769 -17.570  -0.595
    5    HB2  ALA 769           HB3      ALA 769  26.428 -16.515  -1.040

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLU 770           H        GLU 770  25.534 -15.829  -2.773
    2    HA   GLU 770           HA       GLU 770  26.151 -14.162  -5.034
    3    HB2  GLU 770           HB2      GLU 770  23.776 -13.556  -4.884
    4    HB3  GLU 770           HB3      GLU 770  24.004 -15.299  -4.937
    5    HG2  GLU 770           HG2      GLU 770  23.779 -15.354  -2.476
    6    HG3  GLU 770           HG3      GLU 770  23.431 -13.633  -2.505

  No H/Q in entry =           6
  In of MODEL   10
    1    H    LYS 771           H        LYS 771  25.829 -11.829  -4.892
    2    HA   LYS 771           HA       LYS 771  25.995 -10.774  -2.181
    3    HB2  LYS 771           HB2      LYS 771  27.778  -9.954  -4.499
    4    HB3  LYS 771           HB3      LYS 771  27.721  -9.134  -2.943
    5    HG2  LYS 771           HG2      LYS 771  28.527 -12.013  -3.353
    6    HG3  LYS 771           HG3      LYS 771  29.647 -10.667  -3.122
    7    HD2  LYS 771           HD2      LYS 771  29.029 -10.378  -0.897
    8    HD3  LYS 771           HD3      LYS 771  27.486 -11.188  -1.096
    9    HE2  LYS 771           HE2      LYS 771  28.633 -13.308  -1.388
   10    HE3  LYS 771           HE3      LYS 771  30.196 -12.512  -1.123
   11    HZ2  LYS 771           HZ1      LYS 771  29.318 -13.552   0.929
   12    HZ1  LYS 771           HZ2      LYS 771  27.941 -12.602   0.818
   13    HZ3  LYS 771           HZ3      LYS 771  29.445 -11.887   1.070

  No H/Q in entry =          13
  In of MODEL   10
    1    H    ALA 772           H        ALA 772  25.235  -8.692  -1.896
    2    HA   ALA 772           HA       ALA 772  23.511  -7.749  -4.060
    3    HB1  ALA 772           HB1      ALA 772  21.793  -7.257  -2.418
    4    HB3  ALA 772           HB2      ALA 772  22.813  -7.910  -1.131
    5    HB2  ALA 772           HB3      ALA 772  22.189  -8.976  -2.390

  No H/Q in entry =           5
  In of MODEL   10
    1    H    CYS 773           H        CYS 773  22.716  -5.452  -3.450
    2    HA   CYS 773           HA       CYS 773  24.960  -3.796  -3.376
    3    HB2  CYS 773           HB2      CYS 773  22.089  -3.028  -2.783
    4    HB3  CYS 773           HB3      CYS 773  23.394  -1.930  -3.215

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLY 774           H        GLY 774  26.160  -3.128  -1.795
    2    HA3  GLY 774           HA2      GLY 774  26.130  -2.122   0.491
    3    HA2  GLY 774           HA3      GLY 774  25.249  -3.579   0.960

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ALA 775           H        ALA 775  26.800  -5.187  -0.986
    2    HA   ALA 775           HA       ALA 775  29.541  -4.910  -0.204
    3    HB1  ALA 775           HB1      ALA 775  29.732  -7.210   0.656
    4    HB3  ALA 775           HB2      ALA 775  27.986  -7.412   0.508
    5    HB2  ALA 775           HB3      ALA 775  28.643  -6.249   1.660

  No H/Q in entry =           5
  In of MODEL   10
    1    H    CYS 776           H        CYS 776  30.208  -4.794  -2.240
    2    HA   CYS 776           HA       CYS 776  29.640  -7.064  -3.975
    3    HB2  CYS 776           HB2      CYS 776  29.577  -4.141  -4.806
    4    HB3  CYS 776           HB3      CYS 776  29.541  -5.493  -5.924

  No H/Q in entry =           4
  In of MODEL   10
    1    HA   PRO 777           HA       PRO 777  34.139  -6.683  -3.912
    2    HB2  PRO 777           HB2      PRO 777  34.044  -9.039  -5.679
    3    HB3  PRO 777           HB3      PRO 777  34.802  -8.869  -4.093
    4    HG2  PRO 777           HG2      PRO 777  32.593 -10.352  -4.434
    5    HG3  PRO 777           HG3      PRO 777  32.862  -9.406  -2.958
    6    HD2  PRO 777           HD2      PRO 777  31.139  -8.765  -5.327
    7    HD3  PRO 777           HD3      PRO 777  30.800  -8.588  -3.587

  No H/Q in entry =           7
  In of MODEL   10
    1    H    LEU 778           H        LEU 778  35.747  -7.226  -5.946
    2    HA   LEU 778           HA       LEU 778  35.268  -5.106  -7.673
    3    HB2  LEU 778           HB2      LEU 778  37.352  -5.712  -8.880
    4    HB3  LEU 778           HB3      LEU 778  37.513  -5.541  -7.154
    5    HG   LEU 778           HG       LEU 778  38.972  -7.271  -7.956
    6   HD13  LEU 778          HD11      LEU 778  38.403  -9.164  -6.612
    7   HD12  LEU 778          HD12      LEU 778  36.743  -8.611  -6.491
    8   HD11  LEU 778          HD13      LEU 778  38.035  -7.665  -5.752
    9   HD21  LEU 778          HD21      LEU 778  37.856  -7.928 -10.004
   10   HD23  LEU 778          HD22      LEU 778  36.551  -8.651  -9.053
   11   HD22  LEU 778          HD23      LEU 778  38.169  -9.345  -8.991

  No H/Q in entry =          11
  In of MODEL   10
    1    H    TRP 779           H        TRP 779  34.217  -8.280  -8.035
    2    HA   TRP 779           HA       TRP 779  33.697  -7.905 -10.885
    3    HB2  TRP 779           HB2      TRP 779  32.881 -10.295 -10.765
    4    HB3  TRP 779           HB3      TRP 779  34.592 -10.075 -10.414
    5    HD1  TRP 779           HD1      TRP 779  31.253 -10.795  -8.585
    6    HE1  TRP 779           HE1      TRP 779  31.814 -11.963  -6.345
    7    HE3  TRP 779           HE3      TRP 779  36.339 -10.562  -8.755
    8    HZ2  TRP 779           HZ2      TRP 779  34.091 -12.661  -4.882
    9    HZ3  TRP 779           HZ3      TRP 779  37.624 -11.474  -6.909
   10    HH2  TRP 779           HH2      TRP 779  36.527 -12.530  -5.003

  No H/Q in entry =          10
  In of MODEL   10
    1    H    GLY 780           H        GLY 780  32.269  -7.000  -8.116
    2    HA3  GLY 780           HA2      GLY 780  29.545  -7.664  -8.999
    3    HA2  GLY 780           HA3      GLY 780  30.000  -7.235  -7.351

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LYS 781           H        LYS 781  27.986  -5.962  -8.979
    2    HA   LYS 781           HA       LYS 781  28.970  -3.221  -8.804
    3    HB2  LYS 781           HB2      LYS 781  29.463  -4.277 -11.086
    4    HB3  LYS 781           HB3      LYS 781  27.721  -4.210 -11.324
    5    HG2  LYS 781           HG2      LYS 781  28.901  -2.336 -12.370
    6    HG3  LYS 781           HG3      LYS 781  27.755  -1.803 -11.136
    7    HD2  LYS 781           HD2      LYS 781  29.459  -1.326  -9.594
    8    HD3  LYS 781           HD3      LYS 781  30.650  -2.271 -10.483
    9    HE2  LYS 781           HE2      LYS 781  30.906   0.184 -10.597
   10    HE3  LYS 781           HE3      LYS 781  30.820  -0.613 -12.165
   11    HZ1  LYS 781           HZ1      LYS 781  28.576   0.843 -10.824
   12    HZ3  LYS 781           HZ2      LYS 781  28.517   0.121 -12.363
   13    HZ2  LYS 781           HZ3      LYS 781  29.512   1.422 -12.093

  No H/Q in entry =          13
  In of MODEL   10
    1    H    CYS 782           H        CYS 782  27.348  -2.260  -7.733
    2    HA   CYS 782           HA       CYS 782  24.582  -3.105  -8.181
    3    HB2  CYS 782           HB2      CYS 782  25.351  -2.699  -5.797
    4    HB3  CYS 782           HB3      CYS 782  25.686  -1.027  -6.225

  No H/Q in entry =           4
  In of MODEL   10
    1    H    ASP 783           H        ASP 783  24.084  -2.340 -10.161
    2    HA   ASP 783           HA       ASP 783  25.375  -0.001 -11.163
    3    HB2  ASP 783           HB2      ASP 783  24.498  -0.538 -13.289
    4    HB3  ASP 783           HB3      ASP 783  24.916  -2.064 -12.525

  No H/Q in entry =           4
  In of MODEL   10
    1    H    ALA 784           H        ALA 784  22.050  -0.681 -10.191
    2    HA   ALA 784           HA       ALA 784  21.550   2.150 -10.765
    3    HB1  ALA 784           HB1      ALA 784  19.604  -0.067 -11.332
    4    HB3  ALA 784           HB2      ALA 784  20.580   0.783 -12.529
    5    HB2  ALA 784           HB3      ALA 784  19.350   1.654 -11.611

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLU 785           H        GLU 785  19.530  -0.400  -9.361
    2    HA   GLU 785           HA       GLU 785  18.854   1.511  -7.261
    3    HB2  GLU 785           HB2      GLU 785  17.456  -1.038  -8.063
    4    HB3  GLU 785           HB3      GLU 785  16.877   0.148  -6.907
    5    HG2  GLU 785           HG2      GLU 785  16.762   1.805  -8.731
    6    HG3  GLU 785           HG3      GLU 785  17.232   0.538  -9.861

  No H/Q in entry =           6
  In of MODEL   10
    1    H    SER 786           H        SER 786  19.117   1.013  -5.155
    2    HA   SER 786           HA       SER 786  21.009  -1.009  -4.512
    3    HB2  SER 786           HB2      SER 786  20.820   1.203  -3.297
    4    HB3  SER 786           HB3      SER 786  19.298   0.636  -2.619
    5    HG   SER 786           HG       SER 786  20.320  -0.570  -1.273

  No H/Q in entry =           5
  In of MODEL   10
    1    H    SER 787           H        SER 787  20.232  -2.936  -4.963
    2    HA   SER 787           HA       SER 787  18.296  -4.103  -3.225
    3    HB2  SER 787           HB2      SER 787  16.972  -4.984  -5.268
    4    HB3  SER 787           HB3      SER 787  16.690  -3.306  -4.792
    5    HG   SER 787           HG       SER 787  18.400  -2.799  -6.362

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LYS 788           H        LYS 788  19.281  -5.036  -6.479
    2    HA   LYS 788           HA       LYS 788  20.748  -7.263  -5.283
    3    HB2  LYS 788           HB2      LYS 788  20.335  -8.533  -7.279
    4    HB3  LYS 788           HB3      LYS 788  18.801  -7.868  -6.756
    5    HG2  LYS 788           HG2      LYS 788  19.023  -6.096  -8.465
    6    HG3  LYS 788           HG3      LYS 788  20.524  -6.845  -9.006
    7    HD2  LYS 788           HD2      LYS 788  19.215  -8.959  -9.374
    8    HD3  LYS 788           HD3      LYS 788  17.755  -8.016  -9.078
    9    HE2  LYS 788           HE2      LYS 788  19.787  -7.536 -11.252
   10    HE3  LYS 788           HE3      LYS 788  18.191  -8.245 -11.467
   11    HZ1  LYS 788           HZ1      LYS 788  17.217  -6.123 -10.767
   12    HZ3  LYS 788           HZ2      LYS 788  18.206  -5.956 -12.110
   13    HZ2  LYS 788           HZ3      LYS 788  18.760  -5.441 -10.618

  No H/Q in entry =          13
  In of MODEL   10
    1    H    CYS 789           H        CYS 789  22.751  -7.779  -6.170
    2    HA   CYS 789           HA       CYS 789  24.067  -5.496  -7.462
    3    HB2  CYS 789           HB2      CYS 789  24.898  -6.314  -5.210
    4    HB3  CYS 789           HB3      CYS 789  25.283  -7.845  -5.968

  No H/Q in entry =           4
  In of MODEL   10
    1    H    VAL 790           H        VAL 790  25.010  -5.859  -9.472
    2    HA   VAL 790           HA       VAL 790  24.443  -8.499 -10.577
    3    HB   VAL 790           HB       VAL 790  24.491  -7.497 -12.809
    4   HG13  VAL 790          HG11      VAL 790  22.515  -6.066 -12.692
    5   HG12  VAL 790          HG12      VAL 790  22.721  -5.943 -10.946
    6   HG11  VAL 790          HG13      VAL 790  22.370  -7.507 -11.684
    7   HG21  VAL 790          HG21      VAL 790  25.034  -4.857 -11.433
    8   HG23  VAL 790          HG22      VAL 790  24.686  -5.060 -13.150
    9   HG22  VAL 790          HG23      VAL 790  26.160  -5.740 -12.463

  No H/Q in entry =           9
  In of MODEL   10
    1    H    CYS 791           H        CYS 791  26.103  -8.913 -12.496
    2    HA   CYS 791           HA       CYS 791  28.685  -8.672 -11.148
    3    HB2  CYS 791           HB2      CYS 791  27.938 -10.822 -13.149
    4    HB3  CYS 791           HB3      CYS 791  29.228 -10.795 -11.962

  No H/Q in entry =           4
  In of MODEL   10
    1    H    ARG 792           H        ARG 792  30.405  -8.044 -12.296
    2    HA   ARG 792           HA       ARG 792  29.865  -6.469 -14.662
    3    HB2  ARG 792           HB2      ARG 792  32.500  -6.986 -13.262
    4    HB3  ARG 792           HB3      ARG 792  32.142  -5.678 -14.384
    5    HG2  ARG 792           HG2      ARG 792  30.622  -4.680 -12.822
    6    HG3  ARG 792           HG3      ARG 792  30.804  -6.039 -11.716
    7    HD2  ARG 792           HD2      ARG 792  32.145  -4.313 -10.841
    8    HD3  ARG 792           HD3      ARG 792  33.258  -5.438 -11.606
    9    HE   ARG 792           HE       ARG 792  32.500  -3.379 -13.401
   10   HH11  ARG 792          HH11      ARG 792  34.688  -4.121 -10.728
   11   HH12  ARG 792          HH12      ARG 792  35.672  -2.738 -10.953
   12   HH21  ARG 792          HH21      ARG 792  33.823  -1.527 -13.732
   13   HH22  ARG 792          HH22      ARG 792  35.144  -1.180 -12.705

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLU 793           H        GLU 793  31.146  -6.779 -16.620
    2    HA   GLU 793           HA       GLU 793  31.627  -9.591 -17.126
    3    HB2  GLU 793           HB2      GLU 793  31.602  -7.200 -18.964
    4    HB3  GLU 793           HB3      GLU 793  31.917  -8.840 -19.503
    5    HG2  GLU 793           HG2      GLU 793  29.680  -9.507 -18.728
    6    HG3  GLU 793           HG3      GLU 793  29.372  -7.843 -18.237

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ALA 794           H        ALA 794  33.625 -10.073 -18.549
    2    HA   ALA 794           HA       ALA 794  35.862  -9.532 -16.892
    3    HB2  ALA 794           HB1      ALA 794  35.500 -11.669 -18.047
    4    HB3  ALA 794           HB2      ALA 794  37.083 -10.973 -18.391
    5    HB1  ALA 794           HB3      ALA 794  35.798 -10.869 -19.593

  No H/Q in entry =           5
  In of MODEL   10
    1    H    SER 795           H        SER 795  34.652  -8.166 -19.805
    2    HA   SER 795           HA       SER 795  37.076  -6.874 -20.520
    3    HB2  SER 795           HB2      SER 795  34.248  -6.383 -21.472
    4    HB3  SER 795           HB3      SER 795  35.723  -5.797 -22.254
    5    HG   SER 795           HG       SER 795  36.356  -7.944 -22.551

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLU 796           H        GLU 796  34.994  -6.302 -17.998
    2    HA   GLU 796           HA       GLU 796  35.498  -3.410 -18.020
    3    HB2  GLU 796           HB2      GLU 796  33.095  -4.321 -17.840
    4    HB3  GLU 796           HB3      GLU 796  33.549  -4.907 -16.248
    5    HG2  GLU 796           HG2      GLU 796  34.059  -2.602 -15.562
    6    HG3  GLU 796           HG3      GLU 796  33.554  -2.033 -17.152

  No H/Q in entry =           6
  In of MODEL   10
    1    H    CYS 797           H        CYS 797  37.300  -5.651 -17.371
    2    HA   CYS 797           HA       CYS 797  37.707  -5.696 -14.549
    3    HB2  CYS 797           HB2      CYS 797  38.414  -7.552 -15.978
    4    HB3  CYS 797           HB3      CYS 797  39.561  -6.487 -16.789

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLU 798           H        GLU 798  37.801  -3.649 -13.978
    2    HA   GLU 798           HA       GLU 798  39.904  -1.875 -14.919
    3    HB2  GLU 798           HB2      GLU 798  37.541  -1.126 -14.484
    4    HB3  GLU 798           HB3      GLU 798  37.790  -1.448 -12.789
    5    HG2  GLU 798           HG2      GLU 798  39.331   0.594 -14.386
    6    HG3  GLU 798           HG3      GLU 798  37.891   0.954 -13.448

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU 799           H        GLU 799  38.813  -3.113 -11.743
    2    HA   GLU 799           HA       GLU 799  41.097  -2.499 -10.275
    3    HB2  GLU 799           HB2      GLU 799  38.974  -3.208  -9.234
    4    HB3  GLU 799           HB3      GLU 799  39.166  -4.814  -9.914
    5    HG2  GLU 799           HG2      GLU 799  39.710  -4.773  -7.539
    6    HG3  GLU 799           HG3      GLU 799  41.125  -5.184  -8.506

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLU 800           H        GLU 800  42.841  -3.789  -9.597
    2    HA   GLU 800           HA       GLU 800  44.450  -4.684 -11.574
    3    HB2  GLU 800           HB2      GLU 800  44.525  -5.476  -8.672
    4    HB3  GLU 800           HB3      GLU 800  45.824  -5.801  -9.810
    5    HG2  GLU 800           HG2      GLU 800  44.774  -3.067  -9.127
    6    HG3  GLU 800           HG3      GLU 800  46.212  -3.802  -8.428

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLY 801           H        GLY 801  43.271  -7.132  -9.217
    2    HA3  GLY 801           HA2      GLY 801  42.533  -9.229  -9.558
    3    HA2  GLY 801           HA3      GLY 801  42.335  -8.844 -11.257

  No H/Q in entry =           3
  In of MODEL   10
    1    H    PHE 802           H        PHE 802  43.793 -10.864  -9.285
    2    HA   PHE 802           HA       PHE 802  46.364 -11.151 -10.538
    3    HB2  PHE 802           HB2      PHE 802  44.748 -12.827  -8.641
    4    HB3  PHE 802           HB3      PHE 802  46.221 -13.454  -9.362
    5    HD1  PHE 802           HD1      PHE 802  47.770 -13.577  -7.660
    6    HD2  PHE 802           HD2      PHE 802  45.432 -10.047  -8.065
    7    HE1  PHE 802           HE1      PHE 802  49.097 -12.531  -5.970
    8    HE2  PHE 802           HE2      PHE 802  46.768  -8.965  -6.361
    9    HZ   PHE 802           HZ       PHE 802  48.629 -10.195  -5.277

  No H/Q in entry =           9
  In of MODEL   10
    1    H    SER 803           H        SER 803  46.689 -13.739 -11.179
    2    HA   SER 803           HA       SER 803  44.627 -14.357 -13.096
    3    HB2  SER 803           HB2      SER 803  47.622 -14.583 -13.461
    4    HB3  SER 803           HB3      SER 803  46.398 -15.123 -14.611
    5    HG   SER 803           HG       SER 803  45.789 -12.647 -14.041

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ILE 804           H        ILE 804  43.951 -16.407 -12.920
    2    HA   ILE 804           HA       ILE 804  45.485 -18.262 -11.258
    3    HB   ILE 804           HB       ILE 804  43.539 -18.994 -10.037
    4   HG12  ILE 804          HG12      ILE 804  41.817 -18.639 -11.840
    5   HG13  ILE 804          HG13      ILE 804  41.289 -18.125 -10.250
    6   HG23  ILE 804          HG21      ILE 804  42.944 -17.005  -8.711
    7   HG22  ILE 804          HG22      ILE 804  43.660 -15.995  -9.969
    8   HG21  ILE 804          HG23      ILE 804  44.677 -17.104  -9.050
    9   HD11  ILE 804          HD11      ILE 804  41.750 -15.790 -10.900
   10   HD13  ILE 804          HD12      ILE 804  40.552 -16.577 -11.923
   11   HD12  ILE 804          HD13      ILE 804  42.191 -16.352 -12.516

  No H/Q in entry =          11
  In of MODEL   10
    1    H    CYS 805           H        CYS 805  44.321 -20.534 -11.469
    2    HA   CYS 805           HA       CYS 805  43.702 -20.838 -14.322
    3    HB2  CYS 805           HB2      CYS 805  45.795 -21.956 -13.466
    4    HB3  CYS 805           HB3      CYS 805  44.745 -22.966 -12.470

  No H/Q in entry =           4
  In of MODEL   10
    1    H    VAL 806           H        VAL 806  41.791 -21.746 -14.804
    2    HA   VAL 806           HA       VAL 806  40.374 -23.031 -12.634
    3    HB   VAL 806           HB       VAL 806  39.687 -20.657 -12.672
    4   HG13  VAL 806          HG11      VAL 806  38.487 -19.720 -14.531
    5   HG12  VAL 806          HG12      VAL 806  38.834 -21.183 -15.459
    6   HG11  VAL 806          HG13      VAL 806  40.157 -20.144 -14.927
    7   HG21  VAL 806          HG21      VAL 806  38.027 -22.362 -12.038
    8   HG23  VAL 806          HG22      VAL 806  37.529 -22.472 -13.714
    9   HG22  VAL 806          HG23      VAL 806  37.299 -20.957 -12.813

  No H/Q in entry =           9
  In of MODEL   10
    1    H    GLU 807           H        GLU 807  39.212 -24.771 -13.270
    2    HA   GLU 807           HA       GLU 807  39.569 -25.638 -15.981
    3    HB2  GLU 807           HB2      GLU 807  39.863 -27.182 -14.061
    4    HB3  GLU 807           HB3      GLU 807  38.179 -26.950 -13.637
    5    HG2  GLU 807           HG2      GLU 807  37.544 -27.913 -15.826
    6    HG3  GLU 807           HG3      GLU 807  39.257 -28.210 -16.135

  No H/Q in entry =           6
  In of MODEL   10
    1    H    VAL 808           H        VAL 808  38.174 -25.309 -17.458
    2    HA   VAL 808           HA       VAL 808  35.392 -24.868 -16.812
    3    HB   VAL 808           HB       VAL 808  36.408 -22.645 -16.878
    4   HG12  VAL 808          HG11      VAL 808  37.342 -23.315 -19.654
    5   HG11  VAL 808          HG12      VAL 808  38.352 -23.049 -18.234
    6   HG13  VAL 808          HG13      VAL 808  37.417 -21.716 -18.911
    7   HG21  VAL 808          HG21      VAL 808  34.748 -23.206 -19.308
    8   HG23  VAL 808          HG22      VAL 808  35.062 -21.604 -18.629
    9   HG22  VAL 808          HG23      VAL 808  34.151 -22.798 -17.689

  No H/Q in entry =           9
  In of MODEL   10
    1    H    ASN 809           H        ASN 809  34.147 -25.959 -18.106
    2    HA   ASN 809           HA       ASN 809  33.370 -27.134 -19.851
    3    HB2  ASN 809           HB2      ASN 809  35.374 -25.433 -21.140
    4    HB3  ASN 809           HB3      ASN 809  34.721 -26.753 -22.127
    5   HD21  ASN 809          HD21      ASN 809  34.390 -23.565 -21.060
    6   HD22  ASN 809          HD22      ASN 809  32.779 -23.267 -21.568

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLY 810           H        GLY 810  35.995 -27.848 -18.307
    2    HA3  GLY 810           HA2      GLY 810  36.551 -30.159 -18.133
    3    HA2  GLY 810           HA3      GLY 810  36.458 -30.243 -19.914

  No H/Q in entry =           3
  In of MODEL   10
    1    H    LYS 811           H        LYS 811  37.853 -27.547 -19.841
    2    HA   LYS 811           HA       LYS 811  40.567 -28.671 -19.586
    3    HB2  LYS 811           HB2      LYS 811  41.171 -26.949 -21.294
    4    HB3  LYS 811           HB3      LYS 811  40.097 -28.212 -21.881
    5    HG2  LYS 811           HG2      LYS 811  38.181 -26.669 -21.554
    6    HG3  LYS 811           HG3      LYS 811  39.317 -25.414 -21.072
    7    HD2  LYS 811           HD2      LYS 811  39.259 -26.832 -23.704
    8    HD3  LYS 811           HD3      LYS 811  38.607 -25.217 -23.411
    9    HE2  LYS 811           HE2      LYS 811  40.897 -24.520 -22.668
   10    HE3  LYS 811           HE3      LYS 811  41.496 -26.087 -23.195
   11    HZ3  LYS 811           HZ1      LYS 811  41.894 -24.470 -24.880
   12    HZ2  LYS 811           HZ2      LYS 811  40.288 -23.982 -24.881
   13    HZ1  LYS 811           HZ3      LYS 811  40.696 -25.519 -25.448

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLU 812           H        GLU 812  42.244 -27.142 -18.907
    2    HA   GLU 812           HA       GLU 812  41.130 -25.217 -17.027
    3    HB2  GLU 812           HB2      GLU 812  43.928 -26.291 -17.314
    4    HB3  GLU 812           HB3      GLU 812  43.467 -25.050 -16.161
    5    HG2  GLU 812           HG2      GLU 812  41.898 -26.649 -15.131
    6    HG3  GLU 812           HG3      GLU 812  42.480 -27.888 -16.241

  No H/Q in entry =           6
  In of MODEL   10
    1    H    GLN 813           H        GLN 813  41.182 -23.128 -17.291
    2    HA   GLN 813           HA       GLN 813  43.016 -22.068 -19.301
    3    HB2  GLN 813           HB2      GLN 813  40.791 -22.112 -20.214
    4    HB3  GLN 813           HB3      GLN 813  40.135 -21.268 -18.811
    5    HG2  GLN 813           HG2      GLN 813  41.436 -19.357 -19.348
    6    HG3  GLN 813           HG3      GLN 813  42.147 -20.162 -20.758
    7   HE21  GLN 813          HE21      GLN 813  39.446 -18.450 -19.525
    8   HE22  GLN 813          HE22      GLN 813  38.496 -18.427 -20.960

  No H/Q in entry =           8
  In of MODEL   10
    1    H    THR 814           H        THR 814  43.961 -20.122 -18.793
    2    HA   THR 814           HA       THR 814  43.974 -19.413 -15.992
    3    HB   THR 814           HB       THR 814  45.464 -18.219 -18.336
    4    HG1  THR 814           HG1      THR 814  47.070 -19.621 -17.926
    5   HG21  THR 814          HG21      THR 814  45.991 -18.049 -15.364
    6   HG23  THR 814          HG22      THR 814  45.399 -16.745 -16.390
    7   HG22  THR 814          HG23      THR 814  47.030 -17.378 -16.621

  No H/Q in entry =           7
  In of MODEL   10
    1    H    MET 815           H        MET 815  42.743 -17.816 -15.262
    2    HA   MET 815           HA       MET 815  41.769 -15.887 -17.243
    3    HB2  MET 815           HB2      MET 815  40.220 -16.835 -14.842
    4    HB3  MET 815           HB3      MET 815  39.670 -15.675 -16.044
    5    HG2  MET 815           HG2      MET 815  40.003 -17.613 -17.718
    6    HG3  MET 815           HG3      MET 815  40.120 -18.554 -16.230
    7    HE1  MET 815           HE1      MET 815  38.365 -20.066 -17.116
    8    HE3  MET 815           HE2      MET 815  38.003 -19.110 -18.550
    9    HE2  MET 815           HE3      MET 815  36.688 -19.648 -17.483

  No H/Q in entry =           9
  In of MODEL   10
    1    H    SER 816           H        SER 816  41.299 -13.864 -16.379
    2    HA   SER 816           HA       SER 816  43.092 -13.080 -14.290
    3    HB2  SER 816           HB2      SER 816  40.871 -11.521 -15.638
    4    HB3  SER 816           HB3      SER 816  42.213 -10.859 -14.701
    5    HG   SER 816           HG       SER 816  42.709 -12.449 -16.988

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLU 817           H        GLU 817  42.417 -12.324 -12.316
    2    HA   GLU 817           HA       GLU 817  40.615 -13.840 -10.890
    3    HB2  GLU 817           HB2      GLU 817  42.582 -12.351 -10.228
    4    HB3  GLU 817           HB3      GLU 817  41.390 -11.061 -10.261
    5    HG2  GLU 817           HG2      GLU 817  40.227 -11.902  -8.456
    6    HG3  GLU 817           HG3      GLU 817  41.043 -13.472  -8.604

  No H/Q in entry =           6
  In of MODEL   10
    1    H    CYS 818           H        CYS 818  40.238 -10.626 -12.259
    2    HA   CYS 818           HA       CYS 818  37.632 -10.092 -11.389
    3    HB2  CYS 818           HB2      CYS 818  37.710  -8.476 -13.376
    4    HB3  CYS 818           HB3      CYS 818  38.942  -8.283 -12.126

  No H/Q in entry =           4
  In of MODEL   10
    1    H    GLU 819           H        GLU 819  38.883 -11.864 -14.145
    2    HA   GLU 819           HA       GLU 819  36.413 -12.012 -15.592
    3    HB2  GLU 819           HB2      GLU 819  38.555 -12.119 -16.746
    4    HB3  GLU 819           HB3      GLU 819  38.991 -13.549 -15.819
    5    HG2  GLU 819           HG2      GLU 819  37.440 -14.874 -16.988
    6    HG3  GLU 819           HG3      GLU 819  36.698 -13.462 -17.741

  No H/Q in entry =           6
  In of MODEL   10
    1    H    ALA 820           H        ALA 820  38.401 -14.452 -13.932
    2    HA   ALA 820           HA       ALA 820  36.664 -16.539 -13.998
    3    HB3  ALA 820           HB1      ALA 820  38.597 -15.826 -11.811
    4    HB1  ALA 820           HB2      ALA 820  38.940 -16.769 -13.268
    5    HB2  ALA 820           HB3      ALA 820  37.861 -17.414 -12.031

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLY 821           H        GLY 821  37.041 -13.957 -11.554
    2    HA3  GLY 821           HA2      GLY 821  35.123 -14.821  -9.691
    3    HA2  GLY 821           HA3      GLY 821  35.745 -13.185  -9.850

  No H/Q in entry =           3
  In of MODEL   10
    1    H    ALA 822           H        ALA 822  34.865 -12.613 -12.463
    2    HA   ALA 822           HA       ALA 822  32.211 -11.808 -12.012
    3    HB1  ALA 822           HB1      ALA 822  33.684 -12.088 -14.631
    4    HB2  ALA 822           HB2      ALA 822  33.717 -10.672 -13.575
    5    HB3  ALA 822           HB3      ALA 822  32.211 -11.154 -14.356

  No H/Q in entry =           5
  In of MODEL   10
    1    H    LEU 823           H        LEU 823  33.624 -14.446 -13.786
    2    HA   LEU 823           HA       LEU 823  31.233 -15.501 -14.782
    3    HB2  LEU 823           HB2      LEU 823  33.899 -16.793 -14.249
    4    HB3  LEU 823           HB3      LEU 823  32.598 -17.574 -15.131
    5    HG   LEU 823           HG       LEU 823  33.870 -14.975 -15.986
    6   HD11  LEU 823          HD11      LEU 823  34.423 -17.768 -16.964
    7   HD13  LEU 823          HD12      LEU 823  35.539 -16.679 -16.111
    8   HD12  LEU 823          HD13      LEU 823  34.988 -16.276 -17.719
    9   HD21  LEU 823          HD21      LEU 823  31.981 -16.868 -17.382
   10   HD23  LEU 823          HD22      LEU 823  32.778 -15.489 -18.136
   11   HD22  LEU 823          HD23      LEU 823  31.628 -15.227 -16.828

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ARG 824           H        ARG 824  33.004 -16.189 -11.755
    2    HA   ARG 824           HA       ARG 824  31.260 -18.206 -10.834
    3    HB2  ARG 824           HB2      ARG 824  32.773 -16.216  -9.158
    4    HB3  ARG 824           HB3      ARG 824  32.154 -17.765  -8.614
    5    HG2  ARG 824           HG2      ARG 824  33.801 -18.812 -10.268
    6    HG3  ARG 824           HG3      ARG 824  34.488 -17.191 -10.417
    7    HD2  ARG 824           HD2      ARG 824  35.686 -18.488  -8.788
    8    HD3  ARG 824           HD3      ARG 824  34.815 -17.170  -7.991
    9    HE   ARG 824           HE       ARG 824  33.493 -19.723  -8.211
   10   HH11  ARG 824          HH11      ARG 824  35.238 -17.476  -6.102
   11   HH12  ARG 824          HH12      ARG 824  34.651 -18.149  -4.649
   12   HH21  ARG 824          HH21      ARG 824  32.741 -20.685  -6.237
   13   HH22  ARG 824          HH22      ARG 824  33.231 -20.096  -4.715

  No H/Q in entry =          13
  In of MODEL   10
    1    H    CYS 825           H        CYS 825  31.006 -14.756 -10.891
    2    HA   CYS 825           HA       CYS 825  28.938 -14.566  -8.895
    3    HB2  CYS 825           HB2      CYS 825  30.530 -12.662  -9.407
    4    HB3  CYS 825           HB3      CYS 825  29.812 -12.574 -10.995

  No H/Q in entry =           4
  In of MODEL   10
    1    H    ARG 826           H        ARG 826  29.217 -14.324 -12.388
    2    HA   ARG 826           HA       ARG 826  26.593 -13.918 -13.095
    3    HB2  ARG 826           HB2      ARG 826  27.964 -13.537 -14.863
    4    HB3  ARG 826           HB3      ARG 826  29.083 -14.809 -14.403
    5    HG2  ARG 826           HG2      ARG 826  27.666 -16.447 -15.282
    6    HG3  ARG 826           HG3      ARG 826  26.420 -15.262 -15.713
    7    HD2  ARG 826           HD2      ARG 826  27.933 -14.259 -17.338
    8    HD3  ARG 826           HD3      ARG 826  29.242 -15.327 -16.825
    9    HE   ARG 826           HE       ARG 826  27.435 -17.093 -17.501
   10   HH11  ARG 826          HH11      ARG 826  28.350 -14.169 -19.317
   11   HH12  ARG 826          HH12      ARG 826  27.977 -14.850 -20.831
   12   HH21  ARG 826          HH21      ARG 826  26.976 -18.016 -19.620
   13   HH22  ARG 826          HH22      ARG 826  27.191 -17.050 -21.009

  No H/Q in entry =          13
  In of MODEL   10
    1    H    GLY 827           H        GLY 827  28.257 -16.887 -12.338
    2    HA3  GLY 827           HA2      GLY 827  26.985 -18.777 -11.538
    3    HA2  GLY 827           HA3      GLY 827  25.690 -18.263 -12.622

  No H/Q in entry =           3
  In of MODEL   10
    1    H    GLN 828           H        GLN 828  28.973 -18.212 -13.643
    2    HA   GLN 828           HA       GLN 828  28.432 -20.072 -15.747
    3    HB2  GLN 828           HB2      GLN 828  29.923 -18.095 -16.022
    4    HB3  GLN 828           HB3      GLN 828  30.998 -18.778 -14.813
    5    HG2  GLN 828           HG2      GLN 828  31.852 -19.147 -17.066
    6    HG3  GLN 828           HG3      GLN 828  31.454 -20.672 -16.271
    7   HE21  GLN 828          HE21      GLN 828  30.589 -18.448 -18.759
    8   HE22  GLN 828          HE22      GLN 828  29.514 -19.516 -19.584

  No H/Q in entry =           8
  In of MODEL   10
    1    H    SER 829           H        SER 829  29.567 -22.120 -15.892
    2    HA   SER 829           HA       SER 829  30.118 -23.216 -13.261
    3    HB2  SER 829           HB2      SER 829  29.902 -24.575 -15.946
    4    HB3  SER 829           HB3      SER 829  29.975 -25.376 -14.372
    5    HG   SER 829           HG       SER 829  28.022 -24.149 -13.868

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ILE 830           H        ILE 830  32.095 -22.920 -12.590
    2    HA   ILE 830           HA       ILE 830  34.305 -23.571 -14.335
    3    HB   ILE 830           HB       ILE 830  35.626 -21.641 -13.667
    4   HG12  ILE 830          HG12      ILE 830  34.477 -21.215 -11.480
    5   HG13  ILE 830          HG13      ILE 830  34.841 -19.751 -12.380
    6   HG23  ILE 830          HG21      ILE 830  34.497 -21.400 -15.738
    7   HG22  ILE 830          HG22      ILE 830  34.504 -19.834 -14.914
    8   HG21  ILE 830          HG23      ILE 830  33.046 -20.836 -14.912
    9   HD11  ILE 830          HD11      ILE 830  32.148 -21.103 -12.200
   10   HD13  ILE 830          HD12      ILE 830  32.487 -19.633 -13.101
   11   HD12  ILE 830          HD13      ILE 830  32.594 -19.632 -11.349

  No H/Q in entry =          11
  In of MODEL   10
    1    H    SER 831           H        SER 831  35.919 -24.542 -13.261
    2    HA   SER 831           HA       SER 831  35.477 -24.865 -10.413
    3    HB2  SER 831           HB2      SER 831  36.717 -26.674 -12.448
    4    HB3  SER 831           HB3      SER 831  36.616 -27.030 -10.728
    5    HG   SER 831           HG       SER 831  34.724 -27.841 -11.282

  No H/Q in entry =           5
  In of MODEL   10
    1    H    VAL 832           H        VAL 832  36.850 -23.413  -9.496
    2    HA   VAL 832           HA       VAL 832  39.396 -22.714 -10.551
    3    HB   VAL 832           HB       VAL 832  38.360 -22.377  -7.716
    4   HG13  VAL 832          HG11      VAL 832  40.789 -22.131  -7.833
    5   HG12  VAL 832          HG12      VAL 832  40.030 -20.566  -7.536
    6   HG11  VAL 832          HG13      VAL 832  40.619 -20.966  -9.147
    7   HG22  VAL 832          HG21      VAL 832  36.886 -21.290  -9.319
    8   HG21  VAL 832          HG22      VAL 832  38.261 -20.461 -10.048
    9   HG23  VAL 832          HG23      VAL 832  37.778 -20.082  -8.396

  No H/Q in entry =           9
  In of MODEL   10
    1    H    THR 833           H        THR 833  41.009 -24.098 -10.722
    2    HA   THR 833           HA       THR 833  41.165 -26.341  -8.956
    3    HB   THR 833           HB       THR 833  43.060 -26.932 -10.560
    4    HG1  THR 833           HG1      THR 833  43.096 -25.733 -12.488
    5   HG21  THR 833          HG21      THR 833  40.291 -26.457 -11.686
    6   HG23  THR 833          HG22      THR 833  40.805 -27.885 -10.791
    7   HG22  THR 833          HG23      THR 833  41.491 -27.543 -12.379

  No H/Q in entry =           7
  In of MODEL   10
    1    H    SER 834           H        SER 834  42.949 -23.407  -9.747
    2    HA   SER 834           HA       SER 834  44.297 -23.537  -7.235
    3    HB2  SER 834           HB2      SER 834  45.717 -24.969  -8.636
    4    HB3  SER 834           HB3      SER 834  45.905 -23.659  -9.801
    5    HG   SER 834           HG       SER 834  47.350 -24.163  -7.732

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ILE 835           H        ILE 835  45.552 -21.627  -6.904
    2    HA   ILE 835           HA       ILE 835  44.348 -19.355  -8.237
    3    HB   ILE 835           HB       ILE 835  45.334 -18.005  -6.359
    4   HG12  ILE 835          HG12      ILE 835  45.862 -19.375  -4.266
    5   HG13  ILE 835          HG13      ILE 835  46.081 -20.741  -5.346
    6   HG21  ILE 835          HG21      ILE 835  43.037 -18.775  -6.360
    7   HG23  ILE 835          HG22      ILE 835  43.748 -18.747  -4.737
    8   HG22  ILE 835          HG23      ILE 835  43.569 -20.285  -5.594
    9   HD12  ILE 835          HD11      ILE 835  48.186 -19.751  -4.705
   10   HD11  ILE 835          HD12      ILE 835  47.641 -18.198  -5.365
   11   HD13  ILE 835          HD13      ILE 835  47.897 -19.572  -6.443

  No H/Q in entry =          11
  In of MODEL   10
    1    H    ARG 836           H        ARG 836  46.786 -21.199  -8.830
    2    HA   ARG 836           HA       ARG 836  48.748 -19.134  -9.448
    3    HB2  ARG 836           HB2      ARG 836  48.924 -22.090  -9.995
    4    HB3  ARG 836           HB3      ARG 836  50.242 -20.934  -9.907
    5    HG2  ARG 836           HG2      ARG 836  49.840 -20.720  -7.480
    6    HG3  ARG 836           HG3      ARG 836  48.578 -21.949  -7.609
    7    HD2  ARG 836           HD2      ARG 836  50.357 -23.374  -8.727
    8    HD3  ARG 836           HD3      ARG 836  51.516 -22.221  -8.077
    9    HE   ARG 836           HE       ARG 836  49.656 -23.781  -6.420
   10   HH11  ARG 836          HH11      ARG 836  52.887 -22.359  -6.866
   11   HH12  ARG 836          HH12      ARG 836  53.565 -23.185  -5.536
   12   HH21  ARG 836          HH21      ARG 836  50.634 -24.898  -4.591
   13   HH22  ARG 836          HH22      ARG 836  52.278 -24.656  -4.229

  No H/Q in entry =          13
  In of MODEL   10
    1    HA   PRO 837           HA       PRO 837  46.934 -19.116 -13.567
    2    HB2  PRO 837           HB2      PRO 837  49.091 -18.091 -14.936
    3    HB3  PRO 837           HB3      PRO 837  47.976 -17.090 -14.002
    4    HG2  PRO 837           HG2      PRO 837  50.674 -18.132 -13.252
    5    HG3  PRO 837           HG3      PRO 837  49.965 -16.539 -12.941
    6    HD2  PRO 837           HD2      PRO 837  50.098 -18.456 -11.045
    7    HD3  PRO 837           HD3      PRO 837  48.756 -17.296 -11.120

  No H/Q in entry =           7
  In of MODEL   10
    1    H    CYS 838           H        CYS 838  46.991 -20.600 -15.333
    2    HA   CYS 838           HA       CYS 838  49.057 -22.500 -14.977
    3    HB2  CYS 838           HB2      CYS 838  47.589 -23.770 -16.803
    4    HB3  CYS 838           HB3      CYS 838  47.262 -23.895 -15.093

  No H/Q in entry =           4
  In of MODEL   10
    1    H    ALA 839           H        ALA 839  49.634 -23.693 -17.216
    2    HA   ALA 839           HA       ALA 839  50.785 -21.647 -18.904
    3    HB1  ALA 839           HB1      ALA 839  52.164 -23.535 -18.155
    4    HB2  ALA 839           HB2      ALA 839  51.976 -23.567 -19.907
    5    HB3  ALA 839           HB3      ALA 839  51.035 -24.667 -18.898

  No H/Q in entry =           5
  In of MODEL   10
    1    H    ALA 840           H        ALA 840  48.038 -21.831 -18.892
    2    HA   ALA 840           HA       ALA 840  47.227 -23.231 -21.276
    3    HB3  ALA 840           HB1      ALA 840  44.975 -22.633 -20.607
    4    HB1  ALA 840           HB2      ALA 840  45.615 -21.593 -19.336
    5    HB2  ALA 840           HB3      ALA 840  45.841 -23.333 -19.230

  No H/Q in entry =           5
  In of MODEL   10
    1    H    GLU 841           H        GLU 841  48.233 -22.058 -22.823
    2    HA   GLU 841           HA       GLU 841  47.165 -19.344 -23.249
    3    HB2  GLU 841           HB2      GLU 841  49.776 -20.519 -24.237
    4    HB3  GLU 841           HB3      GLU 841  49.133 -18.966 -24.732
    5    HG2  GLU 841           HG2      GLU 841  49.351 -18.105 -22.500
    6    HG3  GLU 841           HG3      GLU 841  49.833 -19.691 -21.898

  No H/Q in entry =           6
  In of MODEL   10
    1    H    THR 842           H        THR 842  48.595 -21.771 -25.188
    2    HA   THR 842           HA       THR 842  46.671 -21.225 -27.290
    3    HB   THR 842           HB       THR 842  48.234 -22.803 -28.603
    4    HG1  THR 842           HG1      THR 842  49.378 -23.696 -26.963
    5   HG22  THR 842          HG21      THR 842  49.267 -20.172 -27.536
    6   HG21  THR 842          HG22      THR 842  48.142 -20.362 -28.879
    7   HG23  THR 842          HG23      THR 842  49.794 -20.954 -29.028

  No H/Q in entry =           7
  In of MODEL   10
    1    H    GLN 843           H        GLN 843  46.755 -23.220 -24.784
    2    HA   GLN 843           HA       GLN 843  45.489 -25.422 -26.216
    3    HB2  GLN 843           HB2      GLN 843  45.677 -26.663 -24.031
    4    HB3  GLN 843           HB3      GLN 843  47.206 -26.232 -24.769
    5    HG2  GLN 843           HG2      GLN 843  47.488 -24.404 -23.202
    6    HG3  GLN 843           HG3      GLN 843  45.900 -24.721 -22.510
    7   HE21  GLN 843          HE21      GLN 843  46.700 -25.110 -20.467
    8   HE22  GLN 843          HE22      GLN 843  47.615 -26.524 -20.088

  No H/Q in entry =           8
  In of MODEL   11
    1    H1   GLY 689           H2       GLY 689  49.665  12.283 -20.012
    2    H2   GLY 689           H1       GLY 689  50.197  11.430 -21.362
    3    H3   GLY 689           H3       GLY 689  48.727  11.026 -20.642
    4    HA2  GLY 689           HA2      GLY 689  50.465   9.448 -20.060
    5    HA3  GLY 689           HA3      GLY 689  49.877  10.324 -18.653

  No H/Q in entry =           5
  In of MODEL   11
    1    H    SER 690           H        SER 690  52.568   9.131 -19.749
    2    HA   SER 690           HA       SER 690  54.756   9.471 -19.584
    3    HB2  SER 690           HB2      SER 690  54.164  12.442 -19.678
    4    HB3  SER 690           HB3      SER 690  55.748  11.696 -19.910
    5    HG   SER 690           HG       SER 690  54.486  10.457 -21.630

  No H/Q in entry =           5
  In of MODEL   11
    1    H    HIS 691           H        HIS 691  56.264   9.482 -18.024
    2    HA   HIS 691           HA       HIS 691  57.293   9.707 -16.030
    3    HB2  HIS 691           HB2      HIS 691  56.697  12.150 -16.235
    4    HB3  HIS 691           HB3      HIS 691  55.214  11.815 -15.371
    5    HD1  HIS 691           HD1      HIS 691  58.812  12.540 -14.907
    6    HD2  HIS 691           HD2      HIS 691  55.584  11.394 -12.555
    7    HE1  HIS 691           HE1      HIS 691  59.492  13.000 -12.553
    8    HE2  HIS 691           HE2      HIS 691  57.417  12.635 -11.234

  No H/Q in entry =           8
  In of MODEL   11
    1    H    MET 692           H        MET 692  54.333   8.467 -16.473
    2    HA   MET 692           HA       MET 692  53.678   7.906 -13.709
    3    HB2  MET 692           HB2      MET 692  52.440   6.843 -16.257
    4    HB3  MET 692           HB3      MET 692  51.841   6.518 -14.638
    5    HG2  MET 692           HG2      MET 692  51.438   8.914 -14.313
    6    HG3  MET 692           HG3      MET 692  52.015   9.220 -15.945
    7    HE1  MET 692           HE1      MET 692  49.785  10.550 -16.419
    8    HE3  MET 692           HE2      MET 692  49.189  10.195 -14.797
    9    HE2  MET 692           HE3      MET 692  48.169   9.879 -16.201

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ASN 693           H        ASN 693  55.584   6.596 -16.116
    2    HA   ASN 693           HA       ASN 693  56.076   4.233 -14.462
    3    HB2  ASN 693           HB2      ASN 693  56.409   4.470 -17.482
    4    HB3  ASN 693           HB3      ASN 693  56.832   3.063 -16.516
    5   HD21  ASN 693          HD21      ASN 693  55.168   1.723 -15.727
    6   HD22  ASN 693          HD22      ASN 693  53.565   1.826 -16.353

  No H/Q in entry =           6
  In of MODEL   11
    1    HA   PRO 694           HA       PRO 694  60.010   6.256 -14.071
    2    HB2  PRO 694           HB2      PRO 694  61.223   3.561 -13.915
    3    HB3  PRO 694           HB3      PRO 694  61.266   4.877 -12.736
    4    HG2  PRO 694           HG2      PRO 694  59.775   2.705 -12.305
    5    HG3  PRO 694           HG3      PRO 694  59.204   4.317 -11.840
    6    HD2  PRO 694           HD2      PRO 694  58.453   2.660 -14.222
    7    HD3  PRO 694           HD3      PRO 694  57.426   3.646 -13.155

  No H/Q in entry =           7
  In of MODEL   11
    1    H    LEU 695           H        LEU 695  60.413   7.089 -16.042
    2    HA   LEU 695           HA       LEU 695  61.205   5.444 -18.247
    3    HB2  LEU 695           HB2      LEU 695  61.194   8.457 -17.990
    4    HB3  LEU 695           HB3      LEU 695  61.472   7.570 -19.473
    5    HG   LEU 695           HG       LEU 695  58.894   7.615 -17.902
    6   HD13  LEU 695          HD11      LEU 695  58.010   8.840 -19.810
    7   HD12  LEU 695          HD12      LEU 695  59.600   8.821 -20.568
    8   HD11  LEU 695          HD13      LEU 695  59.351   9.708 -19.064
    9   HD21  LEU 695          HD21      LEU 695  59.565   6.268 -20.522
   10   HD23  LEU 695          HD22      LEU 695  57.957   6.382 -19.812
   11   HD22  LEU 695          HD23      LEU 695  59.212   5.451 -18.999

  No H/Q in entry =          11
  In of MODEL   11
    1    H    THR 696           H        THR 696  63.001   4.469 -17.772
    2    HA   THR 696           HA       THR 696  65.436   6.105 -17.509
    3    HB   THR 696           HB       THR 696  65.044   3.451 -16.088
    4    HG1  THR 696           HG1      THR 696  63.988   5.861 -15.505
    5   HG21  THR 696          HG21      THR 696  67.357   4.243 -16.431
    6   HG23  THR 696          HG22      THR 696  66.929   4.233 -14.723
    7   HG22  THR 696          HG23      THR 696  66.957   5.754 -15.618

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLN 697           H        GLN 697  64.138   2.856 -17.961
    2    HA   GLN 697           HA       GLN 697  64.935   2.398 -20.549
    3    HB2  GLN 697           HB2      GLN 697  67.227   2.163 -19.424
    4    HB3  GLN 697           HB3      GLN 697  66.530   0.975 -18.343
    5    HG2  GLN 697           HG2      GLN 697  67.925   0.037 -20.188
    6    HG3  GLN 697           HG3      GLN 697  66.289  -0.611 -20.115
    7   HE21  GLN 697          HE21      GLN 697  68.527   1.317 -21.939
    8   HE22  GLN 697          HE22      GLN 697  67.535   1.479 -23.334

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ALA 698           H        ALA 698  64.525  -0.355 -20.512
    2    HA   ALA 698           HA       ALA 698  61.880  -0.725 -19.824
    3    HB3  ALA 698           HB1      ALA 698  62.311  -3.134 -19.970
    4    HB2  ALA 698           HB2      ALA 698  64.046  -2.824 -19.897
    5    HB1  ALA 698           HB3      ALA 698  63.104  -2.262 -21.280

  No H/Q in entry =           5
  In of MODEL   11
    1    H    VAL 699           H        VAL 699  61.018  -0.449 -17.931
    2    HA   VAL 699           HA       VAL 699  62.526  -0.780 -15.547
    3    HB   VAL 699           HB       VAL 699  60.907   1.070 -15.794
    4   HG12  VAL 699          HG11      VAL 699  58.782  -1.041 -15.820
    5   HG11  VAL 699          HG12      VAL 699  59.236   0.022 -17.152
    6   HG13  VAL 699          HG13      VAL 699  58.494   0.698 -15.700
    7   HG23  VAL 699          HG21      VAL 699  59.733   0.847 -13.628
    8   HG22  VAL 699          HG22      VAL 699  61.433   0.399 -13.549
    9   HG21  VAL 699          HG23      VAL 699  60.195  -0.855 -13.588

  No H/Q in entry =           9
  In of MODEL   11
    1    HA   PRO 700           HA       PRO 700  61.845  -5.083 -15.013
    2    HB2  PRO 700           HB2      PRO 700  61.619  -5.013 -12.214
    3    HB3  PRO 700           HB3      PRO 700  63.087  -5.306 -13.147
    4    HG2  PRO 700           HG2      PRO 700  62.130  -2.799 -11.868
    5    HG3  PRO 700           HG3      PRO 700  63.787  -3.355 -12.138
    6    HD2  PRO 700           HD2      PRO 700  62.677  -1.413 -13.609
    7    HD3  PRO 700           HD3      PRO 700  63.821  -2.564 -14.329

  No H/Q in entry =           7
  In of MODEL   11
    1    H    LYS 701           H        LYS 701  60.085  -6.179 -15.235
    2    HA   LYS 701           HA       LYS 701  57.551  -5.094 -14.389
    3    HB2  LYS 701           HB2      LYS 701  58.242  -7.660 -15.826
    4    HB3  LYS 701           HB3      LYS 701  56.608  -7.164 -15.430
    5    HG2  LYS 701           HG2      LYS 701  58.505  -5.679 -17.238
    6    HG3  LYS 701           HG3      LYS 701  57.192  -6.730 -17.772
    7    HD2  LYS 701           HD2      LYS 701  56.891  -4.155 -16.192
    8    HD3  LYS 701           HD3      LYS 701  56.577  -4.354 -17.909
    9    HE2  LYS 701           HE2      LYS 701  55.085  -5.743 -15.674
   10    HE3  LYS 701           HE3      LYS 701  54.501  -4.361 -16.583
   11    HZ1  LYS 701           HZ1      LYS 701  54.564  -5.770 -18.603
   12    HZ3  LYS 701           HZ2      LYS 701  53.525  -6.341 -17.428
   13    HZ2  LYS 701           HZ3      LYS 701  54.994  -7.101 -17.645

  No H/Q in entry =          13
  In of MODEL   11
    1    H    CYS 702           H        CYS 702  56.713  -5.494 -12.524
    2    HA   CYS 702           HA       CYS 702  57.791  -7.737 -10.992
    3    HB2  CYS 702           HB2      CYS 702  56.073  -5.520  -9.834
    4    HB3  CYS 702           HB3      CYS 702  57.186  -6.594  -9.042

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLN 703           H        GLN 703  56.416  -9.228 -10.156
    2    HA   GLN 703           HA       GLN 703  54.011  -9.725 -11.610
    3    HB2  GLN 703           HB2      GLN 703  55.009 -11.058  -9.071
    4    HB3  GLN 703           HB3      GLN 703  53.871 -11.729 -10.234
    5    HG2  GLN 703           HG2      GLN 703  55.606 -11.754 -11.935
    6    HG3  GLN 703           HG3      GLN 703  56.780 -11.110 -10.772
    7   HE21  GLN 703          HE21      GLN 703  55.137 -13.820 -12.004
    8   HE22  GLN 703          HE22      GLN 703  55.932 -15.025 -11.042

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ARG 704           H        ARG 704  51.943 -10.184 -10.371
    2    HA   ARG 704           HA       ARG 704  51.075  -7.722  -9.297
    3    HB2  ARG 704           HB2      ARG 704  49.740 -10.395  -9.500
    4    HB3  ARG 704           HB3      ARG 704  48.926  -8.968  -8.869
    5    HG2  ARG 704           HG2      ARG 704  49.037  -7.853 -10.896
    6    HG3  ARG 704           HG3      ARG 704  50.242  -8.972 -11.564
    7    HD2  ARG 704           HD2      ARG 704  48.546 -10.736 -11.521
    8    HD3  ARG 704           HD3      ARG 704  47.403  -9.568 -10.843
    9    HE   ARG 704           HE       ARG 704  47.537  -8.352 -12.890
   10   HH11  ARG 704          HH11      ARG 704  48.889 -11.665 -13.127
   11   HH12  ARG 704          HH12      ARG 704  48.350 -11.887 -14.717
   12   HH21  ARG 704          HH21      ARG 704  46.789  -8.763 -15.102
   13   HH22  ARG 704          HH22      ARG 704  47.143 -10.255 -15.839

  No H/Q in entry =          13
  In of MODEL   11
    1    H    TRP 705           H        TRP 705  52.282 -10.510  -7.719
    2    HA   TRP 705           HA       TRP 705  51.373  -9.556  -5.124
    3    HB2  TRP 705           HB2      TRP 705  52.616 -11.637  -4.297
    4    HB3  TRP 705           HB3      TRP 705  51.186 -11.903  -5.286
    5    HD1  TRP 705           HD1      TRP 705  54.927 -12.495  -5.219
    6    HE1  TRP 705           HE1      TRP 705  55.576 -13.896  -7.262
    7    HE3  TRP 705           HE3      TRP 705  50.503 -12.365  -7.791
    8    HZ2  TRP 705           HZ2      TRP 705  54.384 -14.869  -9.592
    9    HZ3  TRP 705           HZ3      TRP 705  50.367 -13.552  -9.941
   10    HH2  TRP 705           HH2      TRP 705  52.291 -14.777 -10.816

  No H/Q in entry =          10
  In of MODEL   11
    1    H    GLU 706           H        GLU 706  53.756  -8.887  -7.212
    2    HA   GLU 706           HA       GLU 706  55.719  -8.228  -5.169
    3    HB2  GLU 706           HB2      GLU 706  55.889  -8.411  -8.171
    4    HB3  GLU 706           HB3      GLU 706  57.168  -7.681  -7.181
    5    HG2  GLU 706           HG2      GLU 706  57.426  -9.904  -6.106
    6    HG3  GLU 706           HG3      GLU 706  56.226 -10.541  -7.238

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LYS 707           H        LYS 707  56.866  -6.127  -5.808
    2    HA   LYS 707           HA       LYS 707  55.258  -4.138  -7.067
    3    HB2  LYS 707           HB2      LYS 707  55.178  -2.571  -5.197
    4    HB3  LYS 707           HB3      LYS 707  54.340  -4.050  -4.760
    5    HG2  LYS 707           HG2      LYS 707  56.166  -4.729  -3.353
    6    HG3  LYS 707           HG3      LYS 707  57.157  -3.383  -3.927
    7    HD2  LYS 707           HD2      LYS 707  55.494  -1.808  -3.002
    8    HD3  LYS 707           HD3      LYS 707  54.590  -3.175  -2.355
    9    HE2  LYS 707           HE2      LYS 707  56.444  -3.771  -0.936
   10    HE3  LYS 707           HE3      LYS 707  57.450  -2.519  -1.668
   11    HZ2  LYS 707           HZ1      LYS 707  54.993  -2.061  -0.063
   12    HZ1  LYS 707           HZ2      LYS 707  55.889  -0.864  -0.824
   13    HZ3  LYS 707           HZ3      LYS 707  56.577  -1.752   0.425

  No H/Q in entry =          13
  In of MODEL   11
    1    H    LEU 708           H        LEU 708  56.482  -2.177  -7.351
    2    HA   LEU 708           HA       LEU 708  59.307  -2.818  -7.672
    3    HB2  LEU 708           HB2      LEU 708  58.074  -2.079  -9.629
    4    HB3  LEU 708           HB3      LEU 708  57.578  -0.623  -8.796
    5    HG   LEU 708           HG       LEU 708  59.997   0.022  -8.682
    6   HD11  LEU 708          HD11      LEU 708  60.318  -2.259 -10.614
    7   HD13  LEU 708          HD12      LEU 708  61.023  -2.139  -9.001
    8   HD12  LEU 708          HD13      LEU 708  61.535  -1.029 -10.270
    9   HD22  LEU 708          HD21      LEU 708  58.489   1.018 -10.284
   10   HD21  LEU 708          HD22      LEU 708  58.754  -0.318 -11.402
   11   HD23  LEU 708          HD23      LEU 708  60.077   0.780 -11.011

  No H/Q in entry =          11
  In of MODEL   11
    1    H    GLN 709           H        GLN 709  60.620  -2.149  -6.072
    2    HA   GLN 709           HA       GLN 709  60.570   0.643  -5.304
    3    HB2  GLN 709           HB2      GLN 709  60.619   0.308  -2.943
    4    HB3  GLN 709           HB3      GLN 709  59.246  -0.627  -3.497
    5    HG2  GLN 709           HG2      GLN 709  60.614  -2.676  -3.373
    6    HG3  GLN 709           HG3      GLN 709  61.968  -1.689  -2.806
    7   HE21  GLN 709          HE21      GLN 709  62.075  -2.848  -0.881
    8   HE22  GLN 709          HE22      GLN 709  60.930  -2.618   0.379

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ASN 710           H        ASN 710  62.660   1.308  -4.643
    2    HA   ASN 710           HA       ASN 710  64.969   1.225  -4.507
    3    HB2  ASN 710           HB2      ASN 710  64.289  -0.522  -2.778
    4    HB3  ASN 710           HB3      ASN 710  64.558  -1.743  -3.995
    5   HD21  ASN 710          HD21      ASN 710  65.969   0.382  -1.781
    6   HD22  ASN 710          HD22      ASN 710  67.616  -0.150  -1.926

  No H/Q in entry =           6
  In of MODEL   11
    1    H    SER 711           H        SER 711  63.438   0.616  -7.007
    2    HA   SER 711           HA       SER 711  63.771   0.192  -9.168
    3    HB2  SER 711           HB2      SER 711  66.683   0.112  -8.361
    4    HB3  SER 711           HB3      SER 711  66.081   0.334 -10.015
    5    HG   SER 711           HG       SER 711  66.488   2.335  -9.226

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ARG 712           H        ARG 712  63.359  -2.014  -7.252
    2    HA   ARG 712           HA       ARG 712  64.114  -4.216  -9.008
    3    HB2  ARG 712           HB2      ARG 712  64.856  -5.591  -7.174
    4    HB3  ARG 712           HB3      ARG 712  65.762  -4.085  -7.076
    5    HG2  ARG 712           HG2      ARG 712  64.313  -3.286  -5.327
    6    HG3  ARG 712           HG3      ARG 712  63.318  -4.729  -5.444
    7    HD2  ARG 712           HD2      ARG 712  64.711  -5.133  -3.593
    8    HD3  ARG 712           HD3      ARG 712  65.473  -6.013  -4.918
    9    HE   ARG 712           HE       ARG 712  66.456  -3.334  -4.480
   10   HH11  ARG 712          HH11      ARG 712  66.947  -6.780  -3.836
   11   HH12  ARG 712          HH12      ARG 712  68.518  -6.588  -3.222
   12   HH21  ARG 712          HH21      ARG 712  68.557  -3.041  -3.603
   13   HH22  ARG 712          HH22      ARG 712  69.489  -4.358  -3.076

  No H/Q in entry =          13
  In of MODEL   11
    1    H    CYS 713           H        CYS 713  62.734  -6.186  -8.311
    2    HA   CYS 713           HA       CYS 713  60.143  -5.199  -7.432
    3    HB2  CYS 713           HB2      CYS 713  60.869  -7.675  -8.996
    4    HB3  CYS 713           HB3      CYS 713  59.230  -7.232  -8.522

  No H/Q in entry =           4
  In of MODEL   11
    1    H    VAL 714           H        VAL 714  59.520  -5.707  -5.529
    2    HA   VAL 714           HA       VAL 714  60.653  -8.064  -4.169
    3    HB   VAL 714           HB       VAL 714  60.404  -6.883  -2.027
    4   HG12  VAL 714          HG11      VAL 714  61.939  -5.240  -4.018
    5   HG11  VAL 714          HG12      VAL 714  62.540  -6.662  -3.160
    6   HG13  VAL 714          HG13      VAL 714  62.147  -5.187  -2.270
    7   HG22  VAL 714          HG21      VAL 714  58.511  -5.457  -2.563
    8   HG21  VAL 714          HG22      VAL 714  59.504  -4.526  -3.683
    9   HG23  VAL 714          HG23      VAL 714  59.849  -4.479  -1.953

  No H/Q in entry =           9
  In of MODEL   11
    1    H    CYS 715           H        CYS 715  58.994  -8.601  -2.262
    2    HA   CYS 715           HA       CYS 715  56.442  -8.836  -3.619
    3    HB2  CYS 715           HB2      CYS 715  57.423  -9.961  -0.996
    4    HB3  CYS 715           HB3      CYS 715  55.806 -10.227  -1.635

  No H/Q in entry =           4
  In of MODEL   11
    1    H    LYS 716           H        LYS 716  54.507  -7.980  -2.852
    2    HA   LYS 716           HA       LYS 716  54.859  -5.641  -1.217
    3    HB2  LYS 716           HB2      LYS 716  52.369  -5.293  -1.513
    4    HB3  LYS 716           HB3      LYS 716  53.291  -5.327  -3.003
    5    HG2  LYS 716           HG2      LYS 716  52.448  -7.453  -3.595
    6    HG3  LYS 716           HG3      LYS 716  51.834  -7.738  -1.967
    7    HD2  LYS 716           HD2      LYS 716  50.026  -7.199  -3.565
    8    HD3  LYS 716           HD3      LYS 716  50.137  -6.027  -2.263
    9    HE2  LYS 716           HE2      LYS 716  49.737  -4.852  -4.320
   10    HE3  LYS 716           HE3      LYS 716  51.384  -4.519  -3.808
   11    HZ2  LYS 716           HZ1      LYS 716  51.140  -4.933  -6.182
   12    HZ1  LYS 716           HZ2      LYS 716  50.626  -6.495  -5.918
   13    HZ3  LYS 716           HZ3      LYS 716  52.204  -6.033  -5.506

  No H/Q in entry =          13
  In of MODEL   11
    1    H    MET 717           H        MET 717  52.903  -5.367   0.483
    2    HA   MET 717           HA       MET 717  53.497  -7.447   2.416
    3    HB2  MET 717           HB2      MET 717  51.937  -4.886   2.654
    4    HB3  MET 717           HB3      MET 717  52.357  -5.934   3.993
    5    HG2  MET 717           HG2      MET 717  54.417  -4.582   2.269
    6    HG3  MET 717           HG3      MET 717  53.718  -3.811   3.679
    7    HE1  MET 717           HE1      MET 717  56.119  -6.495   2.265
    8    HE3  MET 717           HE2      MET 717  55.178  -7.695   3.182
    9    HE2  MET 717           HE3      MET 717  56.795  -7.261   3.691

  No H/Q in entry =           9
  In of MODEL   11
    1    HA   PRO 718           HA       PRO 718  49.734  -9.643   1.606
    2    HB2  PRO 718           HB2      PRO 718  49.445 -10.960   3.984
    3    HB3  PRO 718           HB3      PRO 718  50.613 -11.438   2.750
    4    HG2  PRO 718           HG2      PRO 718  51.038  -9.821   5.233
    5    HG3  PRO 718           HG3      PRO 718  52.044 -11.115   4.553
    6    HD2  PRO 718           HD2      PRO 718  52.672  -8.507   4.251
    7    HD3  PRO 718           HD3      PRO 718  53.016  -9.710   2.993

  No H/Q in entry =           7
  In of MODEL   11
    1    H    TYR 719           H        TYR 719  50.055  -7.506   4.242
    2    HA   TYR 719           HA       TYR 719  47.208  -7.493   4.831
    3    HB2  TYR 719           HB2      TYR 719  47.881  -5.847   6.627
    4    HB3  TYR 719           HB3      TYR 719  48.569  -7.455   6.782
    5    HD1  TYR 719           HD1      TYR 719  49.271  -3.945   6.058
    6    HD2  TYR 719           HD2      TYR 719  50.974  -7.814   6.490
    7    HE1  TYR 719           HE1      TYR 719  51.479  -2.938   6.215
    8    HE2  TYR 719           HE2      TYR 719  53.210  -6.815   6.661
    9    HH   TYR 719           HH       TYR 719  54.352  -4.734   5.984

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLU 720           H        GLU 720  49.069  -6.167   2.572
    2    HA   GLU 720           HA       GLU 720  47.653  -3.616   2.436
    3    HB2  GLU 720           HB2      GLU 720  50.135  -4.715   1.164
    4    HB3  GLU 720           HB3      GLU 720  49.354  -3.275   0.520
    5    HG2  GLU 720           HG2      GLU 720  50.246  -3.548   3.370
    6    HG3  GLU 720           HG3      GLU 720  51.260  -2.870   2.094

  No H/Q in entry =           6
  In of MODEL   11
    1    H    CYS 721           H        CYS 721  46.928  -6.493   1.815
    2    HA   CYS 721           HA       CYS 721  46.483  -6.554  -1.036
    3    HB2  CYS 721           HB2      CYS 721  47.274  -8.550   0.060
    4    HB3  CYS 721           HB3      CYS 721  45.902  -8.524   1.172

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLY 722           H        GLY 722  44.498  -6.395  -1.983
    2    HA3  GLY 722           HA2      GLY 722  42.242  -5.825  -0.203
    3    HA2  GLY 722           HA3      GLY 722  42.569  -4.853  -1.633

  No H/Q in entry =           3
  In of MODEL   11
    1    HA   PRO 723           HA       PRO 723  39.629  -7.487  -3.625
    2    HB2  PRO 723           HB2      PRO 723  40.216  -6.807  -6.209
    3    HB3  PRO 723           HB3      PRO 723  39.256  -5.786  -5.128
    4    HG2  PRO 723           HG2      PRO 723  42.140  -5.591  -5.866
    5    HG3  PRO 723           HG3      PRO 723  40.945  -4.301  -5.676
    6    HD2  PRO 723           HD2      PRO 723  42.770  -4.865  -3.782
    7    HD3  PRO 723           HD3      PRO 723  41.141  -4.285  -3.380

  No H/Q in entry =           7
  In of MODEL   11
    1    H    SER 724           H        SER 724  39.856  -9.680  -3.841
    2    HA   SER 724           HA       SER 724  41.448 -10.858  -5.830
    3    HB2  SER 724           HB2      SER 724  42.728 -12.227  -4.081
    4    HB3  SER 724           HB3      SER 724  43.302 -10.593  -4.418
    5    HG   SER 724           HG       SER 724  42.072  -9.934  -2.560

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU 725           H        LEU 725  41.081 -13.071  -5.939
    2    HA   LEU 725           HA       LEU 725  38.405 -13.827  -5.159
    3    HB2  LEU 725           HB2      LEU 725  40.644 -15.246  -6.516
    4    HB3  LEU 725           HB3      LEU 725  39.179 -16.111  -6.070
    5    HG   LEU 725           HG       LEU 725  39.222 -13.708  -7.909
    6   HD12  LEU 725          HD11      LEU 725  39.154 -15.306  -9.741
    7   HD11  LEU 725          HD12      LEU 725  39.334 -16.645  -8.602
    8   HD13  LEU 725          HD13      LEU 725  40.648 -15.487  -8.827
    9   HD21  LEU 725          HD21      LEU 725  37.245 -15.942  -7.495
   10   HD23  LEU 725          HD22      LEU 725  37.106 -14.616  -8.652
   11   HD22  LEU 725          HD23      LEU 725  37.069 -14.281  -6.922

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ASP 726           H        ASP 726  37.796 -14.778  -3.369
    2    HA   ASP 726           HA       ASP 726  39.676 -15.567  -1.362
    3    HB2  ASP 726           HB2      ASP 726  36.674 -15.997  -1.480
    4    HB3  ASP 726           HB3      ASP 726  37.679 -16.253  -0.069

  No H/Q in entry =           4
  In of MODEL   11
    1    H    VAL 727           H        VAL 727  40.327 -17.564  -0.860
    2    HA   VAL 727           HA       VAL 727  39.125 -19.903  -2.119
    3    HB   VAL 727           HB       VAL 727  41.399 -20.807  -2.734
    4   HG12  VAL 727          HG11      VAL 727  40.577 -18.299  -4.195
    5   HG11  VAL 727          HG12      VAL 727  39.942 -19.920  -4.477
    6   HG13  VAL 727          HG13      VAL 727  41.629 -19.559  -4.838
    7   HG22  VAL 727          HG21      VAL 727  43.272 -19.247  -3.009
    8   HG21  VAL 727          HG22      VAL 727  42.754 -19.309  -1.324
    9   HG23  VAL 727          HG23      VAL 727  42.293 -17.945  -2.341

  No H/Q in entry =           9
  In of MODEL   11
    1    H    CYS 728           H        CYS 728  40.033 -21.941  -1.122
    2    HA   CYS 728           HA       CYS 728  40.664 -21.410   1.682
    3    HB2  CYS 728           HB2      CYS 728  39.682 -23.949   0.361
    4    HB3  CYS 728           HB3      CYS 728  39.969 -23.729   2.080

  No H/Q in entry =           4
  In of MODEL   11
    1    H    ALA 729           H        ALA 729  42.591 -21.963   2.484
    2    HA   ALA 729           HA       ALA 729  44.336 -23.694   0.877
    3    HB2  ALA 729           HB1      ALA 729  46.202 -22.242   1.458
    4    HB1  ALA 729           HB2      ALA 729  45.099 -21.166   2.305
    5    HB3  ALA 729           HB3      ALA 729  44.975 -21.352   0.550

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLN 730           H        GLN 730  45.982 -24.701   2.230
    2    HA   GLN 730           HA       GLN 730  45.036 -24.997   4.972
    3    HB2  GLN 730           HB2      GLN 730  45.111 -27.086   3.628
    4    HB3  GLN 730           HB3      GLN 730  46.834 -26.834   3.419
    5    HG2  GLN 730           HG2      GLN 730  47.225 -27.010   5.770
    6    HG3  GLN 730           HG3      GLN 730  45.510 -27.168   6.098
    7   HE21  GLN 730          HE21      GLN 730  45.640 -29.189   7.009
    8   HE22  GLN 730          HE22      GLN 730  46.106 -30.597   6.139

  No H/Q in entry =           8
  In of MODEL   11
    1    H    ASP 731           H        ASP 731  46.124 -24.256   6.466
    2    HA   ASP 731           HA       ASP 731  48.620 -22.914   6.198
    3    HB2  ASP 731           HB2      ASP 731  46.896 -22.134   7.728
    4    HB3  ASP 731           HB3      ASP 731  46.885 -23.684   8.540

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLU 732           H        GLU 732  50.582 -23.933   6.243
    2    HA   GLU 732           HA       GLU 732  50.767 -26.712   7.011
    3    HB2  GLU 732           HB2      GLU 732  52.790 -24.788   5.890
    4    HB3  GLU 732           HB3      GLU 732  53.156 -26.460   6.280
    5    HG2  GLU 732           HG2      GLU 732  51.105 -25.534   4.286
    6    HG3  GLU 732           HG3      GLU 732  52.718 -26.140   3.903

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ARG 733           H        ARG 733  50.787 -24.065   8.859
    2    HA   ARG 733           HA       ARG 733  53.113 -24.783  10.457
    3    HB2  ARG 733           HB2      ARG 733  52.586 -22.397   9.785
    4    HB3  ARG 733           HB3      ARG 733  51.141 -22.496  10.763
    5    HG2  ARG 733           HG2      ARG 733  53.922 -22.830  11.875
    6    HG3  ARG 733           HG3      ARG 733  53.112 -21.273  11.753
    7    HD2  ARG 733           HD2      ARG 733  51.316 -22.129  13.217
    8    HD3  ARG 733           HD3      ARG 733  52.181 -23.661  13.342
    9    HE   ARG 733           HE       ARG 733  53.997 -21.798  14.073
   10   HH11  ARG 733          HH11      ARG 733  50.796 -22.734  15.273
   11   HH12  ARG 733          HH12      ARG 733  51.023 -22.121  16.831
   12   HH21  ARG 733          HH21      ARG 733  54.370 -21.016  16.264
   13   HH22  ARG 733          HH22      ARG 733  53.137 -21.151  17.430

  No H/Q in entry =          13
  In of MODEL   11
    1    H    SER 734           H        SER 734  49.627 -24.454  10.631
    2    HA   SER 734           HA       SER 734  49.618 -25.846  13.229
    3    HB2  SER 734           HB2      SER 734  47.408 -24.206  12.034
    4    HB3  SER 734           HB3      SER 734  47.661 -24.629  13.730
    5    HG   SER 734           HG       SER 734  49.139 -22.870  12.103

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LYS 735           H        LYS 735  48.745 -26.270   9.859
    2    HA   LYS 735           HA       LYS 735  47.453 -27.558   8.706
    3    HB2  LYS 735           HB2      LYS 735  47.658 -29.369  11.108
    4    HB3  LYS 735           HB3      LYS 735  46.845 -29.831   9.623
    5    HG2  LYS 735           HG2      LYS 735  49.755 -29.097   9.896
    6    HG3  LYS 735           HG3      LYS 735  49.096 -30.718   9.648
    7    HD2  LYS 735           HD2      LYS 735  48.006 -29.726   7.533
    8    HD3  LYS 735           HD3      LYS 735  49.081 -28.381   7.780
    9    HE2  LYS 735           HE2      LYS 735  51.021 -29.635   7.526
   10    HE3  LYS 735           HE3      LYS 735  50.167 -31.172   7.633
   11    HZ2  LYS 735           HZ1      LYS 735  49.975 -29.190   5.400
   12    HZ1  LYS 735           HZ2      LYS 735  49.119 -30.641   5.473
   13    HZ3  LYS 735           HZ3      LYS 735  50.788 -30.654   5.357

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ARG 736           H        ARG 736  45.980 -26.065   8.546
    2    HA   ARG 736           HA       ARG 736  43.335 -26.792   9.451
    3    HB2  ARG 736           HB2      ARG 736  42.901 -24.456  10.298
    4    HB3  ARG 736           HB3      ARG 736  44.039 -25.345  11.314
    5    HG2  ARG 736           HG2      ARG 736  45.896 -24.216  10.251
    6    HG3  ARG 736           HG3      ARG 736  44.790 -23.361   9.181
    7    HD2  ARG 736           HD2      ARG 736  43.880 -22.159  11.082
    8    HD3  ARG 736           HD3      ARG 736  44.912 -23.081  12.188
    9    HE   ARG 736           HE       ARG 736  46.472 -21.870  10.163
   10   HH11  ARG 736          HH11      ARG 736  44.713 -20.848  13.066
   11   HH12  ARG 736          HH12      ARG 736  45.832 -19.629  13.447
   12   HH21  ARG 736          HH21      ARG 736  47.955 -20.252  10.662
   13   HH22  ARG 736          HH22      ARG 736  47.722 -19.258  12.040

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ILE 737           H        ILE 737  41.829 -26.104   7.857
    2    HA   ILE 737           HA       ILE 737  42.960 -24.839   5.533
    3    HB   ILE 737           HB       ILE 737  40.059 -25.515   6.068
    4   HG12  ILE 737          HG12      ILE 737  41.456 -27.567   6.328
    5   HG13  ILE 737          HG13      ILE 737  40.382 -27.652   4.936
    6   HG22  ILE 737          HG21      ILE 737  41.600 -25.253   3.491
    7   HG21  ILE 737          HG22      ILE 737  40.673 -23.966   4.231
    8   HG23  ILE 737          HG23      ILE 737  39.846 -25.429   3.672
    9   HD12  ILE 737          HD11      ILE 737  43.322 -27.056   4.913
   10   HD11  ILE 737          HD12      ILE 737  42.251 -27.046   3.507
   11   HD13  ILE 737          HD13      ILE 737  42.540 -28.556   4.379

  No H/Q in entry =          11
  In of MODEL   11
    1    H    LEU 738           H        LEU 738  42.939 -22.674   5.388
    2    HA   LEU 738           HA       LEU 738  40.877 -21.276   6.914
    3    HB2  LEU 738           HB2      LEU 738  42.301 -19.484   7.516
    4    HB3  LEU 738           HB3      LEU 738  43.142 -20.952   7.994
    5    HG   LEU 738           HG       LEU 738  43.754 -19.127   5.660
    6   HD11  LEU 738          HD11      LEU 738  44.373 -18.200   7.798
    7   HD13  LEU 738          HD12      LEU 738  45.807 -18.654   6.881
    8   HD12  LEU 738          HD13      LEU 738  45.253 -19.674   8.210
    9   HD23  LEU 738          HD21      LEU 738  45.194 -21.610   6.558
   10   HD22  LEU 738          HD22      LEU 738  45.719 -20.492   5.275
   11   HD21  LEU 738          HD23      LEU 738  44.221 -21.410   5.102

  No H/Q in entry =          11
  In of MODEL   11
    1    HA   PRO 739           HA       PRO 739  39.892 -19.313   3.146
    2    HB2  PRO 739           HB2      PRO 739  38.731 -17.054   4.058
    3    HB3  PRO 739           HB3      PRO 739  37.952 -18.647   4.214
    4    HG2  PRO 739           HG2      PRO 739  39.454 -17.059   6.254
    5    HG3  PRO 739           HG3      PRO 739  37.960 -17.999   6.441
    6    HD2  PRO 739           HD2      PRO 739  40.452 -18.943   7.149
    7    HD3  PRO 739           HD3      PRO 739  39.095 -19.984   6.651

  No H/Q in entry =           7
  In of MODEL   11
    1    H    LEU 740           H        LEU 740  41.431 -18.569   1.948
    2    HA   LEU 740           HA       LEU 740  42.829 -16.132   2.760
    3    HB2  LEU 740           HB2      LEU 740  43.867 -18.457   1.152
    4    HB3  LEU 740           HB3      LEU 740  44.663 -16.908   1.196
    5    HG   LEU 740           HG       LEU 740  44.314 -18.836   3.482
    6   HD12  LEU 740          HD11      LEU 740  46.722 -17.832   1.976
    7   HD11  LEU 740          HD12      LEU 740  45.982 -19.413   1.823
    8   HD13  LEU 740          HD13      LEU 740  46.747 -18.947   3.354
    9   HD21  LEU 740          HD21      LEU 740  45.594 -16.094   3.454
   10   HD23  LEU 740          HD22      LEU 740  45.679 -17.251   4.780
   11   HD22  LEU 740          HD23      LEU 740  44.127 -16.546   4.331

  No H/Q in entry =          11
  In of MODEL   11
    1    H    THR 741           H        THR 741  43.942 -15.445   0.453
    2    HA   THR 741           HA       THR 741  41.883 -15.455  -1.569
    3    HB   THR 741           HB       THR 741  42.953 -12.940  -1.718
    4    HG1  THR 741           HG1      THR 741  42.534 -13.617   0.994
    5   HG22  THR 741          HG21      THR 741  40.813 -12.169  -0.825
    6   HG21  THR 741          HG22      THR 741  40.503 -13.796  -0.185
    7   HG23  THR 741          HG23      THR 741  40.620 -13.534  -1.932

  No H/Q in entry =           7
  In of MODEL   11
    1    H    VAL 742           H        VAL 742  42.772 -14.962  -3.616
    2    HA   VAL 742           HA       VAL 742  45.016 -16.292  -4.396
    3    HB   VAL 742           HB       VAL 742  43.997 -13.766  -5.656
    4   HG11  VAL 742          HG11      VAL 742  45.536 -16.021  -6.895
    5   HG13  VAL 742          HG12      VAL 742  46.059 -14.347  -6.612
    6   HG12  VAL 742          HG13      VAL 742  44.754 -14.681  -7.744
    7   HG23  VAL 742          HG21      VAL 742  42.664 -15.176  -7.053
    8   HG22  VAL 742          HG22      VAL 742  42.223 -15.214  -5.335
    9   HG21  VAL 742          HG23      VAL 742  43.112 -16.580  -6.060

  No H/Q in entry =           9
  In of MODEL   11
    1    H    CYS 743           H        CYS 743  44.698 -12.851  -4.042
    2    HA   CYS 743           HA       CYS 743  47.284 -12.041  -4.380
    3    HB2  CYS 743           HB2      CYS 743  45.699 -10.361  -4.502
    4    HB3  CYS 743           HB3      CYS 743  44.864 -10.942  -3.068

  No H/Q in entry =           4
  In of MODEL   11
    1    H    LYS 744           H        LYS 744  45.666 -12.642  -1.196
    2    HA   LYS 744           HA       LYS 744  47.961 -12.126   0.323
    3    HB2  LYS 744           HB2      LYS 744  45.670 -13.965   1.000
    4    HB3  LYS 744           HB3      LYS 744  46.940 -13.499   2.114
    5    HG2  LYS 744           HG2      LYS 744  46.215 -11.120   1.818
    6    HG3  LYS 744           HG3      LYS 744  44.852 -11.716   0.863
    7    HD2  LYS 744           HD2      LYS 744  44.198 -13.133   2.823
    8    HD3  LYS 744           HD3      LYS 744  45.456 -12.328   3.754
    9    HE2  LYS 744           HE2      LYS 744  43.387 -11.237   4.267
   10    HE3  LYS 744           HE3      LYS 744  44.312 -10.145   3.243
   11    HZ2  LYS 744           HZ1      LYS 744  42.031 -11.861   2.378
   12    HZ1  LYS 744           HZ2      LYS 744  42.966 -10.924   1.340
   13    HZ3  LYS 744           HZ3      LYS 744  42.047 -10.186   2.508

  No H/Q in entry =          13
  In of MODEL   11
    1    H    MET 745           H        MET 745  46.735 -15.248  -0.829
    2    HA   MET 745           HA       MET 745  48.729 -16.918   0.224
    3    HB2  MET 745           HB2      MET 745  46.989 -18.118  -0.617
    4    HB3  MET 745           HB3      MET 745  46.776 -17.110  -2.025
    5    HG2  MET 745           HG2      MET 745  47.564 -19.140  -2.898
    6    HG3  MET 745           HG3      MET 745  48.961 -18.112  -2.865
    7    HE1  MET 745           HE1      MET 745  47.180 -21.127  -1.420
    8    HE3  MET 745           HE2      MET 745  47.287 -20.255   0.113
    9    HE2  MET 745           HE3      MET 745  48.232 -21.729  -0.147

  No H/Q in entry =           9
  In of MODEL   11
    1    H    HIS 746           H        HIS 746  48.651 -15.200  -2.881
    2    HA   HIS 746           HA       HIS 746  51.081 -16.376  -3.789
    3    HB2  HIS 746           HB2      HIS 746  49.381 -14.182  -4.652
    4    HB3  HIS 746           HB3      HIS 746  51.060 -14.059  -5.226
    5    HD1  HIS 746           HD1      HIS 746  51.763 -16.286  -6.764
    6    HD2  HIS 746           HD2      HIS 746  47.713 -15.597  -6.132
    7    HE1  HIS 746           HE1      HIS 746  50.575 -17.471  -8.615
    8    HE2  HIS 746           HE2      HIS 746  48.144 -17.167  -8.152

  No H/Q in entry =           8
  In of MODEL   11
    1    H    VAL 747           H        VAL 747  50.365 -13.352  -2.126
    2    HA   VAL 747           HA       VAL 747  52.981 -12.351  -2.139
    3    HB   VAL 747           HB       VAL 747  50.637 -11.809  -0.294
    4   HG11  VAL 747          HG11      VAL 747  52.733 -11.398   0.933
    5   HG13  VAL 747          HG12      VAL 747  51.900  -9.891   0.567
    6   HG12  VAL 747          HG13      VAL 747  53.302 -10.376  -0.386
    7   HG23  VAL 747          HG21      VAL 747  51.961 -10.213  -2.456
    8   HG22  VAL 747          HG22      VAL 747  50.576  -9.680  -1.490
    9   HG21  VAL 747          HG23      VAL 747  50.419 -11.055  -2.594

  No H/Q in entry =           9
  In of MODEL   11
    1    H    LEU 748           H        LEU 748  51.215 -14.152   0.369
    2    HA   LEU 748           HA       LEU 748  53.468 -14.270   2.036
    3    HB2  LEU 748           HB2      LEU 748  52.219 -15.996   3.353
    4    HB3  LEU 748           HB3      LEU 748  51.330 -14.518   3.071
    5    HG   LEU 748           HG       LEU 748  50.102 -15.761   1.256
    6   HD11  LEU 748          HD11      LEU 748  51.354 -18.150   2.580
    7   HD13  LEU 748          HD12      LEU 748  51.588 -17.629   0.914
    8   HD12  LEU 748          HD13      LEU 748  50.009 -18.207   1.445
    9   HD22  LEU 748          HD21      LEU 748  49.092 -15.243   3.385
   10   HD21  LEU 748          HD22      LEU 748  49.819 -16.682   4.108
   11   HD23  LEU 748          HD23      LEU 748  48.591 -16.848   2.857

  No H/Q in entry =          11
  In of MODEL   11
    1    H    HIS 749           H        HIS 749  52.506 -16.222  -0.623
    2    HA   HIS 749           HA       HIS 749  54.183 -18.425   0.006
    3    HB2  HIS 749           HB2      HIS 749  52.186 -18.091  -1.785
    4    HB3  HIS 749           HB3      HIS 749  53.576 -17.902  -2.857
    5    HD1  HIS 749           HD1      HIS 749  54.746 -20.087  -3.564
    6    HD2  HIS 749           HD2      HIS 749  51.975 -20.566  -0.519
    7    HE1  HIS 749           HE1      HIS 749  54.538 -22.552  -3.243
    8    HE2  HIS 749           HE2      HIS 749  52.907 -22.852  -1.377

  No H/Q in entry =           8
  In of MODEL   11
    1    H    CYS 750           H        CYS 750  54.662 -15.337  -1.692
    2    HA   CYS 750           HA       CYS 750  57.286 -16.248  -2.464
    3    HB2  CYS 750           HB2      CYS 750  57.592 -14.148  -3.645
    4    HB3  CYS 750           HB3      CYS 750  56.005 -14.788  -4.034

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLN 751           H        GLN 751  55.802 -14.405   0.066
    2    HA   GLN 751           HA       GLN 751  58.069 -13.233   1.230
    3    HB2  GLN 751           HB2      GLN 751  55.610 -14.406   2.538
    4    HB3  GLN 751           HB3      GLN 751  56.825 -13.492   3.406
    5    HG2  GLN 751           HG2      GLN 751  55.149 -12.449   1.139
    6    HG3  GLN 751           HG3      GLN 751  54.822 -12.167   2.841
    7   HE21  GLN 751          HE21      GLN 751  55.279 -10.192   0.824
    8   HE22  GLN 751          HE22      GLN 751  56.699  -9.332   1.275

  No H/Q in entry =           8
  In of MODEL   11
    1    H    GLY 752           H        GLY 752  56.856 -16.486   1.293
    2    HA3  GLY 752           HA2      GLY 752  58.560 -18.251   1.474
    3    HA2  GLY 752           HA3      GLY 752  59.279 -17.305   2.772

  No H/Q in entry =           3
  In of MODEL   11
    1    H    ARG 753           H        ARG 753  55.838 -17.791   2.335
    2    HA   ARG 753           HA       ARG 753  55.783 -19.347   4.818
    3    HB2  ARG 753           HB2      ARG 753  53.538 -17.928   3.369
    4    HB3  ARG 753           HB3      ARG 753  53.417 -18.762   4.905
    5    HG2  ARG 753           HG2      ARG 753  55.058 -16.282   4.406
    6    HG3  ARG 753           HG3      ARG 753  53.441 -16.293   5.091
    7    HD2  ARG 753           HD2      ARG 753  54.899 -16.111   6.932
    8    HD3  ARG 753           HD3      ARG 753  54.368 -17.787   6.916
    9    HE   ARG 753           HE       ARG 753  56.754 -17.658   5.497
   10   HH11  ARG 753          HH11      ARG 753  55.617 -17.280   8.824
   11   HH12  ARG 753          HH12      ARG 753  57.143 -17.543   9.523
   12   HH21  ARG 753          HH21      ARG 753  58.847 -18.001   6.441
   13   HH22  ARG 753          HH22      ARG 753  59.040 -17.973   8.135

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ASN 754           H        ASN 754  54.595 -21.301   4.811
    2    HA   ASN 754           HA       ASN 754  54.257 -22.406   2.127
    3    HB2  ASN 754           HB2      ASN 754  54.767 -23.807   4.755
    4    HB3  ASN 754           HB3      ASN 754  54.505 -24.618   3.223
    5   HD21  ASN 754          HD21      ASN 754  56.779 -24.514   5.079
    6   HD22  ASN 754          HD22      ASN 754  58.134 -24.032   4.130

  No H/Q in entry =           6
  In of MODEL   11
    1    H    TYR 755           H        TYR 755  52.298 -22.745   1.479
    2    HA   TYR 755           HA       TYR 755  50.257 -23.602   3.352
    3    HB2  TYR 755           HB2      TYR 755  50.022 -21.260   1.477
    4    HB3  TYR 755           HB3      TYR 755  48.622 -22.171   2.022
    5    HD1  TYR 755           HD1      TYR 755  51.484 -20.127   3.199
    6    HD2  TYR 755           HD2      TYR 755  47.633 -21.635   4.115
    7    HE1  TYR 755           HE1      TYR 755  51.388 -18.661   5.160
    8    HE2  TYR 755           HE2      TYR 755  47.535 -20.177   6.091
    9    HH   TYR 755           HH       TYR 755  49.671 -17.621   6.591

  No H/Q in entry =           9
  In of MODEL   11
    1    H    THR 756           H        THR 756  48.933 -25.053   2.483
    2    HA   THR 756           HA       THR 756  49.641 -25.962  -0.184
    3    HB   THR 756           HB       THR 756  48.049 -27.293   2.032
    4    HG1  THR 756           HG1      THR 756  49.932 -27.639   2.851
    5   HG23  THR 756          HG21      THR 756  47.503 -28.095  -0.169
    6   HG22  THR 756          HG22      THR 756  48.373 -29.343   0.748
    7   HG21  THR 756          HG23      THR 756  49.207 -28.398  -0.510

  No H/Q in entry =           7
  In of MODEL   11
    1    H    LEU 757           H        LEU 757  47.884 -26.312  -1.711
    2    HA   LEU 757           HA       LEU 757  45.665 -24.626  -0.994
    3    HB2  LEU 757           HB2      LEU 757  46.709 -25.407  -3.670
    4    HB3  LEU 757           HB3      LEU 757  45.165 -24.601  -3.440
    5    HG   LEU 757           HG       LEU 757  46.947 -23.115  -1.972
    6   HD12  LEU 757          HD11      LEU 757  48.211 -23.813  -4.599
    7   HD11  LEU 757          HD12      LEU 757  48.822 -24.180  -2.981
    8   HD13  LEU 757          HD13      LEU 757  48.704 -22.504  -3.516
    9   HD22  LEU 757          HD21      LEU 757  46.504 -21.430  -3.635
   10   HD21  LEU 757          HD22      LEU 757  45.053 -22.310  -3.159
   11   HD23  LEU 757          HD23      LEU 757  45.831 -22.662  -4.713

  No H/Q in entry =          11
  In of MODEL   11
    1    H    THR 758           H        THR 758  43.674 -25.143  -1.173
    2    HA   THR 758           HA       THR 758  43.093 -27.938  -1.661
    3    HB   THR 758           HB       THR 758  41.425 -27.719   0.258
    4    HG1  THR 758           HG1      THR 758  42.125 -25.177   0.156
    5   HG22  THR 758          HG21      THR 758  44.342 -27.337   0.999
    6   HG21  THR 758          HG22      THR 758  43.618 -28.860   0.509
    7   HG23  THR 758          HG23      THR 758  43.105 -28.091   2.006

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLY 759           H        GLY 759  40.263 -27.561  -1.276
    2    HA3  GLY 759           HA2      GLY 759  39.778 -25.916  -3.658
    3    HA2  GLY 759           HA3      GLY 759  38.785 -27.273  -3.121

  No H/Q in entry =           3
  In of MODEL   11
    1    H    ARG 760           H        ARG 760  37.435 -25.024  -3.635
    2    HA   ARG 760           HA       ARG 760  37.214 -23.210  -1.438
    3    HB2  ARG 760           HB2      ARG 760  35.400 -22.194  -2.548
    4    HB3  ARG 760           HB3      ARG 760  36.285 -22.908  -3.881
    5    HG2  ARG 760           HG2      ARG 760  33.832 -24.107  -2.580
    6    HG3  ARG 760           HG3      ARG 760  33.832 -23.183  -4.074
    7    HD2  ARG 760           HD2      ARG 760  35.064 -24.895  -5.204
    8    HD3  ARG 760           HD3      ARG 760  35.409 -25.701  -3.667
    9    HE   ARG 760           HE       ARG 760  32.746 -25.725  -3.726
   10   HH11  ARG 760          HH11      ARG 760  35.100 -26.746  -6.202
   11   HH12  ARG 760          HH12      ARG 760  34.113 -28.010  -6.754
   12   HH21  ARG 760          HH21      ARG 760  31.450 -27.528  -4.533
   13   HH22  ARG 760          HH22      ARG 760  32.066 -28.462  -5.819

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ASP 761           H        ASP 761  36.219 -26.352  -1.894
    2    HA   ASP 761           HA       ASP 761  33.925 -26.484  -0.236
    3    HB2  ASP 761           HB2      ASP 761  34.196 -28.101  -1.973
    4    HB3  ASP 761           HB3      ASP 761  35.794 -28.540  -1.405

  No H/Q in entry =           4
  In of MODEL   11
    1    H    SER 762           H        SER 762  37.321 -26.471   0.332
    2    HA   SER 762           HA       SER 762  37.372 -28.149   2.605
    3    HB2  SER 762           HB2      SER 762  39.408 -26.123   1.723
    4    HB3  SER 762           HB3      SER 762  39.682 -27.502   2.780
    5    HG   SER 762           HG       SER 762  38.642 -28.627   0.808

  No H/Q in entry =           5
  In of MODEL   11
    1    H    CYS 763           H        CYS 763  36.839 -24.660   2.270
    2    HA   CYS 763           HA       CYS 763  36.616 -24.585   5.194
    3    HB2  CYS 763           HB2      CYS 763  37.723 -22.483   5.372
    4    HB3  CYS 763           HB3      CYS 763  38.771 -23.530   4.437

  No H/Q in entry =           4
  In of MODEL   11
    1    H    THR 764           H        THR 764  35.495 -22.473   5.884
    2    HA   THR 764           HA       THR 764  33.124 -22.152   4.287
    3    HB   THR 764           HB       THR 764  33.933 -20.790   6.876
    4    HG1  THR 764           HG1      THR 764  32.247 -23.056   6.501
    5   HG21  THR 764          HG21      THR 764  31.243 -21.166   5.554
    6   HG23  THR 764          HG22      THR 764  32.152 -19.660   5.650
    7   HG22  THR 764          HG23      THR 764  31.521 -20.404   7.122

  No H/Q in entry =           7
  In of MODEL   11
    1    H    LEU 765           H        LEU 765  33.478 -20.969   2.542
    2    HA   LEU 765           HA       LEU 765  35.239 -18.668   2.718
    3    HB2  LEU 765           HB2      LEU 765  35.382 -20.733   1.125
    4    HB3  LEU 765           HB3      LEU 765  34.133 -19.865   0.258
    5    HG   LEU 765           HG       LEU 765  35.646 -17.979  -0.051
    6   HD11  LEU 765          HD11      LEU 765  37.562 -19.812   1.367
    7   HD13  LEU 765          HD12      LEU 765  37.000 -18.260   1.966
    8   HD12  LEU 765          HD13      LEU 765  38.044 -18.336   0.535
    9   HD23  LEU 765          HD21      LEU 765  37.127 -19.104  -1.607
   10   HD22  LEU 765          HD22      LEU 765  35.491 -19.759  -1.697
   11   HD21  LEU 765          HD23      LEU 765  36.757 -20.657  -0.857

  No H/Q in entry =          11
  In of MODEL   11
    1    HA   PRO 766           HA       PRO 766  31.632 -16.030   2.166
    2    HB2  PRO 766           HB2      PRO 766  33.010 -13.847   1.150
    3    HB3  PRO 766           HB3      PRO 766  32.764 -14.166   2.859
    4    HG2  PRO 766           HG2      PRO 766  35.168 -14.534   1.193
    5    HG3  PRO 766           HG3      PRO 766  35.042 -14.265   2.937
    6    HD2  PRO 766           HD2      PRO 766  35.625 -16.671   1.710
    7    HD3  PRO 766           HD3      PRO 766  35.035 -16.504   3.368

  No H/Q in entry =           7
  In of MODEL   11
    1    H    ALA 767           H        ALA 767  34.124 -15.882  -0.375
    2    HA   ALA 767           HA       ALA 767  32.063 -15.452  -2.359
    3    HB2  ALA 767           HB1      ALA 767  34.177 -14.176  -2.436
    4    HB3  ALA 767           HB2      ALA 767  33.816 -15.063  -3.927
    5    HB1  ALA 767           HB3      ALA 767  35.031 -15.683  -2.796

  No H/Q in entry =           5
  In of MODEL   11
    1    H    SER 768           H        SER 768  30.971 -17.069  -2.285
    2    HA   SER 768           HA       SER 768  31.768 -19.268  -3.939
    3    HB2  SER 768           HB2      SER 768  30.855 -19.733  -1.087
    4    HB3  SER 768           HB3      SER 768  31.035 -20.972  -2.331
    5    HG   SER 768           HG       SER 768  33.261 -19.483  -2.107

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA 769           H        ALA 769  29.336 -17.800  -1.796
    2    HA   ALA 769           HA       ALA 769  27.185 -18.877  -3.438
    3    HB3  ALA 769           HB1      ALA 769  27.065 -19.229  -1.008
    4    HB2  ALA 769           HB2      ALA 769  25.728 -18.248  -1.599
    5    HB1  ALA 769           HB3      ALA 769  27.076 -17.482  -0.763

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLU 770           H        GLU 770  25.277 -17.349  -3.608
    2    HA   GLU 770           HA       GLU 770  25.906 -15.169  -5.226
    3    HB2  GLU 770           HB2      GLU 770  23.436 -14.636  -5.048
    4    HB3  GLU 770           HB3      GLU 770  23.854 -16.234  -5.632
    5    HG2  GLU 770           HG2      GLU 770  22.084 -16.677  -4.162
    6    HG3  GLU 770           HG3      GLU 770  23.542 -16.959  -3.206

  No H/Q in entry =           6
  In of MODEL   11
    1    H    LYS 771           H        LYS 771  25.732 -12.957  -5.018
    2    HA   LYS 771           HA       LYS 771  25.945 -11.989  -2.253
    3    HB2  LYS 771           HB2      LYS 771  27.314 -10.935  -4.740
    4    HB3  LYS 771           HB3      LYS 771  27.353 -10.180  -3.171
    5    HG2  LYS 771           HG2      LYS 771  28.479 -12.918  -3.771
    6    HG3  LYS 771           HG3      LYS 771  29.422 -11.433  -3.710
    7    HD2  LYS 771           HD2      LYS 771  29.783 -12.215  -1.578
    8    HD3  LYS 771           HD3      LYS 771  28.337 -11.259  -1.295
    9    HE2  LYS 771           HE2      LYS 771  27.004 -13.430  -1.579
   10    HE3  LYS 771           HE3      LYS 771  28.537 -14.245  -1.648
   11    HZ2  LYS 771           HZ1      LYS 771  27.546 -14.258   0.559
   12    HZ1  LYS 771           HZ2      LYS 771  27.645 -12.589   0.623
   13    HZ3  LYS 771           HZ3      LYS 771  29.056 -13.502   0.565

  No H/Q in entry =          13
  In of MODEL   11
    1    H    ALA 772           H        ALA 772  24.468 -10.629  -1.650
    2    HA   ALA 772           HA       ALA 772  22.764  -9.304  -3.631
    3    HB2  ALA 772           HB1      ALA 772  21.635 -10.544  -1.841
    4    HB1  ALA 772           HB2      ALA 772  21.320  -8.814  -1.682
    5    HB3  ALA 772           HB3      ALA 772  22.497  -9.597  -0.629

  No H/Q in entry =           5
  In of MODEL   11
    1    H    CYS 773           H        CYS 773  22.112  -6.981  -2.824
    2    HA   CYS 773           HA       CYS 773  24.489  -5.438  -2.964
    3    HB2  CYS 773           HB2      CYS 773  22.261  -4.715  -3.890
    4    HB3  CYS 773           HB3      CYS 773  21.712  -4.469  -2.237

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLY 774           H        GLY 774  25.692  -4.579  -1.398
    2    HA3  GLY 774           HA2      GLY 774  25.673  -3.688   0.922
    3    HA2  GLY 774           HA3      GLY 774  24.919  -5.228   1.362

  No H/Q in entry =           3
  In of MODEL   11
    1    H    ALA 775           H        ALA 775  26.457  -6.535  -0.800
    2    HA   ALA 775           HA       ALA 775  29.207  -6.279   0.012
    3    HB2  ALA 775           HB1      ALA 775  28.320  -7.995   1.533
    4    HB1  ALA 775           HB2      ALA 775  29.437  -8.699   0.366
    5    HB3  ALA 775           HB3      ALA 775  27.700  -8.897   0.152

  No H/Q in entry =           5
  In of MODEL   11
    1    H    CYS 776           H        CYS 776  29.820  -5.694  -1.981
    2    HA   CYS 776           HA       CYS 776  29.393  -7.632  -4.095
    3    HB2  CYS 776           HB2      CYS 776  29.027  -4.631  -4.403
    4    HB3  CYS 776           HB3      CYS 776  29.037  -5.802  -5.718

  No H/Q in entry =           4
  In of MODEL   11
    1    HA   PRO 777           HA       PRO 777  33.820  -6.730  -3.956
    2    HB2  PRO 777           HB2      PRO 777  34.056  -9.004  -5.785
    3    HB3  PRO 777           HB3      PRO 777  34.693  -8.833  -4.149
    4    HG2  PRO 777           HG2      PRO 777  32.680 -10.531  -4.749
    5    HG3  PRO 777           HG3      PRO 777  32.815  -9.725  -3.178
    6    HD2  PRO 777           HD2      PRO 777  31.068  -9.045  -5.512
    7    HD3  PRO 777           HD3      PRO 777  30.700  -9.047  -3.770

  No H/Q in entry =           7
  In of MODEL   11
    1    H    LEU 778           H        LEU 778  35.455  -6.883  -5.905
    2    HA   LEU 778           HA       LEU 778  35.023  -4.939  -7.740
    3    HB2  LEU 778           HB2      LEU 778  36.896  -5.941  -9.090
    4    HB3  LEU 778           HB3      LEU 778  37.217  -5.645  -7.399
    5    HG   LEU 778           HG       LEU 778  36.449  -8.404  -8.335
    6   HD12  LEU 778          HD11      LEU 778  38.774  -8.957  -8.501
    7   HD11  LEU 778          HD12      LEU 778  39.242  -7.265  -8.256
    8   HD13  LEU 778          HD13      LEU 778  38.352  -7.748  -9.713
    9   HD21  LEU 778          HD21      LEU 778  38.026  -7.354  -5.981
   10   HD23  LEU 778          HD22      LEU 778  37.900  -9.049  -6.418
   11   HD22  LEU 778          HD23      LEU 778  36.459  -8.178  -5.938

  No H/Q in entry =          11
  In of MODEL   11
    1    H    TRP 779           H        TRP 779  34.180  -8.338  -8.251
    2    HA   TRP 779           HA       TRP 779  33.256  -7.790 -10.951
    3    HB2  TRP 779           HB2      TRP 779  32.646 -10.265 -10.907
    4    HB3  TRP 779           HB3      TRP 779  34.358  -9.883 -10.791
    5    HD1  TRP 779           HD1      TRP 779  31.423 -11.111  -8.550
    6    HE1  TRP 779           HE1      TRP 779  32.464 -12.267  -6.494
    7    HE3  TRP 779           HE3      TRP 779  36.326 -10.180  -9.492
    8    HZ2  TRP 779           HZ2      TRP 779  35.071 -12.712  -5.425
    9    HZ3  TRP 779           HZ3      TRP 779  38.027 -11.011  -7.926
   10    HH2  TRP 779           HH2      TRP 779  37.398 -12.247  -5.944

  No H/Q in entry =          10
  In of MODEL   11
    1    H    GLY 780           H        GLY 780  31.896  -6.810  -8.332
    2    HA3  GLY 780           HA2      GLY 780  29.212  -7.509  -9.278
    3    HA2  GLY 780           HA3      GLY 780  29.600  -7.712  -7.574

  No H/Q in entry =           3
  In of MODEL   11
    1    H    LYS 781           H        LYS 781  27.667  -5.926  -8.904
    2    HA   LYS 781           HA       LYS 781  28.236  -3.691  -7.255
    3    HB2  LYS 781           HB2      LYS 781  29.588  -3.001  -9.143
    4    HB3  LYS 781           HB3      LYS 781  28.244  -3.227 -10.252
    5    HG2  LYS 781           HG2      LYS 781  27.073  -1.363  -9.321
    6    HG3  LYS 781           HG3      LYS 781  28.207  -1.253  -7.984
    7    HD2  LYS 781           HD2      LYS 781  28.926  -0.777 -10.885
    8    HD3  LYS 781           HD3      LYS 781  28.560   0.496  -9.717
    9    HE2  LYS 781           HE2      LYS 781  30.449  -0.365  -8.307
   10    HE3  LYS 781           HE3      LYS 781  30.852  -1.469  -9.619
   11    HZ1  LYS 781           HZ1      LYS 781  31.188   0.486 -11.051
   12    HZ3  LYS 781           HZ2      LYS 781  32.231   0.456  -9.753
   13    HZ2  LYS 781           HZ3      LYS 781  30.912   1.505  -9.735

  No H/Q in entry =          13
  In of MODEL   11
    1    H    CYS 782           H        CYS 782  26.425  -2.872  -6.486
    2    HA   CYS 782           HA       CYS 782  23.991  -3.455  -7.966
    3    HB2  CYS 782           HB2      CYS 782  22.827  -3.066  -5.746
    4    HB3  CYS 782           HB3      CYS 782  23.851  -4.492  -5.810

  No H/Q in entry =           4
  In of MODEL   11
    1    H    ASP 783           H        ASP 783  24.199  -1.778  -9.325
    2    HA   ASP 783           HA       ASP 783  24.260   0.925  -8.185
    3    HB2  ASP 783           HB2      ASP 783  25.990   0.466  -9.821
    4    HB3  ASP 783           HB3      ASP 783  24.798  -0.100 -10.974

  No H/Q in entry =           4
  In of MODEL   11
    1    H    ALA 784           H        ALA 784  22.673  -0.832 -10.812
    2    HA   ALA 784           HA       ALA 784  20.311   0.904 -10.523
    3    HB3  ALA 784           HB1      ALA 784  21.316   0.787 -12.764
    4    HB2  ALA 784           HB2      ALA 784  19.706   0.071 -12.764
    5    HB1  ALA 784           HB3      ALA 784  21.133  -0.967 -12.758

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLU 785           H        GLU 785  20.957  -1.172  -8.691
    2    HA   GLU 785           HA       GLU 785  19.097  -3.358  -9.306
    3    HB2  GLU 785           HB2      GLU 785  21.551  -3.192  -7.621
    4    HB3  GLU 785           HB3      GLU 785  20.387  -4.494  -7.432
    5    HG2  GLU 785           HG2      GLU 785  21.706  -3.817 -10.033
    6    HG3  GLU 785           HG3      GLU 785  22.347  -4.998  -8.888

  No H/Q in entry =           6
  In of MODEL   11
    1    H    SER 786           H        SER 786  17.789  -4.168  -7.661
    2    HA   SER 786           HA       SER 786  17.408  -2.439  -5.339
    3    HB2  SER 786           HB2      SER 786  15.378  -4.059  -6.898
    4    HB3  SER 786           HB3      SER 786  15.035  -3.221  -5.388
    5    HG   SER 786           HG       SER 786  16.188  -1.774  -7.490

  No H/Q in entry =           5
  In of MODEL   11
    1    H    SER 787           H        SER 787  18.578  -3.533  -3.860
    2    HA   SER 787           HA       SER 787  19.041  -4.959  -2.219
    3    HB2  SER 787           HB2      SER 787  16.637  -6.547  -3.158
    4    HB3  SER 787           HB3      SER 787  17.504  -6.821  -1.643
    5    HG   SER 787           HG       SER 787  17.035  -4.298  -1.667

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LYS 788           H        LYS 788  18.567  -6.459  -5.294
    2    HA   LYS 788           HA       LYS 788  20.452  -8.594  -4.797
    3    HB2  LYS 788           HB2      LYS 788  18.557  -8.959  -6.276
    4    HB3  LYS 788           HB3      LYS 788  19.017  -7.594  -7.278
    5    HG2  LYS 788           HG2      LYS 788  21.118  -8.890  -7.829
    6    HG3  LYS 788           HG3      LYS 788  20.362 -10.275  -7.039
    7    HD2  LYS 788           HD2      LYS 788  18.692 -10.433  -8.661
    8    HD3  LYS 788           HD3      LYS 788  18.927  -8.767  -9.198
    9    HE2  LYS 788           HE2      LYS 788  20.840 -11.079  -9.669
   10    HE3  LYS 788           HE3      LYS 788  19.874 -10.238 -10.887
   11    HZ1  LYS 788           HZ1      LYS 788  21.080  -8.206 -10.131
   12    HZ3  LYS 788           HZ2      LYS 788  21.934  -9.364 -11.032
   13    HZ2  LYS 788           HZ3      LYS 788  22.170  -9.257  -9.369

  No H/Q in entry =          13
  In of MODEL   11
    1    H    CYS 789           H        CYS 789  22.402  -8.742  -6.360
    2    HA   CYS 789           HA       CYS 789  23.507  -6.110  -7.046
    3    HB2  CYS 789           HB2      CYS 789  24.501  -7.083  -4.937
    4    HB3  CYS 789           HB3      CYS 789  24.970  -8.504  -5.852

  No H/Q in entry =           4
  In of MODEL   11
    1    H    VAL 790           H        VAL 790  24.631  -6.169  -9.158
    2    HA   VAL 790           HA       VAL 790  24.221  -8.752 -10.476
    3    HB   VAL 790           HB       VAL 790  24.378  -7.737 -12.640
    4   HG12  VAL 790          HG11      VAL 790  22.475  -6.294 -12.785
    5   HG11  VAL 790          HG12      VAL 790  22.441  -6.208 -11.023
    6   HG13  VAL 790          HG13      VAL 790  22.214  -7.754 -11.838
    7   HG23  VAL 790          HG21      VAL 790  24.868  -5.085 -11.298
    8   HG22  VAL 790          HG22      VAL 790  24.611  -5.316 -13.028
    9   HG21  VAL 790          HG23      VAL 790  26.031  -6.009 -12.245

  No H/Q in entry =           9
  In of MODEL   11
    1    H    CYS 791           H        CYS 791  25.845  -9.112 -12.242
    2    HA   CYS 791           HA       CYS 791  28.429  -9.065 -10.906
    3    HB2  CYS 791           HB2      CYS 791  27.764 -10.709 -13.323
    4    HB3  CYS 791           HB3      CYS 791  28.791 -11.062 -11.946

  No H/Q in entry =           4
  In of MODEL   11
    1    H    ARG 792           H        ARG 792  30.151  -8.215 -11.883
    2    HA   ARG 792           HA       ARG 792  29.690  -6.538 -14.240
    3    HB2  ARG 792           HB2      ARG 792  32.071  -6.630 -12.371
    4    HB3  ARG 792           HB3      ARG 792  31.785  -5.444 -13.634
    5    HG2  ARG 792           HG2      ARG 792  29.807  -4.644 -12.409
    6    HG3  ARG 792           HG3      ARG 792  30.145  -5.815 -11.139
    7    HD2  ARG 792           HD2      ARG 792  31.014  -3.684 -10.457
    8    HD3  ARG 792           HD3      ARG 792  32.359  -4.761 -10.807
    9    HE   ARG 792           HE       ARG 792  31.389  -2.764 -12.720
   10   HH11  ARG 792          HH11      ARG 792  34.103  -4.307 -10.993
   11   HH12  ARG 792          HH12      ARG 792  35.294  -3.299 -11.654
   12   HH21  ARG 792          HH21      ARG 792  33.041  -1.380 -13.641
   13   HH22  ARG 792          HH22      ARG 792  34.680  -1.602 -13.229

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLU 793           H        GLU 793  31.075  -6.739 -15.986
    2    HA   GLU 793           HA       GLU 793  32.070  -9.432 -16.364
    3    HB2  GLU 793           HB2      GLU 793  31.687  -7.077 -18.135
    4    HB3  GLU 793           HB3      GLU 793  32.732  -8.388 -18.649
    5    HG2  GLU 793           HG2      GLU 793  29.921  -8.862 -17.736
    6    HG3  GLU 793           HG3      GLU 793  30.333  -8.488 -19.412

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ALA 794           H        ALA 794  34.158  -9.738 -17.477
    2    HA   ALA 794           HA       ALA 794  36.246  -8.949 -15.801
    3    HB1  ALA 794           HB1      ALA 794  36.404 -10.083 -18.592
    4    HB2  ALA 794           HB2      ALA 794  36.198 -11.021 -17.121
    5    HB3  ALA 794           HB3      ALA 794  37.682 -10.096 -17.375

  No H/Q in entry =           5
  In of MODEL   11
    1    H    SER 795           H        SER 795  34.997  -7.771 -18.815
    2    HA   SER 795           HA       SER 795  37.116  -6.026 -19.423
    3    HB2  SER 795           HB2      SER 795  34.271  -6.028 -20.426
    4    HB3  SER 795           HB3      SER 795  35.631  -5.194 -21.181
    5    HG   SER 795           HG       SER 795  36.638  -7.242 -21.390

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLU 796           H        GLU 796  34.699  -5.817 -17.054
    2    HA   GLU 796           HA       GLU 796  34.506  -2.925 -17.189
    3    HB2  GLU 796           HB2      GLU 796  33.163  -4.938 -15.382
    4    HB3  GLU 796           HB3      GLU 796  32.941  -3.204 -15.229
    5    HG2  GLU 796           HG2      GLU 796  32.050  -3.185 -17.565
    6    HG3  GLU 796           HG3      GLU 796  32.153  -4.942 -17.565

  No H/Q in entry =           6
  In of MODEL   11
    1    H    CYS 797           H        CYS 797  36.153  -5.410 -15.450
    2    HA   CYS 797           HA       CYS 797  36.839  -3.766 -13.232
    3    HB2  CYS 797           HB2      CYS 797  37.880  -6.434 -14.138
    4    HB3  CYS 797           HB3      CYS 797  38.432  -5.619 -12.677

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLU 798           H        GLU 798  38.283  -2.224 -13.216
    2    HA   GLU 798           HA       GLU 798  40.356  -2.061 -15.258
    3    HB2  GLU 798           HB2      GLU 798  40.842   0.126 -14.325
    4    HB3  GLU 798           HB3      GLU 798  39.097  -0.022 -14.481
    5    HG2  GLU 798           HG2      GLU 798  38.957  -0.564 -12.082
    6    HG3  GLU 798           HG3      GLU 798  40.696  -0.352 -11.954

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU 799           H        GLU 799  39.844  -3.286 -12.212
    2    HA   GLU 799           HA       GLU 799  42.261  -2.986 -10.839
    3    HB2  GLU 799           HB2      GLU 799  40.003  -3.882 -10.003
    4    HB3  GLU 799           HB3      GLU 799  40.474  -5.402 -10.726
    5    HG2  GLU 799           HG2      GLU 799  40.928  -5.357  -8.337
    6    HG3  GLU 799           HG3      GLU 799  42.411  -5.538  -9.280

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLU 800           H        GLU 800  44.212  -3.991 -11.058
    2    HA   GLU 800           HA       GLU 800  44.559  -5.823 -13.264
    3    HB2  GLU 800           HB2      GLU 800  46.612  -4.817 -11.290
    4    HB3  GLU 800           HB3      GLU 800  46.935  -5.625 -12.809
    5    HG2  GLU 800           HG2      GLU 800  46.069  -3.725 -14.039
    6    HG3  GLU 800           HG3      GLU 800  45.662  -2.915 -12.524

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLY 801           H        GLY 801  43.014  -7.126 -11.897
    2    HA3  GLY 801           HA2      GLY 801  43.811  -8.488  -9.595
    3    HA2  GLY 801           HA3      GLY 801  42.585  -9.022 -10.735

  No H/Q in entry =           3
  In of MODEL   11
    1    H    PHE 802           H        PHE 802  44.306 -10.682  -9.396
    2    HA   PHE 802           HA       PHE 802  46.666 -11.353 -10.762
    3    HB2  PHE 802           HB2      PHE 802  44.976 -12.768  -8.770
    4    HB3  PHE 802           HB3      PHE 802  46.392 -13.529  -9.479
    5    HD1  PHE 802           HD1      PHE 802  45.983  -9.960  -8.461
    6    HD2  PHE 802           HD2      PHE 802  47.800 -13.708  -7.697
    7    HE1  PHE 802           HE1      PHE 802  47.352  -8.937  -6.732
    8    HE2  PHE 802           HE2      PHE 802  49.166 -12.723  -5.999
    9    HZ   PHE 802           HZ       PHE 802  48.977 -10.303  -5.475

  No H/Q in entry =           9
  In of MODEL   11
    1    H    SER 803           H        SER 803  47.021 -13.685 -11.444
    2    HA   SER 803           HA       SER 803  44.940 -14.457 -13.295
    3    HB2  SER 803           HB2      SER 803  46.996 -15.452 -14.528
    4    HB3  SER 803           HB3      SER 803  46.730 -13.711 -14.604
    5    HG   SER 803           HG       SER 803  48.927 -14.724 -13.927

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ILE 804           H        ILE 804  44.186 -16.423 -13.068
    2    HA   ILE 804           HA       ILE 804  45.585 -18.358 -11.363
    3    HB   ILE 804           HB       ILE 804  43.589 -18.971 -10.144
    4   HG12  ILE 804          HG12      ILE 804  41.855 -18.533 -11.885
    5   HG13  ILE 804          HG13      ILE 804  41.415 -17.880 -10.316
    6   HG23  ILE 804          HG21      ILE 804  43.135 -16.972  -8.803
    7   HG22  ILE 804          HG22      ILE 804  43.904 -15.991 -10.049
    8   HG21  ILE 804          HG23      ILE 804  44.856 -17.177  -9.155
    9   HD13  ILE 804          HD11      ILE 804  40.783 -16.386 -12.087
   10   HD12  ILE 804          HD12      ILE 804  42.431 -16.324 -12.678
   11   HD11  ILE 804          HD13      ILE 804  42.038 -15.637 -11.096

  No H/Q in entry =          11
  In of MODEL   11
    1    H    CYS 805           H        CYS 805  44.475 -20.582 -11.617
    2    HA   CYS 805           HA       CYS 805  43.791 -20.844 -14.450
    3    HB2  CYS 805           HB2      CYS 805  45.945 -21.881 -13.591
    4    HB3  CYS 805           HB3      CYS 805  44.932 -22.973 -12.642

  No H/Q in entry =           4
  In of MODEL   11
    1    H    VAL 806           H        VAL 806  41.774 -21.604 -14.882
    2    HA   VAL 806           HA       VAL 806  40.243 -22.847 -12.697
    3    HB   VAL 806           HB       VAL 806  39.174 -20.983 -14.800
    4   HG11  VAL 806          HG11      VAL 806  37.894 -22.082 -12.313
    5   HG13  VAL 806          HG12      VAL 806  37.476 -22.431 -13.982
    6   HG12  VAL 806          HG13      VAL 806  37.221 -20.806 -13.322
    7   HG23  VAL 806          HG21      VAL 806  38.944 -19.262 -13.036
    8   HG22  VAL 806          HG22      VAL 806  40.602 -19.640 -13.467
    9   HG21  VAL 806          HG23      VAL 806  39.920 -20.281 -11.967

  No H/Q in entry =           9
  In of MODEL   11
    1    H    GLU 807           H        GLU 807  39.195 -24.720 -13.319
    2    HA   GLU 807           HA       GLU 807  39.541 -25.614 -16.052
    3    HB2  GLU 807           HB2      GLU 807  39.922 -27.123 -14.056
    4    HB3  GLU 807           HB3      GLU 807  38.190 -27.007 -13.751
    5    HG2  GLU 807           HG2      GLU 807  37.760 -27.938 -15.984
    6    HG3  GLU 807           HG3      GLU 807  39.494 -28.145 -16.209

  No H/Q in entry =           6
  In of MODEL   11
    1    H    VAL 808           H        VAL 808  38.102 -25.059 -17.446
    2    HA   VAL 808           HA       VAL 808  35.283 -24.947 -16.698
    3    HB   VAL 808           HB       VAL 808  36.714 -22.970 -18.450
    4   HG12  VAL 808          HG11      VAL 808  33.850 -22.988 -17.609
    5   HG11  VAL 808          HG12      VAL 808  34.487 -23.327 -19.222
    6   HG13  VAL 808          HG13      VAL 808  34.661 -21.711 -18.527
    7   HG22  VAL 808          HG21      VAL 808  37.332 -22.532 -16.229
    8   HG21  VAL 808          HG22      VAL 808  35.665 -22.636 -15.688
    9   HG23  VAL 808          HG23      VAL 808  36.171 -21.310 -16.744

  No H/Q in entry =           9
  In of MODEL   11
    1    H    ASN 809           H        ASN 809  34.104 -26.072 -18.136
    2    HA   ASN 809           HA       ASN 809  33.447 -27.204 -19.972
    3    HB2  ASN 809           HB2      ASN 809  35.599 -25.574 -21.240
    4    HB3  ASN 809           HB3      ASN 809  34.752 -26.803 -22.159
    5   HD21  ASN 809          HD21      ASN 809  34.847 -23.893 -22.329
    6   HD22  ASN 809          HD22      ASN 809  33.202 -23.369 -22.277

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLY 810           H        GLY 810  36.066 -27.816 -18.301
    2    HA3  GLY 810           HA2      GLY 810  36.814 -30.090 -18.115
    3    HA2  GLY 810           HA3      GLY 810  36.728 -30.171 -19.889

  No H/Q in entry =           3
  In of MODEL   11
    1    H    LYS 811           H        LYS 811  37.879 -27.404 -19.861
    2    HA   LYS 811           HA       LYS 811  40.672 -28.309 -19.745
    3    HB2  LYS 811           HB2      LYS 811  41.051 -26.503 -21.436
    4    HB3  LYS 811           HB3      LYS 811  40.029 -27.823 -21.988
    5    HG2  LYS 811           HG2      LYS 811  38.038 -26.453 -21.508
    6    HG3  LYS 811           HG3      LYS 811  39.095 -25.125 -21.045
    7    HD2  LYS 811           HD2      LYS 811  39.058 -26.466 -23.716
    8    HD3  LYS 811           HD3      LYS 811  38.205 -24.966 -23.346
    9    HE2  LYS 811           HE2      LYS 811  40.411 -23.965 -22.705
   10    HE3  LYS 811           HE3      LYS 811  41.185 -25.437 -23.269
   11    HZ2  LYS 811           HZ1      LYS 811  41.220 -23.714 -24.964
   12    HZ1  LYS 811           HZ2      LYS 811  39.545 -23.631 -24.963
   13    HZ3  LYS 811           HZ3      LYS 811  40.307 -25.035 -25.472

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLU 812           H        GLU 812  42.246 -26.851 -18.973
    2    HA   GLU 812           HA       GLU 812  41.148 -25.011 -17.022
    3    HB2  GLU 812           HB2      GLU 812  43.945 -26.060 -17.386
    4    HB3  GLU 812           HB3      GLU 812  43.507 -24.845 -16.196
    5    HG2  GLU 812           HG2      GLU 812  41.954 -26.454 -15.166
    6    HG3  GLU 812           HG3      GLU 812  42.492 -27.666 -16.330

  No H/Q in entry =           6
  In of MODEL   11
    1    H    GLN 813           H        GLN 813  40.872 -23.060 -17.474
    2    HA   GLN 813           HA       GLN 813  42.624 -21.748 -19.428
    3    HB2  GLN 813           HB2      GLN 813  40.341 -21.781 -20.155
    4    HB3  GLN 813           HB3      GLN 813  39.768 -21.160 -18.606
    5    HG2  GLN 813           HG2      GLN 813  40.987 -19.082 -19.052
    6    HG3  GLN 813           HG3      GLN 813  41.474 -19.682 -20.625
    7   HE21  GLN 813          HE21      GLN 813  38.751 -21.002 -20.948
    8   HE22  GLN 813          HE22      GLN 813  37.714 -19.673 -21.318

  No H/Q in entry =           8
  In of MODEL   11
    1    H    THR 814           H        THR 814  43.620 -19.955 -18.809
    2    HA   THR 814           HA       THR 814  43.699 -19.364 -15.983
    3    HB   THR 814           HB       THR 814  45.243 -18.307 -18.311
    4    HG1  THR 814           HG1      THR 814  45.160 -20.644 -17.191
    5   HG23  THR 814          HG21      THR 814  46.911 -17.632 -16.592
    6   HG22  THR 814          HG22      THR 814  45.826 -18.227 -15.330
    7   HG21  THR 814          HG23      THR 814  45.349 -16.853 -16.329

  No H/Q in entry =           7
  In of MODEL   11
    1    H    MET 815           H        MET 815  42.734 -17.633 -15.213
    2    HA   MET 815           HA       MET 815  41.642 -15.745 -17.175
    3    HB2  MET 815           HB2      MET 815  40.318 -16.489 -14.590
    4    HB3  MET 815           HB3      MET 815  39.656 -15.518 -15.895
    5    HG2  MET 815           HG2      MET 815  39.836 -17.649 -17.314
    6    HG3  MET 815           HG3      MET 815  40.164 -18.411 -15.768
    7    HE3  MET 815           HE1      MET 815  36.538 -19.403 -16.772
    8    HE2  MET 815           HE2      MET 815  38.190 -19.999 -16.495
    9    HE1  MET 815           HE3      MET 815  37.844 -18.977 -17.886

  No H/Q in entry =           9
  In of MODEL   11
    1    H    SER 816           H        SER 816  41.164 -13.712 -16.211
    2    HA   SER 816           HA       SER 816  43.107 -12.966 -14.233
    3    HB2  SER 816           HB2      SER 816  40.960 -11.326 -15.609
    4    HB3  SER 816           HB3      SER 816  42.329 -10.704 -14.678
    5    HG   SER 816           HG       SER 816  42.425 -12.124 -17.144

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLU 817           H        GLU 817  42.515 -12.205 -12.271
    2    HA   GLU 817           HA       GLU 817  40.867 -13.567 -10.671
    3    HB2  GLU 817           HB2      GLU 817  42.726 -11.999 -10.157
    4    HB3  GLU 817           HB3      GLU 817  41.556 -10.719 -10.431
    5    HG2  GLU 817           HG2      GLU 817  40.578 -10.945  -8.509
    6    HG3  GLU 817           HG3      GLU 817  40.813 -12.716  -8.446

  No H/Q in entry =           6
  In of MODEL   11
    1    H    CYS 818           H        CYS 818  40.002 -10.463 -12.197
    2    HA   CYS 818           HA       CYS 818  37.485 -10.318 -10.997
    3    HB2  CYS 818           HB2      CYS 818  38.326  -8.283 -11.997
    4    HB3  CYS 818           HB3      CYS 818  38.445  -9.051 -13.574

  No H/Q in entry =           4
  In of MODEL   11
    1    H    GLU 819           H        GLU 819  38.571 -11.743 -13.989
    2    HA   GLU 819           HA       GLU 819  36.086 -12.221 -15.228
    3    HB2  GLU 819           HB2      GLU 819  38.358 -12.140 -16.248
    4    HB3  GLU 819           HB3      GLU 819  38.679 -13.701 -15.531
    5    HG2  GLU 819           HG2      GLU 819  36.910 -14.691 -16.856
    6    HG3  GLU 819           HG3      GLU 819  36.538 -13.101 -17.539

  No H/Q in entry =           6
  In of MODEL   11
    1    H    ALA 820           H        ALA 820  38.295 -14.382 -13.481
    2    HA   ALA 820           HA       ALA 820  36.638 -16.633 -13.523
    3    HB3  ALA 820           HB1      ALA 820  38.838 -15.922 -11.630
    4    HB1  ALA 820           HB2      ALA 820  38.988 -16.835 -13.144
    5    HB2  ALA 820           HB3      ALA 820  38.106 -17.514 -11.774

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLY 821           H        GLY 821  36.360 -13.802 -11.708
    2    HA3  GLY 821           HA2      GLY 821  34.842 -15.115  -9.593
    3    HA2  GLY 821           HA3      GLY 821  35.301 -13.408  -9.623

  No H/Q in entry =           3
  In of MODEL   11
    1    H    ALA 822           H        ALA 822  34.547 -12.693 -12.120
    2    HA   ALA 822           HA       ALA 822  31.892 -11.972 -11.916
    3    HB1  ALA 822           HB1      ALA 822  33.568 -12.228 -14.405
    4    HB2  ALA 822           HB2      ALA 822  33.573 -10.857 -13.297
    5    HB3  ALA 822           HB3      ALA 822  32.117 -11.243 -14.205

  No H/Q in entry =           5
  In of MODEL   11
    1    H    LEU 823           H        LEU 823  33.380 -14.498 -13.851
    2    HA   LEU 823           HA       LEU 823  31.106 -15.426 -15.144
    3    HB2  LEU 823           HB2      LEU 823  33.606 -16.905 -14.346
    4    HB3  LEU 823           HB3      LEU 823  32.413 -17.533 -15.457
    5    HG   LEU 823           HG       LEU 823  34.045 -15.035 -15.905
    6   HD13  LEU 823          HD11      LEU 823  35.411 -17.023 -15.999
    7   HD12  LEU 823          HD12      LEU 823  35.182 -16.348 -17.610
    8   HD11  LEU 823          HD13      LEU 823  34.272 -17.780 -17.114
    9   HD23  LEU 823          HD21      LEU 823  33.159 -15.172 -18.185
   10   HD22  LEU 823          HD22      LEU 823  31.892 -14.903 -16.995
   11   HD21  LEU 823          HD23      LEU 823  32.117 -16.509 -17.693

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ARG 824           H        ARG 824  32.211 -16.053 -11.887
    2    HA   ARG 824           HA       ARG 824  30.623 -18.416 -11.422
    3    HB2  ARG 824           HB2      ARG 824  31.515 -16.461  -9.307
    4    HB3  ARG 824           HB3      ARG 824  31.113 -18.150  -9.098
    5    HG2  ARG 824           HG2      ARG 824  33.160 -18.746 -10.365
    6    HG3  ARG 824           HG3      ARG 824  33.538 -17.022 -10.467
    7    HD2  ARG 824           HD2      ARG 824  33.391 -16.939  -8.001
    8    HD3  ARG 824           HD3      ARG 824  33.276 -18.695  -7.994
    9    HE   ARG 824           HE       ARG 824  35.516 -17.424  -9.324
   10   HH11  ARG 824          HH11      ARG 824  34.339 -19.609  -6.825
   11   HH12  ARG 824          HH12      ARG 824  35.816 -19.792  -6.025
   12   HH21  ARG 824          HH21      ARG 824  37.655 -17.688  -8.195
   13   HH22  ARG 824          HH22      ARG 824  37.743 -18.683  -6.803

  No H/Q in entry =          13
  In of MODEL   11
    1    H    CYS 825           H        CYS 825  30.142 -14.996 -11.293
    2    HA   CYS 825           HA       CYS 825  27.779 -15.146  -9.665
    3    HB2  CYS 825           HB2      CYS 825  29.428 -13.257  -9.465
    4    HB3  CYS 825           HB3      CYS 825  29.092 -12.858 -11.127

  No H/Q in entry =           4
  In of MODEL   11
    1    H    ARG 826           H        ARG 826  28.855 -14.809 -12.939
    2    HA   ARG 826           HA       ARG 826  26.470 -13.836 -14.070
    3    HB2  ARG 826           HB2      ARG 826  28.991 -13.826 -14.812
    4    HB3  ARG 826           HB3      ARG 826  28.492 -15.280 -15.670
    5    HG2  ARG 826           HG2      ARG 826  26.662 -14.004 -16.669
    6    HG3  ARG 826           HG3      ARG 826  27.316 -12.584 -15.821
    7    HD2  ARG 826           HD2      ARG 826  28.133 -12.518 -18.091
    8    HD3  ARG 826           HD3      ARG 826  29.459 -12.929 -17.015
    9    HE   ARG 826           HE       ARG 826  28.193 -15.243 -18.043
   10   HH11  ARG 826          HH11      ARG 826  30.577 -12.711 -18.778
   11   HH12  ARG 826          HH12      ARG 826  31.345 -13.599 -19.999
   12   HH21  ARG 826          HH21      ARG 826  29.248 -16.458 -19.806
   13   HH22  ARG 826          HH22      ARG 826  30.566 -15.746 -20.621

  No H/Q in entry =          13
  In of MODEL   11
    1    H    GLY 827           H        GLY 827  27.688 -17.028 -13.432
    2    HA3  GLY 827           HA2      GLY 827  25.990 -18.812 -13.293
    3    HA2  GLY 827           HA3      GLY 827  25.259 -18.084 -14.720

  No H/Q in entry =           3
  In of MODEL   11
    1    H    GLN 828           H        GLN 828  28.663 -18.236 -14.767
    2    HA   GLN 828           HA       GLN 828  28.638 -20.137 -16.928
    3    HB2  GLN 828           HB2      GLN 828  30.076 -18.098 -16.893
    4    HB3  GLN 828           HB3      GLN 828  30.882 -18.744 -15.475
    5    HG2  GLN 828           HG2      GLN 828  32.250 -19.079 -17.440
    6    HG3  GLN 828           HG3      GLN 828  31.698 -20.632 -16.808
    7   HE21  GLN 828          HE21      GLN 828  31.451 -18.342 -19.370
    8   HE22  GLN 828          HE22      GLN 828  30.609 -19.376 -20.462

  No H/Q in entry =           8
  In of MODEL   11
    1    H    SER 829           H        SER 829  29.840 -22.181 -16.795
    2    HA   SER 829           HA       SER 829  29.975 -23.200 -14.068
    3    HB2  SER 829           HB2      SER 829  28.840 -24.499 -15.896
    4    HB3  SER 829           HB3      SER 829  30.415 -24.733 -16.643
    5    HG   SER 829           HG       SER 829  30.371 -25.339 -13.967

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ILE 830           H        ILE 830  31.827 -22.940 -13.111
    2    HA   ILE 830           HA       ILE 830  34.218 -23.287 -14.672
    3    HB   ILE 830           HB       ILE 830  35.364 -21.387 -13.597
    4   HG12  ILE 830          HG12      ILE 830  34.004 -21.211 -11.467
    5   HG13  ILE 830          HG13      ILE 830  34.274 -19.669 -12.233
    6   HG23  ILE 830          HG21      ILE 830  34.346 -19.515 -14.773
    7   HG22  ILE 830          HG22      ILE 830  32.868 -20.459 -14.967
    8   HG21  ILE 830          HG23      ILE 830  34.354 -20.992 -15.749
    9   HD11  ILE 830          HD11      ILE 830  31.735 -21.264 -12.455
   10   HD13  ILE 830          HD12      ILE 830  32.029 -19.633 -13.070
   11   HD12  ILE 830          HD13      ILE 830  32.011 -19.937 -11.335

  No H/Q in entry =          11
  In of MODEL   11
    1    H    SER 831           H        SER 831  35.912 -24.134 -13.361
    2    HA   SER 831           HA       SER 831  35.277 -24.612 -10.570
    3    HB2  SER 831           HB2      SER 831  36.335 -26.477 -12.654
    4    HB3  SER 831           HB3      SER 831  36.355 -26.803 -10.923
    5    HG   SER 831           HG       SER 831  33.952 -26.217 -11.209

  No H/Q in entry =           5
  In of MODEL   11
    1    H    VAL 832           H        VAL 832  36.717 -23.204  -9.691
    2    HA   VAL 832           HA       VAL 832  39.277 -22.670 -10.848
    3    HB   VAL 832           HB       VAL 832  38.269 -21.981  -8.073
    4   HG11  VAL 832          HG11      VAL 832  40.710 -21.835  -8.253
    5   HG13  VAL 832          HG12      VAL 832  39.992 -20.231  -8.106
    6   HG12  VAL 832          HG13      VAL 832  40.548 -20.806  -9.678
    7   HG22  VAL 832          HG21      VAL 832  37.746 -19.784  -9.025
    8   HG21  VAL 832          HG22      VAL 832  36.822 -21.075  -9.796
    9   HG23  VAL 832          HG23      VAL 832  38.213 -20.369 -10.622

  No H/Q in entry =           9
  In of MODEL   11
    1    H    THR 833           H        THR 833  40.821 -24.096 -10.912
    2    HA   THR 833           HA       THR 833  40.890 -26.228  -9.044
    3    HB   THR 833           HB       THR 833  42.957 -26.841 -10.438
    4    HG1  THR 833           HG1      THR 833  43.032 -25.760 -12.474
    5   HG22  THR 833          HG21      THR 833  40.286 -26.544 -11.813
    6   HG21  THR 833          HG22      THR 833  40.750 -27.868 -10.746
    7   HG23  THR 833          HG23      THR 833  41.571 -27.652 -12.293

  No H/Q in entry =           7
  In of MODEL   11
    1    H    SER 834           H        SER 834  42.876 -23.389  -9.774
    2    HA   SER 834           HA       SER 834  43.839 -23.396  -7.092
    3    HB2  SER 834           HB2      SER 834  45.331 -25.072  -8.183
    4    HB3  SER 834           HB3      SER 834  45.849 -23.825  -9.317
    5    HG   SER 834           HG       SER 834  46.597 -24.310  -6.777

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ILE 835           H        ILE 835  45.459 -21.623  -6.855
    2    HA   ILE 835           HA       ILE 835  44.467 -19.298  -8.289
    3    HB   ILE 835           HB       ILE 835  45.633 -17.944  -6.549
    4   HG12  ILE 835          HG12      ILE 835  46.214 -19.275  -4.404
    5   HG13  ILE 835          HG13      ILE 835  46.370 -20.644  -5.494
    6   HG23  ILE 835          HG21      ILE 835  44.136 -18.447  -4.752
    7   HG22  ILE 835          HG22      ILE 835  43.833 -20.043  -5.423
    8   HG21  ILE 835          HG23      ILE 835  43.290 -18.604  -6.304
    9   HD11  ILE 835          HD11      ILE 835  47.952 -18.113  -5.614
   10   HD13  ILE 835          HD12      ILE 835  48.145 -19.506  -6.683
   11   HD12  ILE 835          HD13      ILE 835  48.524 -19.650  -4.957

  No H/Q in entry =          11
  In of MODEL   11
    1    H    ARG 836           H        ARG 836  46.745 -21.428  -8.794
    2    HA   ARG 836           HA       ARG 836  48.933 -19.643  -9.462
    3    HB2  ARG 836           HB2      ARG 836  48.651 -22.538 -10.236
    4    HB3  ARG 836           HB3      ARG 836  50.130 -21.606 -10.080
    5    HG2  ARG 836           HG2      ARG 836  49.787 -21.538  -7.643
    6    HG3  ARG 836           HG3      ARG 836  48.348 -22.540  -7.845
    7    HD2  ARG 836           HD2      ARG 836  49.985 -24.079  -9.161
    8    HD3  ARG 836           HD3      ARG 836  51.213 -23.227  -8.227
    9    HE   ARG 836           HE       ARG 836  48.942 -24.544  -6.924
   10   HH11  ARG 836          HH11      ARG 836  52.470 -24.083  -7.089
   11   HH12  ARG 836          HH12      ARG 836  52.776 -25.275  -5.912
   12   HH21  ARG 836          HH21      ARG 836  49.415 -26.145  -5.342
   13   HH22  ARG 836          HH22      ARG 836  51.033 -26.458  -4.903

  No H/Q in entry =          13
  In of MODEL   11
    1    HA   PRO 837           HA       PRO 837  47.016 -19.161 -13.440
    2    HB2  PRO 837           HB2      PRO 837  49.085 -17.963 -14.726
    3    HB3  PRO 837           HB3      PRO 837  47.982 -17.101 -13.656
    4    HG2  PRO 837           HG2      PRO 837  50.754 -18.076 -13.155
    5    HG3  PRO 837           HG3      PRO 837  49.953 -16.621 -12.538
    6    HD2  PRO 837           HD2      PRO 837  50.332 -18.925 -11.087
    7    HD3  PRO 837           HD3      PRO 837  49.055 -17.737 -10.758

  No H/Q in entry =           7
  In of MODEL   11
    1    H    CYS 838           H        CYS 838  47.009 -20.327 -15.306
    2    HA   CYS 838           HA       CYS 838  49.134 -22.190 -15.564
    3    HB2  CYS 838           HB2      CYS 838  46.400 -22.051 -16.812
    4    HB3  CYS 838           HB3      CYS 838  47.611 -23.120 -17.495

  No H/Q in entry =           4
  In of MODEL   11
    1    H    ALA 839           H        ALA 839  49.533 -22.506 -18.233
    2    HA   ALA 839           HA       ALA 839  50.461 -19.925 -19.115
    3    HB1  ALA 839           HB1      ALA 839  51.877 -21.920 -19.349
    4    HB3  ALA 839           HB2      ALA 839  51.548 -21.171 -20.912
    5    HB2  ALA 839           HB3      ALA 839  50.679 -22.630 -20.434

  No H/Q in entry =           5
  In of MODEL   11
    1    H    ALA 840           H        ALA 840  47.552 -20.797 -19.028
    2    HA   ALA 840           HA       ALA 840  46.731 -20.742 -21.782
    3    HB2  ALA 840           HB1      ALA 840  45.096 -20.696 -19.260
    4    HB3  ALA 840           HB2      ALA 840  45.482 -22.120 -20.227
    5    HB1  ALA 840           HB3      ALA 840  44.439 -20.861 -20.886

  No H/Q in entry =           5
  In of MODEL   11
    1    H    GLU 841           H        GLU 841  47.657 -18.405 -19.581
    2    HA   GLU 841           HA       GLU 841  45.972 -16.311 -20.709
    3    HB2  GLU 841           HB2      GLU 841  47.244 -14.765 -19.306
    4    HB3  GLU 841           HB3      GLU 841  46.745 -16.158 -18.355
    5    HG2  GLU 841           HG2      GLU 841  48.956 -17.098 -18.483
    6    HG3  GLU 841           HG3      GLU 841  49.480 -15.807 -19.561

  No H/Q in entry =           6
  In of MODEL   11
    1    H    THR 842           H        THR 842  48.656 -18.028 -21.502
    2    HA   THR 842           HA       THR 842  49.798 -16.027 -23.274
    3    HB   THR 842           HB       THR 842  50.805 -18.808 -22.529
    4    HG1  THR 842           HG1      THR 842  51.677 -17.908 -20.735
    5   HG22  THR 842          HG21      THR 842  52.995 -17.931 -23.241
    6   HG21  THR 842          HG22      THR 842  52.253 -16.384 -23.640
    7   HG23  THR 842          HG23      THR 842  51.829 -17.831 -24.560

  No H/Q in entry =           7
  In of MODEL   11
    1    H    GLN 843           H        GLN 843  47.387 -18.128 -23.181
    2    HA   GLN 843           HA       GLN 843  47.679 -19.386 -25.806
    3    HB2  GLN 843           HB2      GLN 843  47.121 -20.877 -23.944
    4    HB3  GLN 843           HB3      GLN 843  45.785 -19.841 -23.482
    5    HG2  GLN 843           HG2      GLN 843  44.864 -21.748 -24.511
    6    HG3  GLN 843           HG3      GLN 843  44.699 -20.437 -25.669
    7   HE21  GLN 843          HE21      GLN 843  44.639 -23.297 -26.067
    8   HE22  GLN 843          HE22      GLN 843  45.892 -23.668 -27.191

  No H/Q in entry =           8
  In of MODEL   12
    1    H1   GLY 689           H3       GLY 689  47.022  16.776 -16.022
    2    H2   GLY 689           H2       GLY 689  47.630  17.848 -14.867
    3    H3   GLY 689           H1       GLY 689  48.184  17.924 -16.461
    4    HA2  GLY 689           HA2      GLY 689  49.794  16.885 -15.033
    5    HA3  GLY 689           HA3      GLY 689  49.204  15.792 -16.278

  No H/Q in entry =           5
  In of MODEL   12
    1    H    SER 690           H        SER 690  47.717  14.171 -15.725
    2    HA   SER 690           HA       SER 690  46.925  13.789 -13.026
    3    HB2  SER 690           HB2      SER 690  46.844  11.876 -15.355
    4    HB3  SER 690           HB3      SER 690  45.917  11.760 -13.856
    5    HG   SER 690           HG       SER 690  45.409  14.133 -14.736

  No H/Q in entry =           5
  In of MODEL   12
    1    H    HIS 691           H        HIS 691  48.431  13.313 -11.583
    2    HA   HIS 691           HA       HIS 691  49.876  10.873 -12.010
    3    HB2  HIS 691           HB2      HIS 691  52.049  11.713 -11.127
    4    HB3  HIS 691           HB3      HIS 691  51.611  12.481 -12.637
    5    HD1  HIS 691           HD1      HIS 691  53.299  13.333  -9.761
    6    HD2  HIS 691           HD2      HIS 691  50.120  15.132 -11.735
    7    HE1  HIS 691           HE1      HIS 691  53.352  15.745  -9.072
    8    HE2  HIS 691           HE2      HIS 691  51.630  16.834 -10.544

  No H/Q in entry =           8
  In of MODEL   12
    1    H    MET 692           H        MET 692  48.270  10.126 -10.767
    2    HA   MET 692           HA       MET 692  48.164  10.852  -7.944
    3    HB2  MET 692           HB2      MET 692  46.089  10.243  -9.134
    4    HB3  MET 692           HB3      MET 692  46.763   8.667  -9.520
    5    HG2  MET 692           HG2      MET 692  46.862   8.163  -7.094
    6    HG3  MET 692           HG3      MET 692  46.070   9.705  -6.777
    7    HE2  MET 692           HE1      MET 692  43.969   9.842  -9.245
    8    HE1  MET 692           HE2      MET 692  43.604  10.291  -7.582
    9    HE3  MET 692           HE3      MET 692  42.549   9.173  -8.440

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ASN 693           H        ASN 693  49.373   8.461 -10.102
    2    HA   ASN 693           HA       ASN 693  50.828   7.134  -7.932
    3    HB2  ASN 693           HB2      ASN 693  49.588   5.840 -10.391
    4    HB3  ASN 693           HB3      ASN 693  50.576   5.012  -9.203
    5   HD21  ASN 693          HD21      ASN 693  49.694   4.540  -7.194
    6   HD22  ASN 693          HD22      ASN 693  48.000   4.563  -6.905

  No H/Q in entry =           6
  In of MODEL   12
    1    HA   PRO 694           HA       PRO 694  54.352   7.963 -10.535
    2    HB2  PRO 694           HB2      PRO 694  55.606   5.484 -10.549
    3    HB3  PRO 694           HB3      PRO 694  55.804   6.698  -9.277
    4    HG2  PRO 694           HG2      PRO 694  54.022   4.295  -9.346
    5    HG3  PRO 694           HG3      PRO 694  54.970   4.950  -7.998
    6    HD2  PRO 694           HD2      PRO 694  52.342   5.349  -8.156
    7    HD3  PRO 694           HD3      PRO 694  53.423   6.625  -7.564

  No H/Q in entry =           7
  In of MODEL   12
    1    H    LEU 695           H        LEU 695  54.597   7.958 -12.697
    2    HA   LEU 695           HA       LEU 695  52.762   6.382 -14.217
    3    HB2  LEU 695           HB2      LEU 695  54.754   8.472 -15.094
    4    HB3  LEU 695           HB3      LEU 695  53.774   7.572 -16.226
    5    HG   LEU 695           HG       LEU 695  52.795   9.713 -15.940
    6   HD13  LEU 695          HD11      LEU 695  50.564   9.210 -15.138
    7   HD12  LEU 695          HD12      LEU 695  51.155   7.724 -14.404
    8   HD11  LEU 695          HD13      LEU 695  51.205   7.922 -16.159
    9   HD23  LEU 695          HD21      LEU 695  52.755   9.202 -12.968
   10   HD22  LEU 695          HD22      LEU 695  52.036  10.594 -13.777
   11   HD21  LEU 695          HD23      LEU 695  53.786  10.356 -13.812

  No H/Q in entry =          11
  In of MODEL   12
    1    H    THR 696           H        THR 696  53.374   4.354 -13.943
    2    HA   THR 696           HA       THR 696  55.794   3.149 -14.457
    3    HB   THR 696           HB       THR 696  53.080   2.016 -15.148
    4    HG1  THR 696           HG1      THR 696  52.728   1.653 -13.048
    5   HG22  THR 696          HG21      THR 696  55.562   0.769 -13.967
    6   HG21  THR 696          HG22      THR 696  55.050   0.634 -15.648
    7   HG23  THR 696          HG23      THR 696  54.056  -0.061 -14.364

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLN 697           H        GLN 697  56.909   3.444 -16.348
    2    HA   GLN 697           HA       GLN 697  55.718   4.152 -18.840
    3    HB2  GLN 697           HB2      GLN 697  58.145   4.572 -18.044
    4    HB3  GLN 697           HB3      GLN 697  58.450   2.900 -18.451
    5    HG2  GLN 697           HG2      GLN 697  57.622   5.080 -20.377
    6    HG3  GLN 697           HG3      GLN 697  59.238   4.424 -20.189
    7   HE21  GLN 697          HE21      GLN 697  59.650   2.338 -21.011
    8   HE22  GLN 697          HE22      GLN 697  58.618   1.630 -22.199

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ALA 698           H        ALA 698  57.505   1.356 -17.928
    2    HA   ALA 698           HA       ALA 698  55.781  -0.385 -19.616
    3    HB1  ALA 698           HB1      ALA 698  58.144  -0.242 -20.409
    4    HB2  ALA 698           HB2      ALA 698  57.680  -1.855 -19.853
    5    HB3  ALA 698           HB3      ALA 698  58.656  -0.814 -18.817

  No H/Q in entry =           5
  In of MODEL   12
    1    H    VAL 699           H        VAL 699  55.023  -2.163 -18.879
    2    HA   VAL 699           HA       VAL 699  54.333  -2.212 -16.257
    3    HB   VAL 699           HB       VAL 699  53.554  -4.479 -16.753
    4   HG13  VAL 699          HG11      VAL 699  52.116  -2.584 -17.212
    5   HG12  VAL 699          HG12      VAL 699  51.887  -3.798 -18.471
    6   HG11  VAL 699          HG13      VAL 699  52.862  -2.368 -18.795
    7   HG23  VAL 699          HG21      VAL 699  54.753  -4.017 -19.484
    8   HG22  VAL 699          HG22      VAL 699  53.665  -5.343 -19.077
    9   HG21  VAL 699          HG23      VAL 699  55.253  -5.242 -18.319

  No H/Q in entry =           9
  In of MODEL   12
    1    HA   PRO 700           HA       PRO 700  58.009  -3.649 -14.299
    2    HB2  PRO 700           HB2      PRO 700  56.779  -4.660 -12.036
    3    HB3  PRO 700           HB3      PRO 700  57.352  -3.009 -12.264
    4    HG2  PRO 700           HG2      PRO 700  54.596  -4.083 -12.405
    5    HG3  PRO 700           HG3      PRO 700  55.160  -2.459 -11.970
    6    HD2  PRO 700           HD2      PRO 700  54.005  -3.082 -14.380
    7    HD3  PRO 700           HD3      PRO 700  55.140  -1.736 -14.134

  No H/Q in entry =           7
  In of MODEL   12
    1    H    LYS 701           H        LYS 701  59.047  -5.376 -14.689
    2    HA   LYS 701           HA       LYS 701  57.600  -7.832 -15.165
    3    HB2  LYS 701           HB2      LYS 701  60.532  -7.259 -15.563
    4    HB3  LYS 701           HB3      LYS 701  59.680  -8.694 -16.112
    5    HG2  LYS 701           HG2      LYS 701  59.202  -5.879 -17.009
    6    HG3  LYS 701           HG3      LYS 701  60.036  -7.132 -17.948
    7    HD2  LYS 701           HD2      LYS 701  57.121  -7.126 -17.099
    8    HD3  LYS 701           HD3      LYS 701  57.728  -6.800 -18.715
    9    HE2  LYS 701           HE2      LYS 701  58.055  -9.413 -17.233
   10    HE3  LYS 701           HE3      LYS 701  56.849  -9.086 -18.466
   11    HZ1  LYS 701           HZ1      LYS 701  58.657  -8.713 -20.062
   12    HZ3  LYS 701           HZ2      LYS 701  58.697 -10.249 -19.385
   13    HZ2  LYS 701           HZ3      LYS 701  59.791  -9.089 -18.860

  No H/Q in entry =          13
  In of MODEL   12
    1    H    CYS 702           H        CYS 702  57.041  -7.978 -13.068
    2    HA   CYS 702           HA       CYS 702  58.944  -9.523 -11.445
    3    HB2  CYS 702           HB2      CYS 702  57.078  -7.411 -10.269
    4    HB3  CYS 702           HB3      CYS 702  58.203  -8.434  -9.412

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLN 703           H        GLN 703  57.661 -10.778  -9.767
    2    HA   GLN 703           HA       GLN 703  55.517 -12.066 -11.055
    3    HB2  GLN 703           HB2      GLN 703  56.764 -12.248  -8.341
    4    HB3  GLN 703           HB3      GLN 703  55.351 -13.209  -8.767
    5    HG2  GLN 703           HG2      GLN 703  56.507 -14.417 -10.397
    6    HG3  GLN 703           HG3      GLN 703  57.799 -13.218 -10.477
    7   HE21  GLN 703          HE21      GLN 703  58.284 -12.997  -7.743
    8   HE22  GLN 703          HE22      GLN 703  58.980 -14.465  -7.175

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ARG 704           H        ARG 704  53.387 -12.342 -10.079
    2    HA   ARG 704           HA       ARG 704  51.971  -9.927  -9.927
    3    HB2  ARG 704           HB2      ARG 704  51.129 -12.641  -8.931
    4    HB3  ARG 704           HB3      ARG 704  50.048 -11.282  -9.178
    5    HG2  ARG 704           HG2      ARG 704  51.678 -12.632 -11.309
    6    HG3  ARG 704           HG3      ARG 704  49.965 -12.892 -10.986
    7    HD2  ARG 704           HD2      ARG 704  49.458 -10.631 -11.502
    8    HD3  ARG 704           HD3      ARG 704  51.150 -10.221 -11.720
    9    HE   ARG 704           HE       ARG 704  50.747 -12.254 -13.499
   10   HH11  ARG 704          HH11      ARG 704  49.145  -9.100 -13.037
   11   HH12  ARG 704          HH12      ARG 704  48.809  -8.893 -14.692
   12   HH21  ARG 704          HH21      ARG 704  50.255 -11.945 -15.782
   13   HH22  ARG 704          HH22      ARG 704  49.424 -10.536 -16.254

  No H/Q in entry =          13
  In of MODEL   12
    1    H    TRP 705           H        TRP 705  53.378 -11.835  -7.451
    2    HA   TRP 705           HA       TRP 705  52.068 -10.356  -5.323
    3    HB2  TRP 705           HB2      TRP 705  53.236 -12.077  -3.887
    4    HB3  TRP 705           HB3      TRP 705  51.991 -12.667  -4.980
    5    HD1  TRP 705           HD1      TRP 705  55.731 -12.844  -4.318
    6    HE1  TRP 705           HE1      TRP 705  56.752 -14.684  -5.759
    7    HE3  TRP 705           HE3      TRP 705  51.691 -13.915  -7.253
    8    HZ2  TRP 705           HZ2      TRP 705  55.950 -16.419  -7.856
    9    HZ3  TRP 705           HZ3      TRP 705  51.903 -15.667  -8.957
   10    HH2  TRP 705           HH2      TRP 705  53.988 -16.899  -9.253

  No H/Q in entry =          10
  In of MODEL   12
    1    H    GLU 706           H        GLU 706  54.427  -9.620  -7.209
    2    HA   GLU 706           HA       GLU 706  56.168  -8.615  -5.107
    3    HB2  GLU 706           HB2      GLU 706  56.736  -9.533  -7.893
    4    HB3  GLU 706           HB3      GLU 706  57.884  -8.496  -7.031
    5    HG2  GLU 706           HG2      GLU 706  57.949 -10.282  -5.303
    6    HG3  GLU 706           HG3      GLU 706  56.935 -11.262  -6.365

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LYS 707           H        LYS 707  57.168  -6.589  -5.644
    2    HA   LYS 707           HA       LYS 707  55.644  -4.926  -7.460
    3    HB2  LYS 707           HB2      LYS 707  55.442  -3.126  -5.764
    4    HB3  LYS 707           HB3      LYS 707  54.531  -4.558  -5.334
    5    HG2  LYS 707           HG2      LYS 707  56.385  -5.187  -3.780
    6    HG3  LYS 707           HG3      LYS 707  57.146  -3.634  -4.146
    7    HD2  LYS 707           HD2      LYS 707  55.141  -2.469  -3.357
    8    HD3  LYS 707           HD3      LYS 707  54.379  -4.010  -2.994
    9    HE2  LYS 707           HE2      LYS 707  55.225  -3.100  -0.945
   10    HE3  LYS 707           HE3      LYS 707  56.226  -4.477  -1.387
   11    HZ1  LYS 707           HZ1      LYS 707  56.933  -1.630  -1.852
   12    HZ3  LYS 707           HZ2      LYS 707  57.972  -2.926  -2.130
   13    HZ2  LYS 707           HZ3      LYS 707  57.466  -2.544  -0.578

  No H/Q in entry =          13
  In of MODEL   12
    1    H    LEU 708           H        LEU 708  56.753  -3.144  -8.199
    2    HA   LEU 708           HA       LEU 708  59.608  -3.580  -8.288
    3    HB2  LEU 708           HB2      LEU 708  58.392  -3.296 -10.348
    4    HB3  LEU 708           HB3      LEU 708  57.773  -1.746  -9.825
    5    HG   LEU 708           HG       LEU 708  60.136  -0.889  -9.860
    6   HD13  LEU 708          HD11      LEU 708  61.320  -2.992  -9.671
    7   HD12  LEU 708          HD12      LEU 708  61.798  -2.147 -11.141
    8   HD11  LEU 708          HD13      LEU 708  60.685  -3.510 -11.233
    9   HD22  LEU 708          HD21      LEU 708  60.221  -0.620 -12.274
   10   HD21  LEU 708          HD22      LEU 708  58.554  -0.476 -11.705
   11   HD23  LEU 708          HD23      LEU 708  59.099  -1.959 -12.483

  No H/Q in entry =          11
  In of MODEL   12
    1    H    GLN 709           H        GLN 709  60.886  -2.581  -6.908
    2    HA   GLN 709           HA       GLN 709  60.628   0.271  -6.492
    3    HB2  GLN 709           HB2      GLN 709  60.756   0.209  -4.110
    4    HB3  GLN 709           HB3      GLN 709  59.472  -0.921  -4.505
    5    HG2  GLN 709           HG2      GLN 709  61.081  -2.787  -4.241
    6    HG3  GLN 709           HG3      GLN 709  62.311  -1.619  -3.820
    7   HE21  GLN 709          HE21      GLN 709  62.621  -2.555  -1.841
    8   HE22  GLN 709          HE22      GLN 709  61.518  -2.386  -0.526

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ASN 710           H        ASN 710  62.680   1.155  -6.185
    2    HA   ASN 710           HA       ASN 710  65.010   1.264  -6.174
    3    HB2  ASN 710           HB2      ASN 710  64.522  -0.072  -3.987
    4    HB3  ASN 710           HB3      ASN 710  64.806  -1.495  -4.945
    5   HD21  ASN 710          HD21      ASN 710  66.350  -2.034  -3.528
    6   HD22  ASN 710          HD22      ASN 710  67.913  -1.314  -3.520

  No H/Q in entry =           6
  In of MODEL   12
    1    H    SER 711           H        SER 711  63.517   0.112  -8.367
    2    HA   SER 711           HA       SER 711  63.707  -0.798 -10.341
    3    HB2  SER 711           HB2      SER 711  65.920  -0.754 -11.482
    4    HB3  SER 711           HB3      SER 711  65.588   0.698 -10.529
    5    HG   SER 711           HG       SER 711  66.831  -0.836  -8.885

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ARG 712           H        ARG 712  63.762  -2.579  -7.919
    2    HA   ARG 712           HA       ARG 712  64.443  -4.999  -9.402
    3    HB2  ARG 712           HB2      ARG 712  65.139  -6.082  -7.320
    4    HB3  ARG 712           HB3      ARG 712  66.173  -4.709  -7.701
    5    HG2  ARG 712           HG2      ARG 712  65.197  -3.421  -5.984
    6    HG3  ARG 712           HG3      ARG 712  63.880  -4.579  -5.762
    7    HD2  ARG 712           HD2      ARG 712  66.803  -5.115  -5.267
    8    HD3  ARG 712           HD3      ARG 712  65.598  -4.811  -4.010
    9    HE   ARG 712           HE       ARG 712  64.705  -6.935  -5.590
   10   HH11  ARG 712          HH11      ARG 712  67.337  -6.300  -3.314
   11   HH12  ARG 712          HH12      ARG 712  67.472  -7.907  -2.790
   12   HH21  ARG 712          HH21      ARG 712  64.864  -9.133  -4.889
   13   HH22  ARG 712          HH22      ARG 712  66.007  -9.572  -3.709

  No H/Q in entry =          13
  In of MODEL   12
    1    H    CYS 713           H        CYS 713  63.406  -6.921  -7.993
    2    HA   CYS 713           HA       CYS 713  60.620  -6.128  -7.609
    3    HB2  CYS 713           HB2      CYS 713  61.776  -8.847  -8.256
    4    HB3  CYS 713           HB3      CYS 713  60.068  -8.434  -8.171

  No H/Q in entry =           4
  In of MODEL   12
    1    H    VAL 714           H        VAL 714  59.913  -6.258  -5.598
    2    HA   VAL 714           HA       VAL 714  61.154  -8.189  -3.768
    3    HB   VAL 714           HB       VAL 714  60.730  -6.637  -1.888
    4   HG12  VAL 714          HG11      VAL 714  62.474  -4.956  -2.349
    5   HG11  VAL 714          HG12      VAL 714  62.418  -5.396  -4.061
    6   HG13  VAL 714          HG13      VAL 714  62.938  -6.578  -2.866
    7   HG21  VAL 714          HG21      VAL 714  59.910  -4.658  -4.021
    8   HG23  VAL 714          HG22      VAL 714  60.115  -4.284  -2.313
    9   HG22  VAL 714          HG23      VAL 714  58.849  -5.402  -2.824

  No H/Q in entry =           9
  In of MODEL   12
    1    H    CYS 715           H        CYS 715  59.386  -8.406  -1.819
    2    HA   CYS 715           HA       CYS 715  57.058  -9.148  -3.347
    3    HB2  CYS 715           HB2      CYS 715  57.891  -9.785  -0.521
    4    HB3  CYS 715           HB3      CYS 715  56.300 -10.181  -1.143

  No H/Q in entry =           4
  In of MODEL   12
    1    H    LYS 716           H        LYS 716  55.016  -8.676  -2.815
    2    HA   LYS 716           HA       LYS 716  54.488  -5.977  -1.973
    3    HB2  LYS 716           HB2      LYS 716  53.471  -7.182  -3.925
    4    HB3  LYS 716           HB3      LYS 716  52.689  -8.282  -2.824
    5    HG2  LYS 716           HG2      LYS 716  51.255  -6.500  -2.004
    6    HG3  LYS 716           HG3      LYS 716  52.123  -5.323  -2.996
    7    HD2  LYS 716           HD2      LYS 716  50.606  -7.712  -4.104
    8    HD3  LYS 716           HD3      LYS 716  49.948  -6.077  -4.007
    9    HE2  LYS 716           HE2      LYS 716  51.733  -5.268  -5.463
   10    HE3  LYS 716           HE3      LYS 716  52.432  -6.873  -5.532
   11    HZ2  LYS 716           HZ1      LYS 716  51.073  -6.280  -7.511
   12    HZ1  LYS 716           HZ2      LYS 716  49.672  -6.288  -6.577
   13    HZ3  LYS 716           HZ3      LYS 716  50.590  -7.688  -6.779

  No H/Q in entry =          13
  In of MODEL   12
    1    H    MET 717           H        MET 717  52.154  -6.163  -0.456
    2    HA   MET 717           HA       MET 717  52.941  -7.953   1.746
    3    HB2  MET 717           HB2      MET 717  51.520  -5.299   2.038
    4    HB3  MET 717           HB3      MET 717  52.012  -6.356   3.345
    5    HG2  MET 717           HG2      MET 717  53.784  -4.780   1.502
    6    HG3  MET 717           HG3      MET 717  53.492  -4.490   3.198
    7    HE3  MET 717           HE1      MET 717  54.423  -6.217   5.158
    8    HE2  MET 717           HE2      MET 717  55.364  -7.663   4.790
    9    HE1  MET 717           HE3      MET 717  53.663  -7.578   4.332

  No H/Q in entry =           9
  In of MODEL   12
    1    HA   PRO 718           HA       PRO 718  49.038  -9.870   1.047
    2    HB2  PRO 718           HB2      PRO 718  48.573 -11.045   3.460
    3    HB3  PRO 718           HB3      PRO 718  49.776 -11.641   2.314
    4    HG2  PRO 718           HG2      PRO 718  50.159  -9.937   4.739
    5    HG3  PRO 718           HG3      PRO 718  51.136 -11.305   4.172
    6    HD2  PRO 718           HD2      PRO 718  51.865  -8.721   3.800
    7    HD3  PRO 718           HD3      PRO 718  52.284 -10.003   2.650

  No H/Q in entry =           7
  In of MODEL   12
    1    H    TYR 719           H        TYR 719  49.387  -7.624   3.620
    2    HA   TYR 719           HA       TYR 719  46.516  -7.419   4.028
    3    HB2  TYR 719           HB2      TYR 719  47.110  -5.737   5.772
    4    HB3  TYR 719           HB3      TYR 719  47.857  -7.308   6.041
    5    HD1  TYR 719           HD1      TYR 719  48.442  -3.795   5.181
    6    HD2  TYR 719           HD2      TYR 719  50.267  -7.573   5.842
    7    HE1  TYR 719           HE1      TYR 719  50.642  -2.707   5.343
    8    HE2  TYR 719           HE2      TYR 719  52.460  -6.483   5.999
    9    HH   TYR 719           HH       TYR 719  52.784  -3.071   6.188

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLU 720           H        GLU 720  48.867  -6.136   2.058
    2    HA   GLU 720           HA       GLU 720  47.534  -3.584   1.659
    3    HB2  GLU 720           HB2      GLU 720  50.063  -4.792   0.631
    4    HB3  GLU 720           HB3      GLU 720  49.407  -3.312  -0.063
    5    HG2  GLU 720           HG2      GLU 720  50.135  -3.704   2.827
    6    HG3  GLU 720           HG3      GLU 720  51.148  -2.903   1.624

  No H/Q in entry =           6
  In of MODEL   12
    1    H    CYS 721           H        CYS 721  47.543  -6.737   0.457
    2    HA   CYS 721           HA       CYS 721  46.569  -5.904  -2.141
    3    HB2  CYS 721           HB2      CYS 721  46.819  -8.211  -2.800
    4    HB3  CYS 721           HB3      CYS 721  48.110  -7.998  -1.636

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLY 722           H        GLY 722  44.397  -6.230  -2.702
    2    HA3  GLY 722           HA2      GLY 722  42.632  -7.017  -0.484
    3    HA2  GLY 722           HA3      GLY 722  42.374  -5.492  -1.320

  No H/Q in entry =           3
  In of MODEL   12
    1    HA   PRO 723           HA       PRO 723  39.984  -7.484  -4.406
    2    HB2  PRO 723           HB2      PRO 723  40.872  -6.473  -6.749
    3    HB3  PRO 723           HB3      PRO 723  39.945  -5.522  -5.578
    4    HG2  PRO 723           HG2      PRO 723  42.907  -5.614  -6.015
    5    HG3  PRO 723           HG3      PRO 723  41.858  -4.201  -5.801
    6    HD2  PRO 723           HD2      PRO 723  43.326  -5.189  -3.793
    7    HD3  PRO 723           HD3      PRO 723  41.713  -4.497  -3.523

  No H/Q in entry =           7
  In of MODEL   12
    1    H    SER 724           H        SER 724  40.518  -9.703  -4.269
    2    HA   SER 724           HA       SER 724  41.782 -10.829  -6.533
    3    HB2  SER 724           HB2      SER 724  43.026 -11.004  -3.789
    4    HB3  SER 724           HB3      SER 724  43.294 -12.284  -4.961
    5    HG   SER 724           HG       SER 724  43.867 -10.524  -6.390

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU 725           H        LEU 725  41.542 -13.251  -6.434
    2    HA   LEU 725           HA       LEU 725  38.853 -13.929  -5.722
    3    HB2  LEU 725           HB2      LEU 725  41.033 -15.205  -7.095
    4    HB3  LEU 725           HB3      LEU 725  40.055 -16.313  -6.154
    5    HG   LEU 725           HG       LEU 725  39.163 -16.386  -8.182
    6   HD12  LEU 725          HD11      LEU 725  37.448 -14.296  -7.000
    7   HD11  LEU 725          HD12      LEU 725  37.446 -16.002  -6.509
    8   HD13  LEU 725          HD13      LEU 725  36.971 -15.536  -8.155
    9   HD23  LEU 725          HD21      LEU 725  38.514 -14.515  -9.614
   10   HD22  LEU 725          HD22      LEU 725  40.237 -14.723  -9.361
   11   HD21  LEU 725          HD23      LEU 725  39.348 -13.445  -8.485

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ASP 726           H        ASP 726  38.025 -14.781  -3.969
    2    HA   ASP 726           HA       ASP 726  39.687 -15.489  -1.751
    3    HB2  ASP 726           HB2      ASP 726  37.488 -16.098  -0.670
    4    HB3  ASP 726           HB3      ASP 726  37.662 -14.417  -1.160

  No H/Q in entry =           4
  In of MODEL   12
    1    H    VAL 727           H        VAL 727  40.372 -17.355  -1.231
    2    HA   VAL 727           HA       VAL 727  39.182 -19.650  -2.522
    3    HB   VAL 727           HB       VAL 727  41.479 -20.669  -2.921
    4   HG11  VAL 727          HG11      VAL 727  40.882 -18.115  -4.431
    5   HG13  VAL 727          HG12      VAL 727  40.235 -19.710  -4.804
    6   HG12  VAL 727          HG13      VAL 727  41.951 -19.391  -5.002
    7   HG21  VAL 727          HG21      VAL 727  42.416 -17.856  -2.351
    8   HG23  VAL 727          HG22      VAL 727  43.413 -19.139  -3.034
    9   HG22  VAL 727          HG23      VAL 727  42.778 -19.291  -1.395

  No H/Q in entry =           9
  In of MODEL   12
    1    H    CYS 728           H        CYS 728  39.909 -21.814  -1.448
    2    HA   CYS 728           HA       CYS 728  40.156 -21.400   1.440
    3    HB2  CYS 728           HB2      CYS 728  39.455 -23.885  -0.135
    4    HB3  CYS 728           HB3      CYS 728  39.557 -23.804   1.611

  No H/Q in entry =           4
  In of MODEL   12
    1    H    ALA 729           H        ALA 729  41.977 -21.901   2.469
    2    HA   ALA 729           HA       ALA 729  43.894 -23.554   1.043
    3    HB3  ALA 729           HB1      ALA 729  44.545 -21.223   0.803
    4    HB2  ALA 729           HB2      ALA 729  45.682 -22.103   1.825
    5    HB1  ALA 729           HB3      ALA 729  44.484 -21.029   2.556

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLN 730           H        GLN 730  45.498 -24.369   2.509
    2    HA   GLN 730           HA       GLN 730  44.435 -24.744   5.208
    3    HB2  GLN 730           HB2      GLN 730  44.295 -26.835   3.895
    4    HB3  GLN 730           HB3      GLN 730  46.028 -26.747   3.616
    5    HG2  GLN 730           HG2      GLN 730  46.462 -26.908   5.980
    6    HG3  GLN 730           HG3      GLN 730  44.749 -26.950   6.337
    7   HE21  GLN 730          HE21      GLN 730  46.724 -28.825   7.013
    8   HE22  GLN 730          HE22      GLN 730  46.327 -30.340   6.279

  No H/Q in entry =           8
  In of MODEL   12
    1    H    ASP 731           H        ASP 731  45.663 -24.163   6.705
    2    HA   ASP 731           HA       ASP 731  48.235 -23.025   6.251
    3    HB2  ASP 731           HB2      ASP 731  46.696 -22.109   7.917
    4    HB3  ASP 731           HB3      ASP 731  46.707 -23.642   8.778

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLU 732           H        GLU 732  50.221 -23.901   6.896
    2    HA   GLU 732           HA       GLU 732  50.149 -26.788   7.194
    3    HB2  GLU 732           HB2      GLU 732  52.232 -24.881   6.235
    4    HB3  GLU 732           HB3      GLU 732  52.588 -26.564   6.587
    5    HG2  GLU 732           HG2      GLU 732  50.444 -25.699   4.674
    6    HG3  GLU 732           HG3      GLU 732  52.103 -26.055   4.186

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ARG 733           H        ARG 733  50.441 -24.199   9.337
    2    HA   ARG 733           HA       ARG 733  52.433 -25.557  10.910
    3    HB2  ARG 733           HB2      ARG 733  51.040 -22.915  11.309
    4    HB3  ARG 733           HB3      ARG 733  52.352 -23.556  12.273
    5    HG2  ARG 733           HG2      ARG 733  52.454 -22.634   9.409
    6    HG3  ARG 733           HG3      ARG 733  53.249 -21.894  10.793
    7    HD2  ARG 733           HD2      ARG 733  53.855 -24.609   9.618
    8    HD3  ARG 733           HD3      ARG 733  54.815 -23.154   9.387
    9    HE   ARG 733           HE       ARG 733  54.860 -23.341  12.011
   10   HH11  ARG 733          HH11      ARG 733  55.283 -25.906   9.590
   11   HH12  ARG 733          HH12      ARG 733  56.378 -26.810  10.512
   12   HH21  ARG 733          HH21      ARG 733  56.387 -24.601  13.303
   13   HH22  ARG 733          HH22      ARG 733  57.025 -26.048  12.683

  No H/Q in entry =          13
  In of MODEL   12
    1    H    SER 734           H        SER 734  49.169 -24.210  11.162
    2    HA   SER 734           HA       SER 734  48.681 -25.895  13.494
    3    HB2  SER 734           HB2      SER 734  46.992 -23.688  12.289
    4    HB3  SER 734           HB3      SER 734  46.695 -24.490  13.836
    5    HG   SER 734           HG       SER 734  49.127 -23.730  14.014

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LYS 735           H        LYS 735  48.361 -26.012  10.207
    2    HA   LYS 735           HA       LYS 735  47.391 -27.410   8.712
    3    HB2  LYS 735           HB2      LYS 735  46.715 -29.103  11.127
    4    HB3  LYS 735           HB3      LYS 735  46.741 -29.647   9.458
    5    HG2  LYS 735           HG2      LYS 735  49.130 -28.682  11.040
    6    HG3  LYS 735           HG3      LYS 735  48.749 -30.359  10.672
    7    HD2  LYS 735           HD2      LYS 735  49.326 -28.229   8.596
    8    HD3  LYS 735           HD3      LYS 735  50.519 -29.363   9.215
    9    HE2  LYS 735           HE2      LYS 735  49.133 -31.229   8.395
   10    HE3  LYS 735           HE3      LYS 735  47.987 -30.065   7.735
   11    HZ3  LYS 735           HZ1      LYS 735  49.724 -29.273   6.193
   12    HZ2  LYS 735           HZ2      LYS 735  49.510 -30.941   6.083
   13    HZ1  LYS 735           HZ3      LYS 735  50.825 -30.333   6.925

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ARG 736           H        ARG 736  45.870 -25.337   9.840
    2    HA   ARG 736           HA       ARG 736  43.125 -26.280  10.008
    3    HB2  ARG 736           HB2      ARG 736  42.635 -23.926  10.641
    4    HB3  ARG 736           HB3      ARG 736  43.804 -24.725  11.687
    5    HG2  ARG 736           HG2      ARG 736  45.627 -23.590  10.553
    6    HG3  ARG 736           HG3      ARG 736  44.476 -22.806   9.468
    7    HD2  ARG 736           HD2      ARG 736  43.497 -21.625  11.336
    8    HD3  ARG 736           HD3      ARG 736  44.547 -22.488  12.463
    9    HE   ARG 736           HE       ARG 736  46.162 -21.228  10.585
   10   HH11  ARG 736          HH11      ARG 736  43.943 -20.328  13.198
   11   HH12  ARG 736          HH12      ARG 736  44.744 -18.877  13.555
   12   HH21  ARG 736          HH21      ARG 736  47.303 -19.177  11.128
   13   HH22  ARG 736          HH22      ARG 736  46.664 -18.222  12.372

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ILE 737           H        ILE 737  41.525 -25.736   8.555
    2    HA   ILE 737           HA       ILE 737  42.406 -24.809   5.961
    3    HB   ILE 737           HB       ILE 737  39.571 -25.402   6.811
    4   HG12  ILE 737          HG12      ILE 737  41.006 -27.381   7.346
    5   HG13  ILE 737          HG13      ILE 737  39.823 -27.708   6.090
    6   HG23  ILE 737          HG21      ILE 737  39.264 -25.818   4.429
    7   HG22  ILE 737          HG22      ILE 737  40.987 -25.564   4.155
    8   HG21  ILE 737          HG23      ILE 737  39.979 -24.226   4.705
    9   HD11  ILE 737          HD11      ILE 737  41.557 -27.447   4.412
   10   HD13  ILE 737          HD12      ILE 737  41.944 -28.723   5.566
   11   HD12  ILE 737          HD13      ILE 737  42.750 -27.154   5.677

  No H/Q in entry =          11
  In of MODEL   12
    1    H    LEU 738           H        LEU 738  42.265 -22.696   5.466
    2    HA   LEU 738           HA       LEU 738  40.295 -21.118   6.899
    3    HB2  LEU 738           HB2      LEU 738  41.753 -19.333   7.415
    4    HB3  LEU 738           HB3      LEU 738  42.511 -20.787   8.028
    5    HG   LEU 738           HG       LEU 738  43.308 -19.175   5.600
    6   HD12  LEU 738          HD11      LEU 738  45.344 -18.726   6.866
    7   HD11  LEU 738          HD12      LEU 738  44.682 -19.612   8.237
    8   HD13  LEU 738          HD13      LEU 738  43.904 -18.129   7.688
    9   HD23  LEU 738          HD21      LEU 738  44.613 -21.643   6.723
   10   HD22  LEU 738          HD22      LEU 738  45.183 -20.671   5.339
   11   HD21  LEU 738          HD23      LEU 738  43.648 -21.538   5.251

  No H/Q in entry =          11
  In of MODEL   12
    1    HA   PRO 739           HA       PRO 739  39.575 -19.302   2.905
    2    HB2  PRO 739           HB2      PRO 739  38.430 -16.987   3.706
    3    HB3  PRO 739           HB3      PRO 739  37.591 -18.538   3.850
    4    HG2  PRO 739           HG2      PRO 739  39.037 -16.979   5.952
    5    HG3  PRO 739           HG3      PRO 739  37.482 -17.825   6.058
    6    HD2  PRO 739           HD2      PRO 739  39.852 -18.900   6.957
    7    HD3  PRO 739           HD3      PRO 739  38.481 -19.876   6.368

  No H/Q in entry =           7
  In of MODEL   12
    1    H    LEU 740           H        LEU 740  41.116 -18.447   1.741
    2    HA   LEU 740           HA       LEU 740  42.540 -16.117   2.760
    3    HB2  LEU 740           HB2      LEU 740  43.674 -18.466   1.261
    4    HB3  LEU 740           HB3      LEU 740  44.457 -16.905   1.264
    5    HG   LEU 740           HG       LEU 740  44.009 -18.700   3.645
    6   HD11  LEU 740          HD11      LEU 740  46.475 -17.832   2.153
    7   HD13  LEU 740          HD12      LEU 740  45.740 -19.429   2.135
    8   HD12  LEU 740          HD13      LEU 740  46.461 -18.811   3.627
    9   HD22  LEU 740          HD21      LEU 740  43.818 -16.366   4.340
   10   HD21  LEU 740          HD22      LEU 740  45.298 -15.972   3.466
   11   HD23  LEU 740          HD23      LEU 740  45.363 -17.032   4.875

  No H/Q in entry =          11
  In of MODEL   12
    1    H    THR 741           H        THR 741  43.791 -15.312   0.654
    2    HA   THR 741           HA       THR 741  41.880 -15.308  -1.518
    3    HB   THR 741           HB       THR 741  43.248 -12.800  -0.479
    4    HG1  THR 741           HG1      THR 741  40.959 -14.127   0.427
    5   HG23  THR 741          HG21      THR 741  42.371 -12.745  -2.756
    6   HG22  THR 741          HG22      THR 741  41.398 -11.702  -1.703
    7   HG21  THR 741          HG23      THR 741  40.819 -13.312  -2.157

  No H/Q in entry =           7
  In of MODEL   12
    1    H    VAL 742           H        VAL 742  42.926 -15.076  -3.505
    2    HA   VAL 742           HA       VAL 742  45.255 -16.365  -4.024
    3    HB   VAL 742           HB       VAL 742  44.170 -14.058  -5.569
    4   HG12  VAL 742          HG11      VAL 742  45.162 -14.956  -7.538
    5   HG11  VAL 742          HG12      VAL 742  46.052 -16.143  -6.550
    6   HG13  VAL 742          HG13      VAL 742  46.316 -14.402  -6.334
    7   HG22  VAL 742          HG21      VAL 742  42.477 -15.607  -5.331
    8   HG21  VAL 742          HG22      VAL 742  43.552 -16.962  -5.691
    9   HG23  VAL 742          HG23      VAL 742  43.121 -15.799  -6.963

  No H/Q in entry =           9
  In of MODEL   12
    1    H    CYS 743           H        CYS 743  45.030 -12.816  -3.905
    2    HA   CYS 743           HA       CYS 743  47.706 -12.300  -4.367
    3    HB2  CYS 743           HB2      CYS 743  47.260 -10.068  -3.550
    4    HB3  CYS 743           HB3      CYS 743  45.930 -10.634  -4.533

  No H/Q in entry =           4
  In of MODEL   12
    1    H    LYS 744           H        LYS 744  45.968 -12.528  -1.297
    2    HA   LYS 744           HA       LYS 744  48.007 -11.945   0.387
    3    HB2  LYS 744           HB2      LYS 744  45.698 -13.847   0.854
    4    HB3  LYS 744           HB3      LYS 744  46.763 -13.302   2.134
    5    HG2  LYS 744           HG2      LYS 744  46.038 -10.989   1.716
    6    HG3  LYS 744           HG3      LYS 744  44.950 -11.578   0.457
    7    HD2  LYS 744           HD2      LYS 744  43.758 -12.926   2.124
    8    HD3  LYS 744           HD3      LYS 744  44.854 -12.346   3.379
    9    HE2  LYS 744           HE2      LYS 744  42.958 -10.646   1.753
   10    HE3  LYS 744           HE3      LYS 744  42.729 -11.147   3.413
   11    HZ2  LYS 744           HZ1      LYS 744  43.600  -8.869   3.190
   12    HZ1  LYS 744           HZ2      LYS 744  45.056  -9.472   2.563
   13    HZ3  LYS 744           HZ3      LYS 744  44.557  -9.871   4.117

  No H/Q in entry =          13
  In of MODEL   12
    1    H    MET 745           H        MET 745  46.804 -15.108  -0.623
    2    HA   MET 745           HA       MET 745  48.554 -16.871   0.583
    3    HB2  MET 745           HB2      MET 745  46.907 -17.975  -0.324
    4    HB3  MET 745           HB3      MET 745  46.708 -16.925  -1.715
    5    HG2  MET 745           HG2      MET 745  47.349 -18.980  -2.649
    6    HG3  MET 745           HG3      MET 745  48.827 -18.068  -2.587
    7    HE2  MET 745           HE1      MET 745  47.808 -21.564   0.227
    8    HE1  MET 745           HE2      MET 745  46.799 -21.009  -1.110
    9    HE3  MET 745           HE3      MET 745  46.956 -20.024   0.346

  No H/Q in entry =           9
  In of MODEL   12
    1    H    HIS 746           H        HIS 746  48.971 -15.227  -2.534
    2    HA   HIS 746           HA       HIS 746  51.405 -16.635  -3.107
    3    HB2  HIS 746           HB2      HIS 746  49.973 -14.382  -4.342
    4    HB3  HIS 746           HB3      HIS 746  51.666 -14.653  -4.808
    5    HD1  HIS 746           HD1      HIS 746  51.895 -17.466  -5.435
    6    HD2  HIS 746           HD2      HIS 746  48.334 -15.442  -6.068
    7    HE1  HIS 746           HE1      HIS 746  50.716 -18.753  -7.198
    8    HE2  HIS 746           HE2      HIS 746  48.589 -17.425  -7.653

  No H/Q in entry =           8
  In of MODEL   12
    1    H    VAL 747           H        VAL 747  50.697 -13.413  -1.885
    2    HA   VAL 747           HA       VAL 747  53.386 -12.548  -1.824
    3    HB   VAL 747           HB       VAL 747  50.965 -11.649  -0.246
    4   HG11  VAL 747          HG11      VAL 747  53.054 -11.149   0.935
    5   HG13  VAL 747          HG12      VAL 747  52.280  -9.688   0.318
    6   HG12  VAL 747          HG13      VAL 747  53.677 -10.367  -0.517
    7   HG22  VAL 747          HG21      VAL 747  51.014  -9.755  -1.794
    8   HG21  VAL 747          HG22      VAL 747  50.852 -11.301  -2.653
    9   HG23  VAL 747          HG23      VAL 747  52.413 -10.485  -2.592

  No H/Q in entry =           9
  In of MODEL   12
    1    H    LEU 748           H        LEU 748  51.245 -13.846   0.586
    2    HA   LEU 748           HA       LEU 748  53.028 -13.981   2.696
    3    HB2  LEU 748           HB2      LEU 748  50.897 -14.154   3.421
    4    HB3  LEU 748           HB3      LEU 748  50.353 -14.905   1.959
    5    HG   LEU 748           HG       LEU 748  51.693 -16.442   4.176
    6   HD13  LEU 748          HD11      LEU 748  49.418 -17.005   4.886
    7   HD12  LEU 748          HD12      LEU 748  48.761 -15.921   3.660
    8   HD11  LEU 748          HD13      LEU 748  49.692 -15.265   5.012
    9   HD21  LEU 748          HD21      LEU 748  51.581 -17.533   1.951
   10   HD23  LEU 748          HD22      LEU 748  49.835 -17.275   1.931
   11   HD22  LEU 748          HD23      LEU 748  50.555 -18.324   3.139

  No H/Q in entry =          11
  In of MODEL   12
    1    H    HIS 749           H        HIS 749  52.534 -16.053  -0.024
    2    HA   HIS 749           HA       HIS 749  53.981 -18.309   0.848
    3    HB2  HIS 749           HB2      HIS 749  52.412 -18.177  -1.142
    4    HB3  HIS 749           HB3      HIS 749  53.692 -17.335  -2.001
    5    HD1  HIS 749           HD1      HIS 749  55.165 -18.842  -3.372
    6    HD2  HIS 749           HD2      HIS 749  53.263 -20.803  -0.262
    7    HE1  HIS 749           HE1      HIS 749  55.767 -21.248  -3.651
    8    HE2  HIS 749           HE2      HIS 749  54.338 -22.429  -1.949

  No H/Q in entry =           8
  In of MODEL   12
    1    H    CYS 750           H        CYS 750  54.950 -15.332  -0.913
    2    HA   CYS 750           HA       CYS 750  57.649 -16.335  -1.034
    3    HB2  CYS 750           HB2      CYS 750  58.251 -14.336  -2.265
    4    HB3  CYS 750           HB3      CYS 750  56.763 -14.987  -2.926

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLN 751           H        GLN 751  55.788 -14.346   1.065
    2    HA   GLN 751           HA       GLN 751  57.855 -13.078   2.491
    3    HB2  GLN 751           HB2      GLN 751  55.235 -14.192   3.524
    4    HB3  GLN 751           HB3      GLN 751  56.298 -13.151   4.455
    5    HG2  GLN 751           HG2      GLN 751  54.993 -12.387   1.859
    6    HG3  GLN 751           HG3      GLN 751  54.352 -11.984   3.444
    7   HE21  GLN 751          HE21      GLN 751  55.178 -10.210   1.298
    8   HE22  GLN 751          HE22      GLN 751  56.408  -9.213   1.952

  No H/Q in entry =           8
  In of MODEL   12
    1    H    GLY 752           H        GLY 752  56.581 -16.322   2.647
    2    HA3  GLY 752           HA2      GLY 752  58.318 -18.037   3.160
    3    HA2  GLY 752           HA3      GLY 752  58.730 -17.037   4.548

  No H/Q in entry =           3
  In of MODEL   12
    1    H    ARG 753           H        ARG 753  55.473 -17.747   3.390
    2    HA   ARG 753           HA       ARG 753  54.992 -19.209   5.889
    3    HB2  ARG 753           HB2      ARG 753  53.036 -17.796   4.095
    4    HB3  ARG 753           HB3      ARG 753  52.683 -18.569   5.632
    5    HG2  ARG 753           HG2      ARG 753  54.416 -16.118   5.294
    6    HG3  ARG 753           HG3      ARG 753  52.732 -16.088   5.792
    7    HD2  ARG 753           HD2      ARG 753  53.365 -17.542   7.721
    8    HD3  ARG 753           HD3      ARG 753  55.051 -17.296   7.270
    9    HE   ARG 753           HE       ARG 753  54.107 -14.795   7.436
   10   HH11  ARG 753          HH11      ARG 753  54.007 -17.526   9.675
   11   HH12  ARG 753          HH12      ARG 753  53.940 -16.551  11.080
   12   HH21  ARG 753          HH21      ARG 753  54.018 -13.454   9.394
   13   HH22  ARG 753          HH22      ARG 753  53.980 -14.225  10.914

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ASN 754           H        ASN 754  53.892 -21.198   5.678
    2    HA   ASN 754           HA       ASN 754  53.963 -22.292   2.950
    3    HB2  ASN 754           HB2      ASN 754  54.057 -23.741   5.599
    4    HB3  ASN 754           HB3      ASN 754  54.126 -24.514   4.024
    5   HD21  ASN 754          HD21      ASN 754  55.981 -24.476   6.263
    6   HD22  ASN 754          HD22      ASN 754  57.480 -23.925   5.622

  No H/Q in entry =           6
  In of MODEL   12
    1    H    TYR 755           H        TYR 755  52.052 -22.719   1.991
    2    HA   TYR 755           HA       TYR 755  49.844 -23.607   3.654
    3    HB2  TYR 755           HB2      TYR 755  49.732 -21.243   1.795
    4    HB3  TYR 755           HB3      TYR 755  48.289 -22.159   2.197
    5    HD1  TYR 755           HD1      TYR 755  47.152 -21.755   4.233
    6    HD2  TYR 755           HD2      TYR 755  51.019 -20.151   3.641
    7    HE1  TYR 755           HE1      TYR 755  46.920 -20.417   6.288
    8    HE2  TYR 755           HE2      TYR 755  50.778 -18.803   5.666
    9    HH   TYR 755           HH       TYR 755  48.409 -19.420   7.926

  No H/Q in entry =           9
  In of MODEL   12
    1    H    THR 756           H        THR 756  48.289 -24.744   2.594
    2    HA   THR 756           HA       THR 756  49.027 -25.826  -0.037
    3    HB   THR 756           HB       THR 756  47.597 -27.082   2.338
    4    HG1  THR 756           HG1      THR 756  49.519 -27.584   2.948
    5   HG21  THR 756          HG21      THR 756  48.350 -28.317  -0.322
    6   HG23  THR 756          HG22      THR 756  46.718 -27.975   0.255
    7   HG22  THR 756          HG23      THR 756  47.696 -29.201   1.066

  No H/Q in entry =           7
  In of MODEL   12
    1    H    LEU 757           H        LEU 757  46.981 -26.240  -1.397
    2    HA   LEU 757           HA       LEU 757  44.866 -24.564  -0.351
    3    HB2  LEU 757           HB2      LEU 757  45.452 -25.273  -3.205
    4    HB3  LEU 757           HB3      LEU 757  43.941 -24.542  -2.700
    5    HG   LEU 757           HG       LEU 757  45.529 -22.780  -1.611
    6   HD12  LEU 757          HD11      LEU 757  47.497 -22.301  -2.971
    7   HD11  LEU 757          HD12      LEU 757  47.272 -23.843  -3.804
    8   HD13  LEU 757          HD13      LEU 757  47.611 -23.814  -2.075
    9   HD23  LEU 757          HD21      LEU 757  44.912 -22.837  -4.549
   10   HD22  LEU 757          HD22      LEU 757  45.263 -21.400  -3.553
   11   HD21  LEU 757          HD23      LEU 757  43.834 -22.382  -3.226

  No H/Q in entry =          11
  In of MODEL   12
    1    H    THR 758           H        THR 758  42.662 -25.162  -0.654
    2    HA   THR 758           HA       THR 758  42.333 -28.051  -0.712
    3    HB   THR 758           HB       THR 758  40.821 -27.752   1.350
    4    HG1  THR 758           HG1      THR 758  42.361 -25.743   2.329
    5   HG21  THR 758          HG21      THR 758  42.985 -28.946   1.411
    6   HG23  THR 758          HG22      THR 758  42.719 -28.043   2.899
    7   HG22  THR 758          HG23      THR 758  43.815 -27.414   1.676

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLY 759           H        GLY 759  39.818 -28.446  -0.283
    2    HA3  GLY 759           HA2      GLY 759  38.516 -27.198  -2.516
    3    HA2  GLY 759           HA3      GLY 759  37.849 -28.455  -1.478

  No H/Q in entry =           3
  In of MODEL   12
    1    H    ARG 760           H        ARG 760  36.373 -26.270  -2.358
    2    HA   ARG 760           HA       ARG 760  36.373 -24.122  -0.524
    3    HB2  ARG 760           HB2      ARG 760  34.279 -23.376  -1.548
    4    HB3  ARG 760           HB3      ARG 760  35.417 -23.870  -2.782
    5    HG2  ARG 760           HG2      ARG 760  33.376 -24.701  -3.543
    6    HG3  ARG 760           HG3      ARG 760  34.137 -26.100  -2.779
    7    HD2  ARG 760           HD2      ARG 760  32.818 -25.612  -0.728
    8    HD3  ARG 760           HD3      ARG 760  31.993 -24.325  -1.600
    9    HE   ARG 760           HE       ARG 760  31.604 -26.483  -3.158
   10   HH11  ARG 760          HH11      ARG 760  31.015 -25.869   0.273
   11   HH12  ARG 760          HH12      ARG 760  29.737 -26.981   0.400
   12   HH21  ARG 760          HH21      ARG 760  29.828 -27.944  -3.018
   13   HH22  ARG 760          HH22      ARG 760  29.011 -28.200  -1.562

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ASP 761           H        ASP 761  34.970 -27.213  -0.458
    2    HA   ASP 761           HA       ASP 761  32.899 -26.865   1.410
    3    HB2  ASP 761           HB2      ASP 761  33.030 -28.838   0.027
    4    HB3  ASP 761           HB3      ASP 761  34.580 -29.280   0.723

  No H/Q in entry =           4
  In of MODEL   12
    1    H    SER 762           H        SER 762  36.321 -27.225   1.711
    2    HA   SER 762           HA       SER 762  36.308 -28.077   4.425
    3    HB2  SER 762           HB2      SER 762  38.599 -27.054   2.758
    4    HB3  SER 762           HB3      SER 762  38.706 -28.020   4.230
    5    HG   SER 762           HG       SER 762  37.263 -29.512   2.910

  No H/Q in entry =           5
  In of MODEL   12
    1    H    CYS 763           H        CYS 763  36.512 -24.901   2.795
    2    HA   CYS 763           HA       CYS 763  37.128 -23.839   5.453
    3    HB2  CYS 763           HB2      CYS 763  38.207 -22.005   4.588
    4    HB3  CYS 763           HB3      CYS 763  38.759 -23.275   3.488

  No H/Q in entry =           4
  In of MODEL   12
    1    H    THR 764           H        THR 764  36.262 -21.556   5.693
    2    HA   THR 764           HA       THR 764  33.518 -21.576   4.800
    3    HB   THR 764           HB       THR 764  34.851 -19.872   6.925
    4    HG1  THR 764           HG1      THR 764  33.276 -22.236   7.087
    5   HG21  THR 764          HG21      THR 764  32.816 -18.898   5.966
    6   HG23  THR 764          HG22      THR 764  32.553 -19.403   7.642
    7   HG22  THR 764          HG23      THR 764  31.936 -20.390   6.307

  No H/Q in entry =           7
  In of MODEL   12
    1    H    LEU 765           H        LEU 765  33.686 -20.880   2.795
    2    HA   LEU 765           HA       LEU 765  35.230 -18.477   2.274
    3    HB2  LEU 765           HB2      LEU 765  35.249 -20.793   0.948
    4    HB3  LEU 765           HB3      LEU 765  33.878 -20.038   0.152
    5    HG   LEU 765           HG       LEU 765  35.323 -18.134  -0.484
    6   HD13  LEU 765          HD11      LEU 765  36.898 -18.193   1.295
    7   HD12  LEU 765          HD12      LEU 765  37.766 -18.414  -0.235
    8   HD11  LEU 765          HD13      LEU 765  37.422 -19.795   0.814
    9   HD23  LEU 765          HD21      LEU 765  36.614 -19.320  -2.164
   10   HD22  LEU 765          HD22      LEU 765  34.993 -20.004  -2.033
   11   HD21  LEU 765          HD23      LEU 765  36.368 -20.842  -1.308

  No H/Q in entry =          11
  In of MODEL   12
    1    HA   PRO 766           HA       PRO 766  31.464 -16.136   2.283
    2    HB2  PRO 766           HB2      PRO 766  32.318 -14.011   0.823
    3    HB3  PRO 766           HB3      PRO 766  32.719 -14.280   2.528
    4    HG2  PRO 766           HG2      PRO 766  34.351 -14.797   0.082
    5    HG3  PRO 766           HG3      PRO 766  34.859 -14.135   1.646
    6    HD2  PRO 766           HD2      PRO 766  35.290 -16.694   0.921
    7    HD3  PRO 766           HD3      PRO 766  35.024 -16.229   2.605

  No H/Q in entry =           7
  In of MODEL   12
    1    H    ALA 767           H        ALA 767  33.007 -17.002  -0.666
    2    HA   ALA 767           HA       ALA 767  30.674 -16.058  -2.151
    3    HB1  ALA 767           HB1      ALA 767  33.341 -16.821  -3.241
    4    HB2  ALA 767           HB2      ALA 767  32.827 -15.197  -2.790
    5    HB3  ALA 767           HB3      ALA 767  32.012 -16.046  -4.115

  No H/Q in entry =           5
  In of MODEL   12
    1    H    SER 768           H        SER 768  29.233 -17.353  -2.787
    2    HA   SER 768           HA       SER 768  29.896 -19.841  -4.068
    3    HB2  SER 768           HB2      SER 768  29.440 -20.463  -1.674
    4    HB3  SER 768           HB3      SER 768  27.853 -19.709  -1.806
    5    HG   SER 768           HG       SER 768  27.169 -21.303  -3.046

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA 769           H        ALA 769  27.197 -17.763  -2.892
    2    HA   ALA 769           HA       ALA 769  26.420 -16.790  -5.381
    3    HB2  ALA 769           HB1      ALA 769  24.660 -19.016  -4.292
    4    HB1  ALA 769           HB2      ALA 769  25.589 -19.093  -5.788
    5    HB3  ALA 769           HB3      ALA 769  24.250 -17.954  -5.641

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLU 770           H        GLU 770  23.899 -16.040  -4.978
    2    HA   GLU 770           HA       GLU 770  22.526 -14.644  -3.930
    3    HB2  GLU 770           HB2      GLU 770  23.344 -16.048  -1.416
    4    HB3  GLU 770           HB3      GLU 770  21.821 -15.222  -1.725
    5    HG2  GLU 770           HG2      GLU 770  22.807 -17.635  -3.158
    6    HG3  GLU 770           HG3      GLU 770  21.699 -17.708  -1.797

  No H/Q in entry =           6
  In of MODEL   12
    1    H    LYS 771           H        LYS 771  23.702 -12.674  -4.309
    2    HA   LYS 771           HA       LYS 771  24.827 -11.689  -1.803
    3    HB2  LYS 771           HB2      LYS 771  25.879 -10.902  -4.562
    4    HB3  LYS 771           HB3      LYS 771  26.441 -10.312  -3.017
    5    HG2  LYS 771           HG2      LYS 771  26.586 -13.192  -3.871
    6    HG3  LYS 771           HG3      LYS 771  27.921 -12.038  -3.941
    7    HD2  LYS 771           HD2      LYS 771  28.220 -12.042  -1.678
    8    HD3  LYS 771           HD3      LYS 771  26.530 -12.353  -1.314
    9    HE2  LYS 771           HE2      LYS 771  26.776 -14.625  -2.081
   10    HE3  LYS 771           HE3      LYS 771  28.496 -14.362  -2.408
   11    HZ1  LYS 771           HZ1      LYS 771  28.713 -13.797   0.020
   12    HZ3  LYS 771           HZ2      LYS 771  28.340 -15.377  -0.291
   13    HZ2  LYS 771           HZ3      LYS 771  27.129 -14.342   0.252

  No H/Q in entry =          13
  In of MODEL   12
    1    H    ALA 772           H        ALA 772  24.256  -9.784  -1.087
    2    HA   ALA 772           HA       ALA 772  22.105  -8.479  -2.567
    3    HB3  ALA 772           HB1      ALA 772  21.379  -9.502  -0.466
    4    HB1  ALA 772           HB2      ALA 772  21.258  -7.744  -0.397
    5    HB2  ALA 772           HB3      ALA 772  22.591  -8.568   0.412

  No H/Q in entry =           5
  In of MODEL   12
    1    H    CYS 773           H        CYS 773  21.914  -6.161  -2.099
    2    HA   CYS 773           HA       CYS 773  24.280  -4.789  -2.730
    3    HB2  CYS 773           HB2      CYS 773  21.951  -4.078  -3.309
    4    HB3  CYS 773           HB3      CYS 773  21.686  -3.708  -1.613

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLY 774           H        GLY 774  25.900  -4.270  -1.373
    2    HA3  GLY 774           HA2      GLY 774  26.300  -2.974   0.739
    3    HA2  GLY 774           HA3      GLY 774  25.286  -4.196   1.498

  No H/Q in entry =           3
  In of MODEL   12
    1    H    ALA 775           H        ALA 775  26.477  -6.243  -0.401
    2    HA   ALA 775           HA       ALA 775  29.216  -6.334   0.579
    3    HB1  ALA 775           HB1      ALA 775  28.955  -8.664   1.318
    4    HB2  ALA 775           HB2      ALA 775  27.227  -8.573   0.972
    5    HB3  ALA 775           HB3      ALA 775  27.926  -7.572   2.248

  No H/Q in entry =           5
  In of MODEL   12
    1    H    CYS 776           H        CYS 776  30.175  -6.268  -1.364
    2    HA   CYS 776           HA       CYS 776  29.537  -8.363  -3.277
    3    HB2  CYS 776           HB2      CYS 776  29.703  -5.426  -4.029
    4    HB3  CYS 776           HB3      CYS 776  29.459  -6.788  -5.120

  No H/Q in entry =           4
  In of MODEL   12
    1    HA   PRO 777           HA       PRO 777  34.021  -7.937  -3.586
    2    HB2  PRO 777           HB2      PRO 777  34.025  -9.468  -6.048
    3    HB3  PRO 777           HB3      PRO 777  34.570  -9.968  -4.447
    4    HG2  PRO 777           HG2      PRO 777  32.368 -11.010  -5.677
    5    HG3  PRO 777           HG3      PRO 777  32.562 -10.915  -3.916
    6    HD2  PRO 777           HD2      PRO 777  31.019  -9.127  -5.756
    7    HD3  PRO 777           HD3      PRO 777  30.576  -9.762  -4.150

  No H/Q in entry =           7
  In of MODEL   12
    1    H    LEU 778           H        LEU 778  35.598  -7.543  -5.665
    2    HA   LEU 778           HA       LEU 778  34.608  -5.157  -6.818
    3    HB2  LEU 778           HB2      LEU 778  36.808  -4.855  -7.928
    4    HB3  LEU 778           HB3      LEU 778  36.906  -5.097  -6.209
    5    HG   LEU 778           HG       LEU 778  38.765  -6.131  -7.192
    6   HD13  LEU 778          HD11      LEU 778  38.660  -8.443  -6.566
    7   HD12  LEU 778          HD12      LEU 778  36.906  -8.355  -6.487
    8   HD11  LEU 778          HD13      LEU 778  37.889  -7.394  -5.373
    9   HD23  LEU 778          HD21      LEU 778  38.655  -7.926  -8.874
   10   HD22  LEU 778          HD22      LEU 778  38.120  -6.356  -9.482
   11   HD21  LEU 778          HD23      LEU 778  36.931  -7.595  -9.069

  No H/Q in entry =          11
  In of MODEL   12
    1    H    TRP 779           H        TRP 779  34.110  -8.200  -7.767
    2    HA   TRP 779           HA       TRP 779  33.575  -7.365 -10.523
    3    HB2  TRP 779           HB2      TRP 779  33.265  -9.903 -10.917
    4    HB3  TRP 779           HB3      TRP 779  34.901  -9.303 -10.701
    5    HD1  TRP 779           HD1      TRP 779  32.161 -11.209  -8.715
    6    HE1  TRP 779           HE1      TRP 779  33.352 -12.616  -6.914
    7    HE3  TRP 779           HE3      TRP 779  36.932  -9.602  -9.456
    8    HZ2  TRP 779           HZ2      TRP 779  36.006 -12.962  -5.940
    9    HZ3  TRP 779           HZ3      TRP 779  38.726 -10.511  -8.063
   10    HH2  TRP 779           HH2      TRP 779  38.268 -12.147  -6.349

  No H/Q in entry =          10
  In of MODEL   12
    1    H    GLY 780           H        GLY 780  32.058  -7.149  -7.815
    2    HA3  GLY 780           HA2      GLY 780  29.475  -7.859  -8.980
    3    HA2  GLY 780           HA3      GLY 780  29.827  -8.222  -7.285

  No H/Q in entry =           3
  In of MODEL   12
    1    H    LYS 781           H        LYS 781  27.871  -6.312  -8.547
    2    HA   LYS 781           HA       LYS 781  28.689  -4.085  -6.899
    3    HB2  LYS 781           HB2      LYS 781  29.612  -3.879  -9.346
    4    HB3  LYS 781           HB3      LYS 781  27.959  -3.433  -9.730
    5    HG2  LYS 781           HG2      LYS 781  29.252  -1.441  -9.413
    6    HG3  LYS 781           HG3      LYS 781  28.135  -1.598  -8.054
    7    HD2  LYS 781           HD2      LYS 781  29.934  -2.500  -6.656
    8    HD3  LYS 781           HD3      LYS 781  31.032  -2.443  -8.032
    9    HE2  LYS 781           HE2      LYS 781  30.865  -0.032  -8.098
   10    HE3  LYS 781           HE3      LYS 781  29.677  -0.064  -6.798
   11    HZ2  LYS 781           HZ1      LYS 781  32.562  -0.854  -6.550
   12    HZ1  LYS 781           HZ2      LYS 781  31.418  -0.993  -5.337
   13    HZ3  LYS 781           HZ3      LYS 781  31.820   0.520  -5.919

  No H/Q in entry =          13
  In of MODEL   12
    1    H    CYS 782           H        CYS 782  27.000  -2.752  -6.365
    2    HA   CYS 782           HA       CYS 782  24.354  -3.840  -6.821
    3    HB2  CYS 782           HB2      CYS 782  24.919  -3.473  -4.527
    4    HB3  CYS 782           HB3      CYS 782  25.503  -1.849  -4.863

  No H/Q in entry =           4
  In of MODEL   12
    1    H    ASP 783           H        ASP 783  23.059  -2.904  -8.257
    2    HA   ASP 783           HA       ASP 783  23.785  -0.348  -9.374
    3    HB2  ASP 783           HB2      ASP 783  21.601  -2.319 -10.099
    4    HB3  ASP 783           HB3      ASP 783  21.780  -0.757 -10.885

  No H/Q in entry =           4
  In of MODEL   12
    1    H    ALA 784           H        ALA 784  21.645   1.094  -9.830
    2    HA   ALA 784           HA       ALA 784  21.304   2.271  -7.313
    3    HB2  ALA 784           HB1      ALA 784  19.932   3.916  -8.415
    4    HB3  ALA 784           HB2      ALA 784  19.734   2.855  -9.809
    5    HB1  ALA 784           HB3      ALA 784  21.321   3.520  -9.428

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLU 785           H        GLU 785  18.927   0.452  -9.258
    2    HA   GLU 785           HA       GLU 785  17.081   0.666  -6.997
    3    HB2  GLU 785           HB2      GLU 785  16.470   1.316  -9.426
    4    HB3  GLU 785           HB3      GLU 785  16.388  -0.420  -9.700
    5    HG2  GLU 785           HG2      GLU 785  14.184   0.501  -9.234
    6    HG3  GLU 785           HG3      GLU 785  14.688  -0.636  -7.977

  No H/Q in entry =           6
  In of MODEL   12
    1    H    SER 786           H        SER 786  19.440  -1.215  -7.440
    2    HA   SER 786           HA       SER 786  18.010  -3.745  -7.425
    3    HB2  SER 786           HB2      SER 786  20.960  -3.162  -7.648
    4    HB3  SER 786           HB3      SER 786  20.221  -4.761  -7.733
    5    HG   SER 786           HG       SER 786  19.325  -2.712  -9.444

  No H/Q in entry =           5
  In of MODEL   12
    1    H    SER 787           H        SER 787  17.559  -4.649  -5.556
    2    HA   SER 787           HA       SER 787  18.869  -3.877  -3.084
    3    HB2  SER 787           HB2      SER 787  16.893  -6.106  -3.596
    4    HB3  SER 787           HB3      SER 787  17.214  -5.300  -2.057
    5    HG   SER 787           HG       SER 787  16.516  -3.352  -3.500

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LYS 788           H        LYS 788  18.908  -6.241  -5.539
    2    HA   LYS 788           HA       LYS 788  20.570  -8.171  -4.156
    3    HB2  LYS 788           HB2      LYS 788  18.766  -8.951  -5.593
    4    HB3  LYS 788           HB3      LYS 788  19.399  -8.015  -6.936
    5    HG2  LYS 788           HG2      LYS 788  21.437  -9.442  -6.871
    6    HG3  LYS 788           HG3      LYS 788  20.636 -10.438  -5.656
    7    HD2  LYS 788           HD2      LYS 788  18.868 -10.974  -7.186
    8    HD3  LYS 788           HD3      LYS 788  19.511  -9.848  -8.381
    9    HE2  LYS 788           HE2      LYS 788  21.541 -11.204  -8.538
   10    HE3  LYS 788           HE3      LYS 788  20.877 -12.332  -7.361
   11    HZ3  LYS 788           HZ1      LYS 788  20.536 -13.157  -9.570
   12    HZ2  LYS 788           HZ2      LYS 788  19.769 -11.728 -10.045
   13    HZ1  LYS 788           HZ3      LYS 788  19.036 -12.734  -8.917

  No H/Q in entry =          13
  In of MODEL   12
    1    H    CYS 789           H        CYS 789  22.668  -8.669  -4.939
    2    HA   CYS 789           HA       CYS 789  23.970  -6.483  -6.363
    3    HB2  CYS 789           HB2      CYS 789  24.834  -7.100  -4.129
    4    HB3  CYS 789           HB3      CYS 789  25.075  -8.748  -4.694

  No H/Q in entry =           4
  In of MODEL   12
    1    H    VAL 790           H        VAL 790  24.778  -6.916  -8.352
    2    HA   VAL 790           HA       VAL 790  24.491  -9.684  -9.272
    3    HB   VAL 790           HB       VAL 790  22.914  -8.008 -10.325
    4   HG12  VAL 790          HG11      VAL 790  23.774  -6.483 -12.041
    5   HG11  VAL 790          HG12      VAL 790  25.411  -6.853 -11.510
    6   HG13  VAL 790          HG13      VAL 790  24.287  -6.064 -10.406
    7   HG22  VAL 790          HG21      VAL 790  23.235  -8.755 -12.653
    8   HG21  VAL 790          HG22      VAL 790  23.419 -10.079 -11.500
    9   HG23  VAL 790          HG23      VAL 790  24.844  -9.333 -12.224

  No H/Q in entry =           9
  In of MODEL   12
    1    H    CYS 791           H        CYS 791  26.086 -10.326 -10.906
    2    HA   CYS 791           HA       CYS 791  28.694  -9.226 -10.193
    3    HB2  CYS 791           HB2      CYS 791  28.081 -11.752 -11.722
    4    HB3  CYS 791           HB3      CYS 791  29.532 -11.351 -10.803

  No H/Q in entry =           4
  In of MODEL   12
    1    H    ARG 792           H        ARG 792  29.892  -8.240 -11.664
    2    HA   ARG 792           HA       ARG 792  28.660  -7.512 -14.169
    3    HB2  ARG 792           HB2      ARG 792  30.999  -6.634 -12.600
    4    HB3  ARG 792           HB3      ARG 792  31.181  -6.535 -14.337
    5    HG2  ARG 792           HG2      ARG 792  30.429  -4.405 -13.511
    6    HG3  ARG 792           HG3      ARG 792  29.152  -5.159 -14.448
    7    HD2  ARG 792           HD2      ARG 792  27.961  -5.748 -12.442
    8    HD3  ARG 792           HD3      ARG 792  29.283  -5.138 -11.437
    9    HE   ARG 792           HE       ARG 792  28.835  -2.986 -12.762
   10   HH11  ARG 792          HH11      ARG 792  26.366  -5.079 -11.333
   11   HH12  ARG 792          HH12      ARG 792  25.144  -3.887 -11.392
   12   HH21  ARG 792          HH21      ARG 792  27.116  -1.332 -12.770
   13   HH22  ARG 792          HH22      ARG 792  25.566  -1.782 -12.216

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLU 793           H        GLU 793  29.875  -7.760 -16.212
    2    HA   GLU 793           HA       GLU 793  30.832 -10.468 -16.386
    3    HB2  GLU 793           HB2      GLU 793  30.303  -8.350 -18.454
    4    HB3  GLU 793           HB3      GLU 793  30.987  -9.918 -18.853
    5    HG2  GLU 793           HG2      GLU 793  28.331  -9.495 -17.502
    6    HG3  GLU 793           HG3      GLU 793  28.557  -9.810 -19.223

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ALA 794           H        ALA 794  32.754 -10.773 -17.989
    2    HA   ALA 794           HA       ALA 794  35.049  -9.991 -16.572
    3    HB1  ALA 794           HB1      ALA 794  34.901 -11.133 -19.356
    4    HB2  ALA 794           HB2      ALA 794  34.791 -12.067 -17.876
    5    HB3  ALA 794           HB3      ALA 794  36.277 -11.189 -18.252

  No H/Q in entry =           5
  In of MODEL   12
    1    H    SER 795           H        SER 795  33.383  -8.648 -19.217
    2    HA   SER 795           HA       SER 795  35.261  -7.056 -20.456
    3    HB2  SER 795           HB2      SER 795  32.363  -6.418 -19.929
    4    HB3  SER 795           HB3      SER 795  33.356  -5.712 -21.199
    5    HG   SER 795           HG       SER 795  33.314  -8.481 -21.241

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLU 796           H        GLU 796  33.646  -6.630 -17.356
    2    HA   GLU 796           HA       GLU 796  34.160  -3.771 -17.221
    3    HB2  GLU 796           HB2      GLU 796  32.884  -5.647 -15.245
    4    HB3  GLU 796           HB3      GLU 796  32.922  -3.895 -15.128
    5    HG2  GLU 796           HG2      GLU 796  31.614  -5.430 -17.356
    6    HG3  GLU 796           HG3      GLU 796  30.773  -4.805 -15.942

  No H/Q in entry =           6
  In of MODEL   12
    1    H    CYS 797           H        CYS 797  36.354  -5.894 -17.047
    2    HA   CYS 797           HA       CYS 797  37.243  -5.810 -14.335
    3    HB2  CYS 797           HB2      CYS 797  37.731  -7.666 -15.912
    4    HB3  CYS 797           HB3      CYS 797  38.815  -6.576 -16.777

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLU 798           H        GLU 798  37.587  -3.833 -13.664
    2    HA   GLU 798           HA       GLU 798  39.383  -2.025 -15.129
    3    HB2  GLU 798           HB2      GLU 798  38.738  -0.322 -13.482
    4    HB3  GLU 798           HB3      GLU 798  37.318  -1.048 -14.220
    5    HG2  GLU 798           HG2      GLU 798  36.931  -2.391 -12.249
    6    HG3  GLU 798           HG3      GLU 798  38.421  -1.806 -11.522

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU 799           H        GLU 799  39.218  -3.969 -12.290
    2    HA   GLU 799           HA       GLU 799  41.527  -2.766 -11.036
    3    HB2  GLU 799           HB2      GLU 799  39.548  -3.501  -9.750
    4    HB3  GLU 799           HB3      GLU 799  39.890  -5.161 -10.222
    5    HG2  GLU 799           HG2      GLU 799  40.658  -4.757  -7.993
    6    HG3  GLU 799           HG3      GLU 799  42.035  -5.025  -9.065

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLU 800           H        GLU 800  40.619  -5.752 -12.633
    2    HA   GLU 800           HA       GLU 800  41.726  -7.275 -13.747
    3    HB2  GLU 800           HB2      GLU 800  44.220  -5.659 -13.211
    4    HB3  GLU 800           HB3      GLU 800  44.140  -7.050 -14.289
    5    HG2  GLU 800           HG2      GLU 800  42.585  -5.911 -15.730
    6    HG3  GLU 800           HG3      GLU 800  42.484  -4.558 -14.610

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLY 801           H        GLY 801  42.850  -6.551 -10.537
    2    HA3  GLY 801           HA2      GLY 801  43.815  -7.752  -8.917
    3    HA2  GLY 801           HA3      GLY 801  42.862  -9.086  -9.557

  No H/Q in entry =           3
  In of MODEL   12
    1    H    PHE 802           H        PHE 802  44.201 -10.650  -9.479
    2    HA   PHE 802           HA       PHE 802  46.800 -10.530 -10.793
    3    HB2  PHE 802           HB2      PHE 802  45.405 -12.531  -9.046
    4    HB3  PHE 802           HB3      PHE 802  46.768 -13.017 -10.035
    5    HD1  PHE 802           HD1      PHE 802  47.590 -13.710  -7.745
    6    HD2  PHE 802           HD2      PHE 802  47.088  -9.656  -8.892
    7    HE1  PHE 802           HE1      PHE 802  49.130 -13.060  -6.017
    8    HE2  PHE 802           HE2      PHE 802  48.650  -8.968  -7.185
    9    HZ   PHE 802           HZ       PHE 802  49.688 -10.660  -5.689

  No H/Q in entry =           9
  In of MODEL   12
    1    H    SER 803           H        SER 803  47.087 -12.896 -11.821
    2    HA   SER 803           HA       SER 803  44.851 -13.405 -13.560
    3    HB2  SER 803           HB2      SER 803  47.792 -13.326 -14.274
    4    HB3  SER 803           HB3      SER 803  46.485 -13.823 -15.355
    5    HG   SER 803           HG       SER 803  46.010 -11.448 -14.144

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ILE 804           H        ILE 804  44.324 -15.483 -13.506
    2    HA   ILE 804           HA       ILE 804  46.124 -17.329 -12.116
    3    HB   ILE 804           HB       ILE 804  44.339 -18.230 -10.754
    4   HG12  ILE 804          HG12      ILE 804  42.438 -17.847 -12.400
    5   HG13  ILE 804          HG13      ILE 804  42.044 -17.491 -10.729
    6   HG23  ILE 804          HG21      ILE 804  43.790 -16.315  -9.306
    7   HG22  ILE 804          HG22      ILE 804  44.319 -15.229 -10.593
    8   HG21  ILE 804          HG23      ILE 804  45.485 -16.307  -9.819
    9   HD12  ILE 804          HD11      ILE 804  42.636 -15.487 -12.908
   10   HD11  ILE 804          HD12      ILE 804  42.349 -15.084 -11.219
   11   HD13  ILE 804          HD13      ILE 804  41.073 -15.836 -12.170

  No H/Q in entry =          11
  In of MODEL   12
    1    H    CYS 805           H        CYS 805  45.722 -19.592 -12.595
    2    HA   CYS 805           HA       CYS 805  44.720 -19.860 -15.278
    3    HB2  CYS 805           HB2      CYS 805  46.938 -20.811 -14.547
    4    HB3  CYS 805           HB3      CYS 805  46.021 -21.998 -13.616

  No H/Q in entry =           4
  In of MODEL   12
    1    H    VAL 806           H        VAL 806  42.612 -20.524 -15.510
    2    HA   VAL 806           HA       VAL 806  41.582 -22.340 -13.464
    3    HB   VAL 806           HB       VAL 806  40.626 -20.112 -13.111
    4   HG12  VAL 806          HG11      VAL 806  39.628 -20.354 -15.912
    5   HG11  VAL 806          HG12      VAL 806  40.877 -19.258 -15.328
    6   HG13  VAL 806          HG13      VAL 806  39.207 -19.070 -14.777
    7   HG21  VAL 806          HG21      VAL 806  39.162 -22.031 -12.642
    8   HG23  VAL 806          HG22      VAL 806  38.589 -21.989 -14.300
    9   HG22  VAL 806          HG23      VAL 806  38.243 -20.640 -13.217

  No H/Q in entry =           9
  In of MODEL   12
    1    H    GLU 807           H        GLU 807  40.341 -24.046 -14.186
    2    HA   GLU 807           HA       GLU 807  40.515 -24.597 -16.988
    3    HB2  GLU 807           HB2      GLU 807  40.897 -26.381 -15.288
    4    HB3  GLU 807           HB3      GLU 807  39.243 -26.176 -14.739
    5    HG2  GLU 807           HG2      GLU 807  38.453 -26.853 -16.982
    6    HG3  GLU 807           HG3      GLU 807  40.147 -27.114 -17.428

  No H/Q in entry =           6
  In of MODEL   12
    1    H    VAL 808           H        VAL 808  39.116 -23.919 -18.288
    2    HA   VAL 808           HA       VAL 808  36.308 -23.714 -17.623
    3    HB   VAL 808           HB       VAL 808  37.252 -21.476 -17.227
    4   HG12  VAL 808          HG11      VAL 808  38.144 -20.090 -19.044
    5   HG11  VAL 808          HG12      VAL 808  38.153 -21.509 -20.088
    6   HG13  VAL 808          HG13      VAL 808  39.174 -21.468 -18.652
    7   HG22  VAL 808          HG21      VAL 808  35.763 -20.168 -18.683
    8   HG21  VAL 808          HG22      VAL 808  34.972 -21.598 -18.005
    9   HG23  VAL 808          HG23      VAL 808  35.525 -21.602 -19.679

  No H/Q in entry =           9
  In of MODEL   12
    1    H    ASN 809           H        ASN 809  35.143 -24.499 -19.239
    2    HA   ASN 809           HA       ASN 809  34.518 -25.336 -21.251
    3    HB2  ASN 809           HB2      ASN 809  36.636 -23.431 -22.045
    4    HB3  ASN 809           HB3      ASN 809  35.918 -24.440 -23.329
    5   HD21  ASN 809          HD21      ASN 809  35.804 -21.606 -21.510
    6   HD22  ASN 809          HD22      ASN 809  34.231 -21.061 -21.941

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLY 810           H        GLY 810  36.747 -26.471 -19.551
    2    HA3  GLY 810           HA2      GLY 810  37.731 -28.614 -19.682
    3    HA2  GLY 810           HA3      GLY 810  37.511 -28.543 -21.433

  No H/Q in entry =           3
  In of MODEL   12
    1    H    LYS 811           H        LYS 811  38.706 -25.721 -20.946
    2    HA   LYS 811           HA       LYS 811  41.479 -26.519 -21.486
    3    HB2  LYS 811           HB2      LYS 811  39.947 -23.966 -21.953
    4    HB3  LYS 811           HB3      LYS 811  41.639 -24.219 -22.341
    5    HG2  LYS 811           HG2      LYS 811  41.106 -25.729 -24.076
    6    HG3  LYS 811           HG3      LYS 811  39.424 -25.852 -23.545
    7    HD2  LYS 811           HD2      LYS 811  39.711 -24.395 -25.535
    8    HD3  LYS 811           HD3      LYS 811  39.006 -23.569 -24.146
    9    HE2  LYS 811           HE2      LYS 811  41.237 -22.640 -23.606
   10    HE3  LYS 811           HE3      LYS 811  41.897 -23.415 -25.042
   11    HZ1  LYS 811           HZ1      LYS 811  39.729 -21.385 -25.036
   12    HZ3  LYS 811           HZ2      LYS 811  40.467 -22.021 -26.402
   13    HZ2  LYS 811           HZ3      LYS 811  41.348 -21.049 -25.321

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLU 812           H        GLU 812  43.096 -25.174 -20.451
    2    HA   GLU 812           HA       GLU 812  42.114 -23.840 -18.029
    3    HB2  GLU 812           HB2      GLU 812  44.838 -24.927 -18.696
    4    HB3  GLU 812           HB3      GLU 812  44.515 -23.903 -17.308
    5    HG2  GLU 812           HG2      GLU 812  42.985 -25.607 -16.444
    6    HG3  GLU 812           HG3      GLU 812  43.379 -26.635 -17.826

  No H/Q in entry =           6
  In of MODEL   12
    1    H    GLN 813           H        GLN 813  41.963 -21.776 -18.205
    2    HA   GLN 813           HA       GLN 813  43.808 -20.451 -20.043
    3    HB2  GLN 813           HB2      GLN 813  41.592 -20.455 -20.982
    4    HB3  GLN 813           HB3      GLN 813  40.906 -19.792 -19.498
    5    HG2  GLN 813           HG2      GLN 813  42.223 -17.794 -19.818
    6    HG3  GLN 813           HG3      GLN 813  42.864 -18.416 -21.339
    7   HE21  GLN 813          HE21      GLN 813  40.210 -16.926 -19.759
    8   HE22  GLN 813          HE22      GLN 813  39.220 -16.696 -21.144

  No H/Q in entry =           8
  In of MODEL   12
    1    H    THR 814           H        THR 814  44.786 -18.685 -19.291
    2    HA   THR 814           HA       THR 814  44.475 -18.061 -16.491
    3    HB   THR 814           HB       THR 814  46.072 -16.680 -18.564
    4    HG1  THR 814           HG1      THR 814  47.789 -18.048 -18.041
    5   HG22  THR 814          HG21      THR 814  46.347 -16.753 -15.568
    6   HG21  THR 814          HG22      THR 814  45.803 -15.400 -16.556
    7   HG23  THR 814          HG23      THR 814  47.481 -15.944 -16.652

  No H/Q in entry =           7
  In of MODEL   12
    1    H    MET 815           H        MET 815  43.173 -16.555 -15.906
    2    HA   MET 815           HA       MET 815  42.497 -14.479 -17.818
    3    HB2  MET 815           HB2      MET 815  40.165 -14.534 -16.844
    4    HB3  MET 815           HB3      MET 815  40.595 -15.839 -17.930
    5    HG2  MET 815           HG2      MET 815  41.053 -17.245 -16.104
    6    HG3  MET 815           HG3      MET 815  40.613 -16.020 -14.931
    7    HE1  MET 815           HE1      MET 815  39.395 -18.559 -17.526
    8    HE3  MET 815           HE2      MET 815  38.976 -17.069 -18.385
    9    HE2  MET 815           HE3      MET 815  37.699 -18.151 -17.807

  No H/Q in entry =           9
  In of MODEL   12
    1    H    SER 816           H        SER 816  41.276 -12.709 -16.583
    2    HA   SER 816           HA       SER 816  43.119 -11.935 -14.522
    3    HB2  SER 816           HB2      SER 816  40.801 -10.465 -15.803
    4    HB3  SER 816           HB3      SER 816  42.017  -9.745 -14.742
    5    HG   SER 816           HG       SER 816  42.412  -9.445 -17.018

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLU 817           H        GLU 817  42.306 -11.058 -12.557
    2    HA   GLU 817           HA       GLU 817  40.829 -12.985 -11.244
    3    HB2  GLU 817           HB2      GLU 817  42.620 -11.122 -10.519
    4    HB3  GLU 817           HB3      GLU 817  41.089 -10.326 -10.101
    5    HG2  GLU 817           HG2      GLU 817  40.637 -11.648  -8.445
    6    HG3  GLU 817           HG3      GLU 817  41.313 -13.044  -9.282

  No H/Q in entry =           6
  In of MODEL   12
    1    H    CYS 818           H        CYS 818  39.795  -9.870 -12.596
    2    HA   CYS 818           HA       CYS 818  37.229  -9.806 -11.368
    3    HB2  CYS 818           HB2      CYS 818  37.566  -8.895 -14.188
    4    HB3  CYS 818           HB3      CYS 818  36.618  -8.176 -12.902

  No H/Q in entry =           4
  In of MODEL   12
    1    H    GLU 819           H        GLU 819  38.558 -11.444 -14.147
    2    HA   GLU 819           HA       GLU 819  36.083 -12.063 -15.394
    3    HB2  GLU 819           HB2      GLU 819  38.198 -11.817 -16.633
    4    HB3  GLU 819           HB3      GLU 819  38.832 -13.225 -15.802
    5    HG2  GLU 819           HG2      GLU 819  37.394 -14.676 -16.934
    6    HG3  GLU 819           HG3      GLU 819  36.370 -13.358 -17.506

  No H/Q in entry =           6
  In of MODEL   12
    1    H    ALA 820           H        ALA 820  38.541 -14.102 -13.857
    2    HA   ALA 820           HA       ALA 820  36.999 -16.400 -13.767
    3    HB3  ALA 820           HB1      ALA 820  39.089 -15.578 -11.764
    4    HB1  ALA 820           HB2      ALA 820  39.378 -16.435 -13.287
    5    HB2  ALA 820           HB3      ALA 820  38.478 -17.217 -11.987

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLY 821           H        GLY 821  37.196 -13.727 -11.509
    2    HA3  GLY 821           HA2      GLY 821  35.605 -14.799  -9.457
    3    HA2  GLY 821           HA3      GLY 821  35.904 -13.088  -9.743

  No H/Q in entry =           3
  In of MODEL   12
    1    H    ALA 822           H        ALA 822  34.798 -12.807 -12.268
    2    HA   ALA 822           HA       ALA 822  32.104 -12.423 -11.640
    3    HB3  ALA 822           HB1      ALA 822  31.823 -11.747 -13.932
    4    HB1  ALA 822           HB2      ALA 822  33.373 -12.470 -14.372
    5    HB2  ALA 822           HB3      ALA 822  33.313 -11.079 -13.279

  No H/Q in entry =           5
  In of MODEL   12
    1    H    LEU 823           H        LEU 823  33.669 -14.866 -13.689
    2    HA   LEU 823           HA       LEU 823  31.232 -16.102 -14.406
    3    HB2  LEU 823           HB2      LEU 823  34.054 -17.198 -14.437
    4    HB3  LEU 823           HB3      LEU 823  32.692 -18.186 -14.855
    5    HG   LEU 823           HG       LEU 823  33.672 -17.483 -16.887
    6   HD12  LEU 823          HD11      LEU 823  31.232 -15.803 -16.472
    7   HD11  LEU 823          HD12      LEU 823  31.260 -17.516 -16.882
    8   HD13  LEU 823          HD13      LEU 823  31.893 -16.331 -18.021
    9   HD22  LEU 823          HD21      LEU 823  34.940 -15.546 -16.141
   10   HD21  LEU 823          HD22      LEU 823  33.447 -14.631 -15.946
   11   HD23  LEU 823          HD23      LEU 823  33.963 -15.143 -17.552

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ARG 824           H        ARG 824  33.385 -16.645 -11.696
    2    HA   ARG 824           HA       ARG 824  31.911 -18.917 -10.749
    3    HB2  ARG 824           HB2      ARG 824  34.357 -18.322 -10.215
    4    HB3  ARG 824           HB3      ARG 824  33.705 -17.156  -9.075
    5    HG2  ARG 824           HG2      ARG 824  32.585 -18.956  -7.862
    6    HG3  ARG 824           HG3      ARG 824  33.230 -20.147  -8.979
    7    HD2  ARG 824           HD2      ARG 824  34.677 -20.206  -7.129
    8    HD3  ARG 824           HD3      ARG 824  35.519 -19.272  -8.343
    9    HE   ARG 824           HE       ARG 824  34.378 -17.294  -7.119
   10   HH11  ARG 824          HH11      ARG 824  36.055 -20.062  -5.570
   11   HH12  ARG 824          HH12      ARG 824  36.403 -19.165  -4.164
   12   HH21  ARG 824          HH21      ARG 824  34.862 -16.175  -5.109
   13   HH22  ARG 824          HH22      ARG 824  35.628 -16.983  -3.854

  No H/Q in entry =          13
  In of MODEL   12
    1    H    CYS 825           H        CYS 825  31.537 -15.540 -10.554
    2    HA   CYS 825           HA       CYS 825  29.910 -15.495  -8.191
    3    HB2  CYS 825           HB2      CYS 825  31.392 -13.603  -9.007
    4    HB3  CYS 825           HB3      CYS 825  30.253 -13.367 -10.320

  No H/Q in entry =           4
  In of MODEL   12
    1    H    ARG 826           H        ARG 826  29.442 -15.480 -11.698
    2    HA   ARG 826           HA       ARG 826  26.609 -15.153 -11.422
    3    HB2  ARG 826           HB2      ARG 826  26.519 -15.456 -13.878
    4    HB3  ARG 826           HB3      ARG 826  27.564 -14.124 -13.340
    5    HG2  ARG 826           HG2      ARG 826  29.468 -15.442 -13.844
    6    HG3  ARG 826           HG3      ARG 826  28.455 -16.834 -14.262
    7    HD2  ARG 826           HD2      ARG 826  28.401 -14.140 -15.636
    8    HD3  ARG 826           HD3      ARG 826  29.167 -15.596 -16.273
    9    HE   ARG 826           HE       ARG 826  26.860 -16.593 -16.081
   10   HH11  ARG 826          HH11      ARG 826  27.347 -13.103 -16.882
   11   HH12  ARG 826          HH12      ARG 826  25.882 -12.998 -17.703
   12   HH21  ARG 826          HH21      ARG 826  24.864 -16.349 -17.316
   13   HH22  ARG 826          HH22      ARG 826  24.457 -14.839 -17.978

  No H/Q in entry =          13
  In of MODEL   12
    1    H    GLY 827           H        GLY 827  28.618 -17.888 -11.397
    2    HA3  GLY 827           HA2      GLY 827  27.432 -19.893 -10.577
    3    HA2  GLY 827           HA3      GLY 827  26.143 -19.428 -11.687

  No H/Q in entry =           3
  In of MODEL   12
    1    H    GLN 828           H        GLN 828  28.802 -18.831 -13.386
    2    HA   GLN 828           HA       GLN 828  28.548 -21.078 -15.086
    3    HB2  GLN 828           HB2      GLN 828  29.421 -18.925 -15.874
    4    HB3  GLN 828           HB3      GLN 828  30.803 -19.081 -14.805
    5    HG2  GLN 828           HG2      GLN 828  31.441 -19.578 -17.105
    6    HG3  GLN 828           HG3      GLN 828  31.579 -21.001 -16.082
    7   HE21  GLN 828          HE21      GLN 828  29.744 -19.486 -18.617
    8   HE22  GLN 828          HE22      GLN 828  28.981 -20.928 -19.170

  No H/Q in entry =           8
  In of MODEL   12
    1    H    SER 829           H        SER 829  29.980 -22.805 -15.449
    2    HA   SER 829           HA       SER 829  31.157 -23.812 -13.002
    3    HB2  SER 829           HB2      SER 829  30.783 -25.143 -15.691
    4    HB3  SER 829           HB3      SER 829  31.173 -25.942 -14.161
    5    HG   SER 829           HG       SER 829  29.007 -24.362 -13.945

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ILE 830           H        ILE 830  33.191 -23.484 -12.596
    2    HA   ILE 830           HA       ILE 830  35.217 -23.615 -14.665
    3    HB   ILE 830           HB       ILE 830  36.412 -21.642 -13.879
    4   HG12  ILE 830          HG12      ILE 830  35.592 -21.628 -11.504
    5   HG13  ILE 830          HG13      ILE 830  35.594 -20.034 -12.191
    6   HG21  ILE 830          HG21      ILE 830  33.605 -20.940 -14.633
    7   HG23  ILE 830          HG22      ILE 830  34.967 -21.231 -15.720
    8   HG22  ILE 830          HG23      ILE 830  34.962 -19.812 -14.667
    9   HD12  ILE 830          HD11      ILE 830  33.209 -21.813 -11.781
   10   HD11  ILE 830          HD12      ILE 830  33.176 -20.237 -12.576
   11   HD13  ILE 830          HD13      ILE 830  33.644 -20.357 -10.882

  No H/Q in entry =          11
  In of MODEL   12
    1    H    SER 831           H        SER 831  37.273 -24.125 -13.740
    2    HA   SER 831           HA       SER 831  37.138 -24.882 -10.935
    3    HB2  SER 831           HB2      SER 831  38.107 -26.451 -13.276
    4    HB3  SER 831           HB3      SER 831  38.454 -26.870 -11.604
    5    HG   SER 831           HG       SER 831  35.813 -26.362 -11.984

  No H/Q in entry =           5
  In of MODEL   12
    1    H    VAL 832           H        VAL 832  38.507 -23.342 -10.115
    2    HA   VAL 832           HA       VAL 832  40.854 -22.423 -11.428
    3    HB   VAL 832           HB       VAL 832  40.149 -22.344  -8.470
    4   HG12  VAL 832          HG11      VAL 832  42.124 -20.688 -10.053
    5   HG11  VAL 832          HG12      VAL 832  42.526 -21.934  -8.873
    6   HG13  VAL 832          HG13      VAL 832  41.721 -20.454  -8.352
    7   HG21  VAL 832          HG21      VAL 832  38.430 -21.246  -9.806
    8   HG23  VAL 832          HG22      VAL 832  39.660 -20.279 -10.620
    9   HG22  VAL 832          HG23      VAL 832  39.360 -20.054  -8.896

  No H/Q in entry =           9
  In of MODEL   12
    1    H    THR 833           H        THR 833  42.497 -23.729 -11.887
    2    HA   THR 833           HA       THR 833  42.820 -26.154 -10.469
    3    HB   THR 833           HB       THR 833  44.741 -26.440 -12.086
    4    HG1  THR 833           HG1      THR 833  44.736 -24.874 -13.808
    5   HG23  THR 833          HG21      THR 833  42.516 -27.277 -12.618
    6   HG22  THR 833          HG22      THR 833  43.253 -26.613 -14.079
    7   HG21  THR 833          HG23      THR 833  42.031 -25.696 -13.218

  No H/Q in entry =           7
  In of MODEL   12
    1    H    SER 834           H        SER 834  44.560 -23.123 -10.788
    2    HA   SER 834           HA       SER 834  45.578 -23.426  -8.121
    3    HB2  SER 834           HB2      SER 834  47.454 -23.068 -10.489
    4    HB3  SER 834           HB3      SER 834  47.910 -23.006  -8.784
    5    HG   SER 834           HG       SER 834  46.635 -25.230  -9.097

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ILE 835           H        ILE 835  46.204 -21.296  -7.304
    2    HA   ILE 835           HA       ILE 835  44.823 -19.288  -8.814
    3    HB   ILE 835           HB       ILE 835  44.846 -17.838  -6.985
    4   HG12  ILE 835          HG12      ILE 835  47.239 -17.937  -6.322
    5   HG13  ILE 835          HG13      ILE 835  46.161 -18.023  -4.942
    6   HG21  ILE 835          HG21      ILE 835  44.624 -20.629  -5.935
    7   HG23  ILE 835          HG22      ILE 835  43.348 -19.630  -6.643
    8   HG22  ILE 835          HG23      ILE 835  44.062 -19.197  -5.084
    9   HD12  ILE 835          HD11      ILE 835  48.017 -19.414  -4.718
   10   HD11  ILE 835          HD12      ILE 835  47.609 -20.275  -6.231
   11   HD13  ILE 835          HD13      ILE 835  46.522 -20.357  -4.807

  No H/Q in entry =          11
  In of MODEL   12
    1    H    ARG 836           H        ARG 836  47.460 -20.431  -9.569
    2    HA   ARG 836           HA       ARG 836  49.067 -18.003  -9.905
    3    HB2  ARG 836           HB2      ARG 836  50.885 -19.467 -10.552
    4    HB3  ARG 836           HB3      ARG 836  50.286 -19.878  -8.957
    5    HG2  ARG 836           HG2      ARG 836  49.102 -21.754  -9.856
    6    HG3  ARG 836           HG3      ARG 836  49.648 -21.346 -11.497
    7    HD2  ARG 836           HD2      ARG 836  51.909 -21.505 -10.777
    8    HD3  ARG 836           HD3      ARG 836  51.376 -21.900  -9.147
    9    HE   ARG 836           HE       ARG 836  50.611 -23.677 -11.384
   10   HH11  ARG 836          HH11      ARG 836  52.425 -23.256  -8.367
   11   HH12  ARG 836          HH12      ARG 836  52.776 -24.909  -8.187
   12   HH21  ARG 836          HH21      ARG 836  51.105 -25.934 -11.136
   13   HH22  ARG 836          HH22      ARG 836  51.962 -26.485  -9.776

  No H/Q in entry =          13
  In of MODEL   12
    1    HA   PRO 837           HA       PRO 837  47.616 -17.989 -14.100
    2    HB2  PRO 837           HB2      PRO 837  49.625 -16.675 -15.352
    3    HB3  PRO 837           HB3      PRO 837  48.491 -15.862 -14.268
    4    HG2  PRO 837           HG2      PRO 837  51.277 -16.814 -13.731
    5    HG3  PRO 837           HG3      PRO 837  50.501 -15.299 -13.236
    6    HD2  PRO 837           HD2      PRO 837  50.805 -17.423 -11.571
    7    HD3  PRO 837           HD3      PRO 837  49.459 -16.279 -11.441

  No H/Q in entry =           7
  In of MODEL   12
    1    H    CYS 838           H        CYS 838  47.868 -19.118 -16.095
    2    HA   CYS 838           HA       CYS 838  50.235 -20.704 -16.164
    3    HB2  CYS 838           HB2      CYS 838  48.903 -22.046 -17.999
    4    HB3  CYS 838           HB3      CYS 838  48.569 -22.356 -16.323

  No H/Q in entry =           4
  In of MODEL   12
    1    H    ALA 839           H        ALA 839  50.720 -21.268 -18.762
    2    HA   ALA 839           HA       ALA 839  51.624 -18.761 -19.747
    3    HB1  ALA 839           HB1      ALA 839  52.875 -20.850 -20.069
    4    HB3  ALA 839           HB2      ALA 839  52.542 -20.051 -21.608
    5    HB2  ALA 839           HB3      ALA 839  51.589 -21.453 -21.115

  No H/Q in entry =           5
  In of MODEL   12
    1    H    ALA 840           H        ALA 840  48.790 -20.346 -19.939
    2    HA   ALA 840           HA       ALA 840  47.704 -19.550 -22.438
    3    HB1  ALA 840           HB1      ALA 840  45.578 -20.220 -21.289
    4    HB3  ALA 840           HB2      ALA 840  46.569 -20.524 -19.833
    5    HB2  ALA 840           HB3      ALA 840  46.861 -21.425 -21.302

  No H/Q in entry =           5
  In of MODEL   12
    1    H    GLU 841           H        GLU 841  48.908 -17.354 -20.776
    2    HA   GLU 841           HA       GLU 841  46.608 -15.687 -20.026
    3    HB2  GLU 841           HB2      GLU 841  48.248 -14.123 -19.125
    4    HB3  GLU 841           HB3      GLU 841  48.583 -15.733 -18.514
    5    HG2  GLU 841           HG2      GLU 841  50.368 -15.958 -20.214
    6    HG3  GLU 841           HG3      GLU 841  50.058 -14.298 -20.710

  No H/Q in entry =           6
  In of MODEL   12
    1    H    THR 842           H        THR 842  48.447 -16.364 -22.671
    2    HA   THR 842           HA       THR 842  48.063 -13.797 -23.916
    3    HB   THR 842           HB       THR 842  49.263 -15.054 -25.800
    4    HG1  THR 842           HG1      THR 842  49.457 -17.138 -25.402
    5   HG21  THR 842          HG21      THR 842  50.394 -13.439 -24.311
    6   HG23  THR 842          HG22      THR 842  51.452 -14.788 -24.721
    7   HG22  THR 842          HG23      THR 842  50.672 -14.729 -23.139

  No H/Q in entry =           7
  In of MODEL   12
    1    H    GLN 843           H        GLN 843  47.337 -14.092 -26.299
    2    HA   GLN 843           HA       GLN 843  44.798 -15.442 -26.258
    3    HB2  GLN 843           HB2      GLN 843  44.371 -14.336 -28.442
    4    HB3  GLN 843           HB3      GLN 843  44.766 -13.186 -27.187
    5    HG2  GLN 843           HG2      GLN 843  46.719 -14.151 -29.281
    6    HG3  GLN 843           HG3      GLN 843  45.747 -12.695 -29.436
    7   HE21  GLN 843          HE21      GLN 843  46.055 -12.001 -26.578
    8   HE22  GLN 843          HE22      GLN 843  47.672 -11.430 -26.413

  No H/Q in entry =           8
  In of MODEL   13
    1    H1   GLY 689           H3       GLY 689  64.772 -18.558 -28.737
    2    H2   GLY 689           H2       GLY 689  65.887 -17.458 -29.410
    3    H3   GLY 689           H1       GLY 689  66.164 -18.167 -27.905
    4    HA2  GLY 689           HA2      GLY 689  63.973 -16.316 -28.496
    5    HA3  GLY 689           HA3      GLY 689  65.430 -15.950 -27.560

  No H/Q in entry =           5
  In of MODEL   13
    1    H    SER 690           H        SER 690  63.951 -15.438 -25.809
    2    HA   SER 690           HA       SER 690  63.088 -17.868 -24.451
    3    HB2  SER 690           HB2      SER 690  64.801 -16.519 -23.270
    4    HB3  SER 690           HB3      SER 690  63.718 -15.131 -23.307
    5    HG   SER 690           HG       SER 690  63.859 -16.663 -21.392

  No H/Q in entry =           5
  In of MODEL   13
    1    H    HIS 691           H        HIS 691  61.046 -17.989 -23.667
    2    HA   HIS 691           HA       HIS 691  59.312 -15.710 -24.158
    3    HB2  HIS 691           HB2      HIS 691  58.741 -18.594 -24.770
    4    HB3  HIS 691           HB3      HIS 691  57.414 -17.501 -24.378
    5    HD1  HIS 691           HD1      HIS 691  59.318 -18.667 -27.222
    6    HD2  HIS 691           HD2      HIS 691  57.451 -15.111 -26.156
    7    HE1  HIS 691           HE1      HIS 691  59.036 -17.375 -29.349
    8    HE2  HIS 691           HE2      HIS 691  57.767 -15.320 -28.705

  No H/Q in entry =           8
  In of MODEL   13
    1    H    MET 692           H        MET 692  60.884 -17.135 -21.966
    2    HA   MET 692           HA       MET 692  58.981 -17.415 -19.820
    3    HB2  MET 692           HB2      MET 692  61.335 -18.376 -19.889
    4    HB3  MET 692           HB3      MET 692  61.944 -16.737 -19.738
    5    HG2  MET 692           HG2      MET 692  60.774 -16.565 -17.562
    6    HG3  MET 692           HG3      MET 692  60.323 -18.261 -17.719
    7    HE1  MET 692           HE1      MET 692  62.183 -20.232 -18.011
    8    HE3  MET 692           HE2      MET 692  63.910 -19.970 -17.769
    9    HE2  MET 692           HE3      MET 692  63.118 -19.324 -19.203

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ASN 693           H        ASN 693  61.200 -15.080 -21.146
    2    HA   ASN 693           HA       ASN 693  59.356 -12.982 -20.864
    3    HB2  ASN 693           HB2      ASN 693  60.787 -11.393 -19.705
    4    HB3  ASN 693           HB3      ASN 693  60.771 -12.828 -18.699
    5   HD21  ASN 693          HD21      ASN 693  62.725 -13.987 -18.426
    6   HD22  ASN 693          HD22      ASN 693  64.227 -13.326 -18.930

  No H/Q in entry =           6
  In of MODEL   13
    1    HA   PRO 694           HA       PRO 694  61.170 -13.051 -24.922
    2    HB2  PRO 694           HB2      PRO 694  59.990 -10.341 -25.179
    3    HB3  PRO 694           HB3      PRO 694  59.776 -11.763 -26.205
    4    HG2  PRO 694           HG2      PRO 694  57.848 -10.984 -24.546
    5    HG3  PRO 694           HG3      PRO 694  58.194 -12.707 -24.793
    6    HD2  PRO 694           HD2      PRO 694  58.936 -10.921 -22.508
    7    HD3  PRO 694           HD3      PRO 694  58.367 -12.607 -22.505

  No H/Q in entry =           7
  In of MODEL   13
    1    H    LEU 695           H        LEU 695  61.192  -9.671 -23.742
    2    HA   LEU 695           HA       LEU 695  64.023  -9.794 -23.631
    3    HB2  LEU 695           HB2      LEU 695  64.481  -7.840 -25.080
    4    HB3  LEU 695           HB3      LEU 695  63.831  -9.177 -25.971
    5    HG   LEU 695           HG       LEU 695  62.988  -7.237 -26.947
    6   HD12  LEU 695          HD11      LEU 695  60.761  -8.305 -25.290
    7   HD11  LEU 695          HD12      LEU 695  61.309  -8.880 -26.867
    8   HD13  LEU 695          HD13      LEU 695  60.583  -7.279 -26.712
    9   HD22  LEU 695          HD21      LEU 695  63.444  -5.585 -25.274
   10   HD21  LEU 695          HD22      LEU 695  62.184  -6.235 -24.233
   11   HD23  LEU 695          HD23      LEU 695  61.752  -5.454 -25.754

  No H/Q in entry =          11
  In of MODEL   13
    1    H    THR 696           H        THR 696  64.921  -8.512 -22.155
    2    HA   THR 696           HA       THR 696  63.232  -6.519 -20.915
    3    HB   THR 696           HB       THR 696  64.101  -7.455 -18.659
    4    HG1  THR 696           HG1      THR 696  63.906  -9.984 -19.870
    5   HG23  THR 696          HG21      THR 696  61.754  -7.360 -19.221
    6   HG22  THR 696          HG22      THR 696  62.105  -8.899 -18.418
    7   HG21  THR 696          HG23      THR 696  61.888  -8.837 -20.174

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLN 697           H        GLN 697  64.522  -4.875 -21.499
    2    HA   GLN 697           HA       GLN 697  67.368  -4.972 -20.988
    3    HB2  GLN 697           HB2      GLN 697  66.436  -3.847 -22.970
    4    HB3  GLN 697           HB3      GLN 697  65.709  -2.657 -21.897
    5    HG2  GLN 697           HG2      GLN 697  67.799  -1.935 -21.122
    6    HG3  GLN 697           HG3      GLN 697  68.628  -3.289 -21.887
    7   HE21  GLN 697          HE21      GLN 697  69.931  -2.147 -23.073
    8   HE22  GLN 697          HE22      GLN 697  69.390  -1.188 -24.388

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ALA 698           H        ALA 698  65.128  -2.458 -20.222
    2    HA   ALA 698           HA       ALA 698  66.242  -2.417 -17.495
    3    HB1  ALA 698           HB1      ALA 698  65.971   0.010 -17.472
    4    HB3  ALA 698           HB2      ALA 698  65.286  -0.042 -19.097
    5    HB2  ALA 698           HB3      ALA 698  66.976  -0.484 -18.835

  No H/Q in entry =           5
  In of MODEL   13
    1    H    VAL 699           H        VAL 699  63.820  -3.542 -18.868
    2    HA   VAL 699           HA       VAL 699  61.729  -2.276 -17.304
    3    HB   VAL 699           HB       VAL 699  61.600  -4.553 -19.262
    4   HG13  VAL 699          HG11      VAL 699  59.154  -4.061 -19.320
    5   HG12  VAL 699          HG12      VAL 699  59.406  -2.790 -18.123
    6   HG11  VAL 699          HG13      VAL 699  59.687  -4.472 -17.688
    7   HG22  VAL 699          HG21      VAL 699  60.687  -2.921 -20.878
    8   HG21  VAL 699          HG22      VAL 699  62.343  -2.556 -20.396
    9   HG23  VAL 699          HG23      VAL 699  61.005  -1.631 -19.718

  No H/Q in entry =           9
  In of MODEL   13
    1    HA   PRO 700           HA       PRO 700  62.828  -5.272 -14.187
    2    HB2  PRO 700           HB2      PRO 700  60.805  -4.691 -12.448
    3    HB3  PRO 700           HB3      PRO 700  62.298  -3.761 -12.570
    4    HG2  PRO 700           HG2      PRO 700  59.603  -3.185 -13.725
    5    HG3  PRO 700           HG3      PRO 700  60.783  -2.066 -13.025
    6    HD2  PRO 700           HD2      PRO 700  60.420  -2.336 -15.682
    7    HD3  PRO 700           HD3      PRO 700  61.994  -1.928 -14.974

  No H/Q in entry =           7
  In of MODEL   13
    1    H    LYS 701           H        LYS 701  59.392  -4.983 -14.441
    2    HA   LYS 701           HA       LYS 701  57.689  -6.449 -14.533
    3    HB2  LYS 701           HB2      LYS 701  59.677  -8.381 -15.732
    4    HB3  LYS 701           HB3      LYS 701  57.930  -8.556 -15.778
    5    HG2  LYS 701           HG2      LYS 701  59.559  -6.403 -17.042
    6    HG3  LYS 701           HG3      LYS 701  58.785  -7.750 -17.902
    7    HD2  LYS 701           HD2      LYS 701  57.421  -5.572 -16.339
    8    HD3  LYS 701           HD3      LYS 701  57.545  -5.619 -18.092
    9    HE2  LYS 701           HE2      LYS 701  56.250  -7.712 -18.156
   10    HE3  LYS 701           HE3      LYS 701  56.130  -7.704 -16.398
   11    HZ1  LYS 701           HZ1      LYS 701  54.966  -5.647 -18.209
   12    HZ3  LYS 701           HZ2      LYS 701  54.820  -5.682 -16.534
   13    HZ2  LYS 701           HZ3      LYS 701  54.123  -6.886 -17.454

  No H/Q in entry =          13
  In of MODEL   13
    1    H    CYS 702           H        CYS 702  57.329  -6.571 -12.540
    2    HA   CYS 702           HA       CYS 702  58.538  -8.736 -10.962
    3    HB2  CYS 702           HB2      CYS 702  56.687  -6.588  -9.906
    4    HB3  CYS 702           HB3      CYS 702  57.865  -7.532  -9.016

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLN 703           H        GLN 703  56.923 -10.062  -9.728
    2    HA   GLN 703           HA       GLN 703  54.799 -10.849 -11.510
    3    HB2  GLN 703           HB2      GLN 703  55.495 -11.828  -8.747
    4    HB3  GLN 703           HB3      GLN 703  54.367 -12.595  -9.848
    5    HG2  GLN 703           HG2      GLN 703  57.320 -12.245 -10.321
    6    HG3  GLN 703           HG3      GLN 703  56.529 -13.733  -9.814
    7   HE21  GLN 703          HE21      GLN 703  55.337 -14.902 -11.334
    8   HE22  GLN 703          HE22      GLN 703  55.445 -14.577 -13.026

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ARG 704           H        ARG 704  52.641 -11.444 -10.454
    2    HA   ARG 704           HA       ARG 704  51.175  -9.101  -9.991
    3    HB2  ARG 704           HB2      ARG 704  50.492 -11.971  -9.435
    4    HB3  ARG 704           HB3      ARG 704  49.343 -10.664  -9.223
    5    HG2  ARG 704           HG2      ARG 704  50.757 -11.116 -11.816
    6    HG3  ARG 704           HG3      ARG 704  49.281 -11.981 -11.379
    7    HD2  ARG 704           HD2      ARG 704  48.042  -9.970 -11.293
    8    HD3  ARG 704           HD3      ARG 704  49.510  -8.997 -11.343
    9    HE   ARG 704           HE       ARG 704  49.847  -9.882 -13.609
   10   HH11  ARG 704          HH11      ARG 704  46.510  -9.606 -12.380
   11   HH12  ARG 704          HH12      ARG 704  45.808  -9.619 -13.926
   12   HH21  ARG 704          HH21      ARG 704  48.838  -9.833 -15.713
   13   HH22  ARG 704          HH22      ARG 704  47.149  -9.745 -15.864

  No H/Q in entry =          13
  In of MODEL   13
    1    H    TRP 705           H        TRP 705  52.753 -11.184  -7.721
    2    HA   TRP 705           HA       TRP 705  51.388  -9.975  -5.461
    3    HB2  TRP 705           HB2      TRP 705  52.600 -11.776  -4.174
    4    HB3  TRP 705           HB3      TRP 705  51.425 -12.338  -5.352
    5    HD1  TRP 705           HD1      TRP 705  55.147 -12.390  -4.583
    6    HE1  TRP 705           HE1      TRP 705  56.305 -14.051  -6.165
    7    HE3  TRP 705           HE3      TRP 705  51.259 -13.371  -7.758
    8    HZ2  TRP 705           HZ2      TRP 705  55.662 -15.593  -8.429
    9    HZ3  TRP 705           HZ3      TRP 705  51.620 -14.945  -9.607
   10    HH2  TRP 705           HH2      TRP 705  53.774 -16.037  -9.932

  No H/Q in entry =          10
  In of MODEL   13
    1    H    GLU 706           H        GLU 706  53.740  -8.967  -7.285
    2    HA   GLU 706           HA       GLU 706  55.443  -8.190  -5.055
    3    HB2  GLU 706           HB2      GLU 706  56.172  -8.774  -7.910
    4    HB3  GLU 706           HB3      GLU 706  57.279  -8.035  -6.740
    5    HG2  GLU 706           HG2      GLU 706  57.068 -10.075  -5.387
    6    HG3  GLU 706           HG3      GLU 706  56.032 -10.765  -6.637

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LYS 707           H        LYS 707  56.293  -6.139  -5.109
    2    HA   LYS 707           HA       LYS 707  55.027  -4.234  -6.944
    3    HB2  LYS 707           HB2      LYS 707  54.845  -2.568  -5.156
    4    HB3  LYS 707           HB3      LYS 707  53.967  -4.013  -4.681
    5    HG2  LYS 707           HG2      LYS 707  55.624  -4.628  -3.117
    6    HG3  LYS 707           HG3      LYS 707  56.789  -3.511  -3.800
    7    HD2  LYS 707           HD2      LYS 707  56.100  -2.544  -1.749
    8    HD3  LYS 707           HD3      LYS 707  55.275  -1.634  -3.001
    9    HE2  LYS 707           HE2      LYS 707  54.022  -3.855  -1.364
   10    HE3  LYS 707           HE3      LYS 707  53.908  -2.156  -0.989
   11    HZ1  LYS 707           HZ1      LYS 707  52.832  -3.340  -3.520
   12    HZ3  LYS 707           HZ2      LYS 707  52.667  -1.761  -2.975
   13    HZ2  LYS 707           HZ3      LYS 707  51.959  -3.007  -2.123

  No H/Q in entry =          13
  In of MODEL   13
    1    H    LEU 708           H        LEU 708  56.409  -2.408  -7.402
    2    HA   LEU 708           HA       LEU 708  59.157  -3.015  -6.795
    3    HB2  LEU 708           HB2      LEU 708  58.556  -2.906  -9.174
    4    HB3  LEU 708           HB3      LEU 708  57.979  -1.268  -8.956
    5    HG   LEU 708           HG       LEU 708  60.797  -1.874  -8.260
    6   HD11  LEU 708          HD11      LEU 708  59.752  -1.452 -11.065
    7   HD13  LEU 708          HD12      LEU 708  60.507  -2.925 -10.447
    8   HD12  LEU 708          HD13      LEU 708  61.452  -1.449 -10.606
    9   HD23  LEU 708          HD21      LEU 708  61.151   0.400  -9.125
   10   HD22  LEU 708          HD22      LEU 708  59.936   0.354  -7.849
   11   HD21  LEU 708          HD23      LEU 708  59.439   0.498  -9.539

  No H/Q in entry =          11
  In of MODEL   13
    1    H    GLN 709           H        GLN 709  60.170  -1.886  -5.411
    2    HA   GLN 709           HA       GLN 709  59.764   0.952  -5.111
    3    HB2  GLN 709           HB2      GLN 709  59.479   0.900  -2.716
    4    HB3  GLN 709           HB3      GLN 709  58.264  -0.189  -3.367
    5    HG2  GLN 709           HG2      GLN 709  59.714  -2.095  -2.830
    6    HG3  GLN 709           HG3      GLN 709  60.890  -0.979  -2.136
    7   HE21  GLN 709          HE21      GLN 709  60.747  -1.850  -0.111
    8   HE22  GLN 709          HE22      GLN 709  59.356  -1.694   0.891

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ASN 710           H        ASN 710  61.693   1.871  -4.255
    2    HA   ASN 710           HA       ASN 710  63.962   2.030  -3.898
    3    HB2  ASN 710           HB2      ASN 710  63.251   0.267  -2.119
    4    HB3  ASN 710           HB3      ASN 710  63.958  -0.919  -3.192
    5   HD21  ASN 710          HD21      ASN 710  64.531   1.577  -0.987
    6   HD22  ASN 710          HD22      ASN 710  66.236   1.438  -0.826

  No H/Q in entry =           6
  In of MODEL   13
    1    H    SER 711           H        SER 711  62.670   0.977  -6.374
    2    HA   SER 711           HA       SER 711  63.145   0.386  -8.450
    3    HB2  SER 711           HB2      SER 711  65.992   0.805  -7.555
    4    HB3  SER 711           HB3      SER 711  65.482   0.657  -9.246
    5    HG   SER 711           HG       SER 711  65.710   2.827  -8.272

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ARG 712           H        ARG 712  63.072  -1.673  -6.258
    2    HA   ARG 712           HA       ARG 712  64.149  -3.878  -7.867
    3    HB2  ARG 712           HB2      ARG 712  64.619  -5.134  -5.791
    4    HB3  ARG 712           HB3      ARG 712  65.555  -3.643  -5.843
    5    HG2  ARG 712           HG2      ARG 712  64.080  -2.605  -4.262
    6    HG3  ARG 712           HG3      ARG 712  62.971  -3.960  -4.353
    7    HD2  ARG 712           HD2      ARG 712  64.221  -4.139  -2.319
    8    HD3  ARG 712           HD3      ARG 712  64.727  -5.424  -3.404
    9    HE   ARG 712           HE       ARG 712  66.446  -3.192  -3.648
   10   HH11  ARG 712          HH11      ARG 712  65.665  -5.897  -1.507
   11   HH12  ARG 712          HH12      ARG 712  67.165  -5.902  -0.695
   12   HH21  ARG 712          HH21      ARG 712  68.564  -3.187  -2.470
   13   HH22  ARG 712          HH22      ARG 712  68.795  -4.342  -1.234

  No H/Q in entry =          13
  In of MODEL   13
    1    H    CYS 713           H        CYS 713  62.910  -5.964  -7.365
    2    HA   CYS 713           HA       CYS 713  60.078  -5.311  -6.992
    3    HB2  CYS 713           HB2      CYS 713  61.358  -7.884  -7.966
    4    HB3  CYS 713           HB3      CYS 713  59.634  -7.565  -7.914

  No H/Q in entry =           4
  In of MODEL   13
    1    H    VAL 714           H        VAL 714  59.307  -5.572  -5.059
    2    HA   VAL 714           HA       VAL 714  60.330  -7.688  -3.297
    3    HB   VAL 714           HB       VAL 714  59.714  -6.292  -1.358
    4   HG12  VAL 714          HG11      VAL 714  61.408  -4.725  -3.270
    5   HG11  VAL 714          HG12      VAL 714  61.962  -6.032  -2.229
    6   HG13  VAL 714          HG13      VAL 714  61.375  -4.527  -1.517
    7   HG21  VAL 714          HG21      VAL 714  58.948  -4.176  -3.364
    8   HG23  VAL 714          HG22      VAL 714  59.009  -3.956  -1.616
    9   HG22  VAL 714          HG23      VAL 714  57.844  -5.075  -2.326

  No H/Q in entry =           9
  In of MODEL   13
    1    H    CYS 715           H        CYS 715  58.367  -8.035  -1.586
    2    HA   CYS 715           HA       CYS 715  56.195  -8.807  -3.343
    3    HB2  CYS 715           HB2      CYS 715  56.732  -9.309  -0.422
    4    HB3  CYS 715           HB3      CYS 715  55.297  -9.876  -1.267

  No H/Q in entry =           4
  In of MODEL   13
    1    H    LYS 716           H        LYS 716  53.970  -8.323  -2.828
    2    HA   LYS 716           HA       LYS 716  53.631  -5.612  -1.955
    3    HB2  LYS 716           HB2      LYS 716  51.473  -7.643  -2.643
    4    HB3  LYS 716           HB3      LYS 716  51.227  -5.920  -2.423
    5    HG2  LYS 716           HG2      LYS 716  52.790  -5.580  -4.376
    6    HG3  LYS 716           HG3      LYS 716  52.679  -7.313  -4.649
    7    HD2  LYS 716           HD2      LYS 716  50.406  -5.311  -4.725
    8    HD3  LYS 716           HD3      LYS 716  51.127  -6.132  -6.103
    9    HE2  LYS 716           HE2      LYS 716  50.333  -8.295  -5.103
   10    HE3  LYS 716           HE3      LYS 716  49.469  -7.349  -3.890
   11    HZ3  LYS 716           HZ1      LYS 716  47.931  -7.869  -5.659
   12    HZ2  LYS 716           HZ2      LYS 716  49.028  -7.376  -6.820
   13    HZ1  LYS 716           HZ3      LYS 716  48.315  -6.231  -5.837

  No H/Q in entry =          13
  In of MODEL   13
    1    H    MET 717           H        MET 717  51.410  -5.527  -0.479
    2    HA   MET 717           HA       MET 717  52.075  -7.206   1.813
    3    HB2  MET 717           HB2      MET 717  50.530  -4.607   1.736
    4    HB3  MET 717           HB3      MET 717  51.013  -5.484   3.174
    5    HG2  MET 717           HG2      MET 717  52.826  -4.080   1.218
    6    HG3  MET 717           HG3      MET 717  52.443  -3.570   2.859
    7    HE2  MET 717           HE1      MET 717  52.609  -6.380   4.439
    8    HE1  MET 717           HE2      MET 717  53.300  -4.877   5.038
    9    HE3  MET 717           HE3      MET 717  54.287  -6.339   4.984

  No H/Q in entry =           9
  In of MODEL   13
    1    HA   PRO 718           HA       PRO 718  48.414  -9.454   0.921
    2    HB2  PRO 718           HB2      PRO 718  47.661 -10.303   3.413
    3    HB3  PRO 718           HB3      PRO 718  49.004 -11.000   2.502
    4    HG2  PRO 718           HG2      PRO 718  49.058  -8.962   4.689
    5    HG3  PRO 718           HG3      PRO 718  50.133 -10.348   4.428
    6    HD2  PRO 718           HD2      PRO 718  50.841  -7.827   3.779
    7    HD3  PRO 718           HD3      PRO 718  51.379  -9.228   2.832

  No H/Q in entry =           7
  In of MODEL   13
    1    H    TYR 719           H        TYR 719  48.275  -6.716   2.854
    2    HA   TYR 719           HA       TYR 719  45.384  -6.806   3.124
    3    HB2  TYR 719           HB2      TYR 719  45.662  -4.660   4.411
    4    HB3  TYR 719           HB3      TYR 719  46.425  -6.066   5.127
    5    HD1  TYR 719           HD1      TYR 719  48.811  -6.138   5.445
    6    HD2  TYR 719           HD2      TYR 719  47.032  -2.902   3.340
    7    HE1  TYR 719           HE1      TYR 719  50.888  -4.852   5.668
    8    HE2  TYR 719           HE2      TYR 719  49.116  -1.616   3.540
    9    HH   TYR 719           HH       TYR 719  51.068  -1.547   5.002

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLU 720           H        GLU 720  47.573  -5.865   0.885
    2    HA   GLU 720           HA       GLU 720  46.061  -3.635  -0.202
    3    HB2  GLU 720           HB2      GLU 720  48.417  -5.235  -1.095
    4    HB3  GLU 720           HB3      GLU 720  47.748  -3.928  -2.082
    5    HG2  GLU 720           HG2      GLU 720  48.308  -2.394  -0.201
    6    HG3  GLU 720           HG3      GLU 720  49.064  -3.755   0.625

  No H/Q in entry =           6
  In of MODEL   13
    1    H    CYS 721           H        CYS 721  46.004  -6.932  -0.095
    2    HA   CYS 721           HA       CYS 721  45.278  -7.513  -2.781
    3    HB2  CYS 721           HB2      CYS 721  45.338  -9.180  -0.306
    4    HB3  CYS 721           HB3      CYS 721  44.908  -9.808  -1.887

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLY 722           H        GLY 722  43.533  -5.885  -2.588
    2    HA3  GLY 722           HA2      GLY 722  41.052  -6.867  -1.505
    3    HA2  GLY 722           HA3      GLY 722  41.255  -5.459  -2.549

  No H/Q in entry =           3
  In of MODEL   13
    1    HA   PRO 723           HA       PRO 723  40.155  -7.722  -6.197
    2    HB2  PRO 723           HB2      PRO 723  42.760  -7.114  -7.455
    3    HB3  PRO 723           HB3      PRO 723  41.136  -6.710  -8.011
    4    HG2  PRO 723           HG2      PRO 723  42.742  -4.844  -7.011
    5    HG3  PRO 723           HG3      PRO 723  41.004  -4.829  -6.658
    6    HD2  PRO 723           HD2      PRO 723  43.285  -5.729  -4.956
    7    HD3  PRO 723           HD3      PRO 723  41.837  -4.800  -4.511

  No H/Q in entry =           7
  In of MODEL   13
    1    H    SER 724           H        SER 724  40.246  -9.842  -5.335
    2    HA   SER 724           HA       SER 724  41.967 -11.634  -6.629
    3    HB2  SER 724           HB2      SER 724  43.008 -12.546  -4.460
    4    HB3  SER 724           HB3      SER 724  43.709 -11.101  -5.178
    5    HG   SER 724           HG       SER 724  41.897 -10.193  -3.624

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU 725           H        LEU 725  41.249 -13.684  -6.633
    2    HA   LEU 725           HA       LEU 725  38.635 -14.262  -5.678
    3    HB2  LEU 725           HB2      LEU 725  40.794 -15.808  -7.042
    4    HB3  LEU 725           HB3      LEU 725  39.382 -16.610  -6.413
    5    HG   LEU 725           HG       LEU 725  39.163 -14.369  -8.419
    6   HD12  LEU 725          HD11      LEU 725  38.953 -16.125 -10.081
    7   HD11  LEU 725          HD12      LEU 725  39.367 -17.342  -8.868
    8   HD13  LEU 725          HD13      LEU 725  40.558 -16.126  -9.357
    9   HD23  LEU 725          HD21      LEU 725  37.355 -16.670  -7.720
   10   HD22  LEU 725          HD22      LEU 725  37.018 -15.352  -8.849
   11   HD21  LEU 725          HD23      LEU 725  37.156 -15.027  -7.124

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ASP 726           H        ASP 726  38.003 -15.261  -3.927
    2    HA   ASP 726           HA       ASP 726  39.917 -15.898  -1.899
    3    HB2  ASP 726           HB2      ASP 726  36.905 -16.136  -1.912
    4    HB3  ASP 726           HB3      ASP 726  37.917 -16.539  -0.533

  No H/Q in entry =           4
  In of MODEL   13
    1    H    VAL 727           H        VAL 727  40.456 -17.815  -1.128
    2    HA   VAL 727           HA       VAL 727  39.415 -20.265  -2.326
    3    HB   VAL 727           HB       VAL 727  41.743 -21.113  -2.769
    4   HG11  VAL 727          HG11      VAL 727  40.379 -20.347  -4.640
    5   HG13  VAL 727          HG12      VAL 727  42.076 -19.961  -4.906
    6   HG12  VAL 727          HG13      VAL 727  40.954 -18.698  -4.400
    7   HG21  VAL 727          HG21      VAL 727  42.978 -19.552  -1.360
    8   HG23  VAL 727          HG22      VAL 727  42.533 -18.216  -2.422
    9   HG22  VAL 727          HG23      VAL 727  43.584 -19.501  -3.014

  No H/Q in entry =           9
  In of MODEL   13
    1    H    CYS 728           H        CYS 728  40.216 -22.210  -1.117
    2    HA   CYS 728           HA       CYS 728  40.763 -21.503   1.664
    3    HB2  CYS 728           HB2      CYS 728  40.033 -24.201   0.492
    4    HB3  CYS 728           HB3      CYS 728  40.072 -23.766   2.194

  No H/Q in entry =           4
  In of MODEL   13
    1    H    ALA 729           H        ALA 729  42.780 -22.008   2.568
    2    HA   ALA 729           HA       ALA 729  44.445 -23.746   0.901
    3    HB1  ALA 729           HB1      ALA 729  45.349 -21.312   2.430
    4    HB3  ALA 729           HB2      ALA 729  45.189 -21.411   0.675
    5    HB2  ALA 729           HB3      ALA 729  46.389 -22.398   1.513

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLN 730           H        GLN 730  46.211 -24.705   2.215
    2    HA   GLN 730           HA       GLN 730  45.185 -25.189   4.894
    3    HB2  GLN 730           HB2      GLN 730  45.255 -27.195   3.404
    4    HB3  GLN 730           HB3      GLN 730  46.996 -26.993   3.315
    5    HG2  GLN 730           HG2      GLN 730  47.291 -27.389   5.592
    6    HG3  GLN 730           HG3      GLN 730  45.572 -27.306   5.930
    7   HE21  GLN 730          HE21      GLN 730  47.346 -29.365   6.592
    8   HE22  GLN 730          HE22      GLN 730  46.851 -30.809   5.809

  No H/Q in entry =           8
  In of MODEL   13
    1    H    ASP 731           H        ASP 731  46.241 -24.538   6.439
    2    HA   ASP 731           HA       ASP 731  48.636 -23.025   6.324
    3    HB2  ASP 731           HB2      ASP 731  46.813 -22.725   8.001
    4    HB3  ASP 731           HB3      ASP 731  47.216 -24.295   8.662

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLU 732           H        GLU 732  50.704 -23.831   6.314
    2    HA   GLU 732           HA       GLU 732  51.053 -26.658   6.822
    3    HB2  GLU 732           HB2      GLU 732  52.761 -24.596   5.510
    4    HB3  GLU 732           HB3      GLU 732  53.437 -26.138   6.017
    5    HG2  GLU 732           HG2      GLU 732  51.106 -25.784   4.159
    6    HG3  GLU 732           HG3      GLU 732  52.763 -26.159   3.671

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ARG 733           H        ARG 733  50.986 -24.228   8.925
    2    HA   ARG 733           HA       ARG 733  53.328 -25.106  10.366
    3    HB2  ARG 733           HB2      ARG 733  51.393 -22.836  10.741
    4    HB3  ARG 733           HB3      ARG 733  52.690 -23.227  11.847
    5    HG2  ARG 733           HG2      ARG 733  52.960 -22.315   8.988
    6    HG3  ARG 733           HG3      ARG 733  53.328 -21.370  10.431
    7    HD2  ARG 733           HD2      ARG 733  54.763 -23.839   9.446
    8    HD3  ARG 733           HD3      ARG 733  55.382 -22.192   9.511
    9    HE   ARG 733           HE       ARG 733  54.742 -22.722  12.075
   10   HH11  ARG 733          HH11      ARG 733  56.827 -24.286   9.703
   11   HH12  ARG 733          HH12      ARG 733  57.861 -25.007  10.838
   12   HH21  ARG 733          HH21      ARG 733  56.127 -23.719  13.660
   13   HH22  ARG 733          HH22      ARG 733  57.458 -24.676  13.152

  No H/Q in entry =          13
  In of MODEL   13
    1    H    SER 734           H        SER 734  49.881 -24.487  10.780
    2    HA   SER 734           HA       SER 734  49.822 -26.160  13.174
    3    HB2  SER 734           HB2      SER 734  47.648 -24.500  11.916
    4    HB3  SER 734           HB3      SER 734  47.644 -25.196  13.539
    5    HG   SER 734           HG       SER 734  49.871 -23.796  13.319

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LYS 735           H        LYS 735  49.088 -26.351   9.828
    2    HA   LYS 735           HA       LYS 735  48.038 -27.778   8.449
    3    HB2  LYS 735           HB2      LYS 735  48.012 -29.739  10.757
    4    HB3  LYS 735           HB3      LYS 735  47.870 -30.125   9.050
    5    HG2  LYS 735           HG2      LYS 735  50.322 -28.939  10.352
    6    HG3  LYS 735           HG3      LYS 735  50.098 -30.646  10.000
    7    HD2  LYS 735           HD2      LYS 735  50.066 -28.466   7.911
    8    HD3  LYS 735           HD3      LYS 735  51.502 -29.390   8.329
    9    HE2  LYS 735           HE2      LYS 735  50.199 -31.468   7.746
   10    HE3  LYS 735           HE3      LYS 735  48.923 -30.410   7.148
   11    HZ1  LYS 735           HZ1      LYS 735  50.543 -29.489   5.529
   12    HZ3  LYS 735           HZ2      LYS 735  50.340 -31.156   5.366
   13    HZ2  LYS 735           HZ3      LYS 735  51.698 -30.566   6.108

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ARG 736           H        ARG 736  46.304 -26.386   8.370
    2    HA   ARG 736           HA       ARG 736  43.758 -27.484   9.245
    3    HB2  ARG 736           HB2      ARG 736  43.071 -25.293  10.258
    4    HB3  ARG 736           HB3      ARG 736  44.353 -26.087  11.173
    5    HG2  ARG 736           HG2      ARG 736  46.002 -24.686  10.180
    6    HG3  ARG 736           HG3      ARG 736  44.806 -23.926   9.133
    7    HD2  ARG 736           HD2      ARG 736  43.748 -22.954  11.113
    8    HD3  ARG 736           HD3      ARG 736  44.950 -23.754  12.140
    9    HE   ARG 736           HE       ARG 736  46.298 -22.292  10.174
   10   HH11  ARG 736          HH11      ARG 736  44.322 -21.554  13.025
   11   HH12  ARG 736          HH12      ARG 736  45.216 -20.141  13.380
   12   HH21  ARG 736          HH21      ARG 736  47.429 -20.413  10.646
   13   HH22  ARG 736          HH22      ARG 736  46.990 -19.456  12.004

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ILE 737           H        ILE 737  41.966 -26.406   8.008
    2    HA   ILE 737           HA       ILE 737  42.979 -25.205   5.548
    3    HB   ILE 737           HB       ILE 737  40.145 -26.025   6.211
    4   HG12  ILE 737          HG12      ILE 737  41.624 -28.011   6.326
    5   HG13  ILE 737          HG13      ILE 737  40.528 -28.104   4.958
    6   HG23  ILE 737          HG21      ILE 737  39.799 -25.919   3.793
    7   HG22  ILE 737          HG22      ILE 737  41.499 -25.553   3.560
    8   HG21  ILE 737          HG23      ILE 737  40.463 -24.393   4.386
    9   HD12  ILE 737          HD11      ILE 737  43.447 -27.373   4.874
   10   HD11  ILE 737          HD12      ILE 737  42.349 -27.381   3.491
   11   HD13  ILE 737          HD13      ILE 737  42.715 -28.888   4.334

  No H/Q in entry =          11
  In of MODEL   13
    1    H    LEU 738           H        LEU 738  42.580 -23.110   5.067
    2    HA   LEU 738           HA       LEU 738  40.703 -21.637   6.736
    3    HB2  LEU 738           HB2      LEU 738  42.226 -19.662   6.621
    4    HB3  LEU 738           HB3      LEU 738  42.550 -20.921   7.777
    5    HG   LEU 738           HG       LEU 738  44.330 -19.748   6.606
    6   HD12  LEU 738          HD11      LEU 738  45.744 -21.826   6.504
    7   HD11  LEU 738          HD12      LEU 738  44.205 -22.725   6.666
    8   HD13  LEU 738          HD13      LEU 738  44.736 -21.638   7.960
    9   HD22  LEU 738          HD21      LEU 738  45.226 -20.633   4.530
   10   HD21  LEU 738          HD22      LEU 738  43.584 -19.986   4.297
   11   HD23  LEU 738          HD23      LEU 738  43.848 -21.714   4.414

  No H/Q in entry =          11
  In of MODEL   13
    1    HA   PRO 739           HA       PRO 739  39.563 -19.554   2.963
    2    HB2  PRO 739           HB2      PRO 739  38.314 -17.435   3.996
    3    HB3  PRO 739           HB3      PRO 739  37.579 -19.044   4.072
    4    HG2  PRO 739           HG2      PRO 739  38.978 -17.501   6.222
    5    HG3  PRO 739           HG3      PRO 739  37.567 -18.570   6.339
    6    HD2  PRO 739           HD2      PRO 739  40.201 -19.375   6.987
    7    HD3  PRO 739           HD3      PRO 739  38.858 -20.444   6.540

  No H/Q in entry =           7
  In of MODEL   13
    1    H    LEU 740           H        LEU 740  41.170 -18.701   1.899
    2    HA   LEU 740           HA       LEU 740  42.380 -16.196   2.824
    3    HB2  LEU 740           HB2      LEU 740  43.663 -18.628   1.677
    4    HB3  LEU 740           HB3      LEU 740  44.323 -17.072   1.241
    5    HG   LEU 740           HG       LEU 740  44.089 -18.141   4.056
    6   HD13  LEU 740          HD11      LEU 740  45.703 -19.329   2.720
    7   HD12  LEU 740          HD12      LEU 740  46.515 -18.336   3.922
    8   HD11  LEU 740          HD13      LEU 740  46.459 -17.816   2.220
    9   HD21  LEU 740          HD21      LEU 740  45.372 -15.625   2.979
   10   HD23  LEU 740          HD22      LEU 740  45.519 -16.218   4.628
   11   HD22  LEU 740          HD23      LEU 740  43.949 -15.704   4.022

  No H/Q in entry =          11
  In of MODEL   13
    1    H    THR 741           H        THR 741  43.689 -15.538   0.570
    2    HA   THR 741           HA       THR 741  41.753 -15.713  -1.584
    3    HB   THR 741           HB       THR 741  43.023 -13.067  -0.833
    4    HG1  THR 741           HG1      THR 741  40.431 -13.902   0.079
    5   HG22  THR 741          HG21      THR 741  40.405 -13.778  -2.103
    6   HG21  THR 741          HG22      THR 741  41.877 -13.377  -2.976
    7   HG23  THR 741          HG23      THR 741  41.101 -12.163  -1.949

  No H/Q in entry =           7
  In of MODEL   13
    1    H    VAL 742           H        VAL 742  42.819 -15.568  -3.631
    2    HA   VAL 742           HA       VAL 742  45.292 -16.719  -3.840
    3    HB   VAL 742           HB       VAL 742  43.917 -16.783  -5.815
    4   HG13  VAL 742          HG11      VAL 742  43.335 -14.947  -7.099
    5   HG12  VAL 742          HG12      VAL 742  44.116 -13.829  -5.967
    6   HG11  VAL 742          HG13      VAL 742  42.692 -14.772  -5.465
    7   HG23  VAL 742          HG21      VAL 742  46.183 -14.941  -6.487
    8   HG22  VAL 742          HG22      VAL 742  45.359 -16.054  -7.580
    9   HG21  VAL 742          HG23      VAL 742  46.358 -16.673  -6.261

  No H/Q in entry =           9
  In of MODEL   13
    1    H    CYS 743           H        CYS 743  44.810 -13.207  -4.156
    2    HA   CYS 743           HA       CYS 743  47.514 -12.612  -4.551
    3    HB2  CYS 743           HB2      CYS 743  45.830 -10.958  -5.011
    4    HB3  CYS 743           HB3      CYS 743  45.319 -10.926  -3.333

  No H/Q in entry =           4
  In of MODEL   13
    1    H    LYS 744           H        LYS 744  45.612 -12.773  -1.566
    2    HA   LYS 744           HA       LYS 744  47.604 -11.969   0.225
    3    HB2  LYS 744           HB2      LYS 744  45.348 -13.930   0.693
    4    HB3  LYS 744           HB3      LYS 744  46.320 -13.194   1.952
    5    HG2  LYS 744           HG2      LYS 744  45.434 -10.971   1.257
    6    HG3  LYS 744           HG3      LYS 744  44.377 -11.788   0.103
    7    HD2  LYS 744           HD2      LYS 744  43.364 -13.057   1.955
    8    HD3  LYS 744           HD3      LYS 744  44.408 -12.218   3.094
    9    HE2  LYS 744           HE2      LYS 744  42.265 -11.181   3.197
   10    HE3  LYS 744           HE3      LYS 744  43.329 -10.068   2.349
   11    HZ2  LYS 744           HZ1      LYS 744  41.107 -10.299   1.370
   12    HZ1  LYS 744           HZ2      LYS 744  41.409 -11.913   1.006
   13    HZ3  LYS 744           HZ3      LYS 744  42.316 -10.671   0.276

  No H/Q in entry =          13
  In of MODEL   13
    1    H    MET 745           H        MET 745  46.623 -15.210  -0.775
    2    HA   MET 745           HA       MET 745  48.479 -16.782   0.580
    3    HB2  MET 745           HB2      MET 745  47.072 -18.166  -0.329
    4    HB3  MET 745           HB3      MET 745  46.587 -17.076  -1.610
    5    HG2  MET 745           HG2      MET 745  47.421 -19.004  -2.708
    6    HG3  MET 745           HG3      MET 745  48.717 -17.835  -2.810
    7    HE2  MET 745           HE1      MET 745  48.683 -21.499  -0.028
    8    HE1  MET 745           HE2      MET 745  47.393 -21.055  -1.149
    9    HE3  MET 745           HE3      MET 745  47.680 -20.089   0.296

  No H/Q in entry =           9
  In of MODEL   13
    1    H    HIS 746           H        HIS 746  48.829 -15.170  -2.560
    2    HA   HIS 746           HA       HIS 746  51.377 -16.394  -3.061
    3    HB2  HIS 746           HB2      HIS 746  49.800 -14.294  -4.401
    4    HB3  HIS 746           HB3      HIS 746  51.527 -14.376  -4.776
    5    HD1  HIS 746           HD1      HIS 746  52.291 -16.511  -6.041
    6    HD2  HIS 746           HD2      HIS 746  48.214 -16.181  -5.503
    7    HE1  HIS 746           HE1      HIS 746  51.292 -18.056  -7.731
    8    HE2  HIS 746           HE2      HIS 746  48.808 -17.546  -7.581

  No H/Q in entry =           8
  In of MODEL   13
    1    H    VAL 747           H        VAL 747  50.379 -13.179  -2.019
    2    HA   VAL 747           HA       VAL 747  52.917 -12.036  -1.800
    3    HB   VAL 747           HB       VAL 747  50.271 -11.476  -0.447
    4   HG12  VAL 747          HG11      VAL 747  52.803  -9.838  -0.152
    5   HG11  VAL 747          HG12      VAL 747  52.062 -10.805   1.121
    6   HG13  VAL 747          HG13      VAL 747  51.211  -9.416   0.476
    7   HG22  VAL 747          HG21      VAL 747  50.464 -10.962  -2.809
    8   HG21  VAL 747          HG22      VAL 747  51.921 -10.034  -2.490
    9   HG23  VAL 747          HG23      VAL 747  50.363  -9.469  -1.863

  No H/Q in entry =           9
  In of MODEL   13
    1    H    LEU 748           H        LEU 748  50.889 -13.538   0.625
    2    HA   LEU 748           HA       LEU 748  52.727 -13.498   2.697
    3    HB2  LEU 748           HB2      LEU 748  50.663 -13.857   3.534
    4    HB3  LEU 748           HB3      LEU 748  50.106 -14.624   2.084
    5    HG   LEU 748           HG       LEU 748  51.664 -16.118   4.200
    6   HD13  LEU 748          HD11      LEU 748  49.461 -16.843   5.024
    7   HD12  LEU 748          HD12      LEU 748  48.665 -15.791   3.859
    8   HD11  LEU 748          HD13      LEU 748  49.618 -15.093   5.169
    9   HD22  LEU 748          HD21      LEU 748  50.616 -18.052   3.170
   10   HD21  LEU 748          HD22      LEU 748  51.471 -17.153   1.928
   11   HD23  LEU 748          HD23      LEU 748  49.716 -17.031   2.061

  No H/Q in entry =          11
  In of MODEL   13
    1    H    HIS 749           H        HIS 749  52.329 -15.716   0.050
    2    HA   HIS 749           HA       HIS 749  53.976 -17.794   1.038
    3    HB2  HIS 749           HB2      HIS 749  52.352 -17.954  -0.909
    4    HB3  HIS 749           HB3      HIS 749  53.549 -17.097  -1.868
    5    HD1  HIS 749           HD1      HIS 749  55.454 -18.491  -2.849
    6    HD2  HIS 749           HD2      HIS 749  53.121 -20.511  -0.076
    7    HE1  HIS 749           HE1      HIS 749  56.199 -20.881  -2.954
    8    HE2  HIS 749           HE2      HIS 749  54.898 -22.048  -1.146

  No H/Q in entry =           8
  In of MODEL   13
    1    H    CYS 750           H        CYS 750  54.607 -14.934  -1.012
    2    HA   CYS 750           HA       CYS 750  57.330 -15.755  -1.284
    3    HB2  CYS 750           HB2      CYS 750  57.671 -13.769  -2.653
    4    HB3  CYS 750           HB3      CYS 750  56.190 -14.575  -3.149

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLN 751           H        GLN 751  55.527 -13.781   0.930
    2    HA   GLN 751           HA       GLN 751  57.723 -12.458   2.079
    3    HB2  GLN 751           HB2      GLN 751  55.157 -13.420   3.357
    4    HB3  GLN 751           HB3      GLN 751  56.301 -12.329   4.119
    5    HG2  GLN 751           HG2      GLN 751  55.909 -10.703   2.310
    6    HG3  GLN 751           HG3      GLN 751  54.734 -11.805   1.616
    7   HE21  GLN 751          HE21      GLN 751  54.349  -9.136   2.619
    8   HE22  GLN 751          HE22      GLN 751  53.173  -9.243   3.895

  No H/Q in entry =           8
  In of MODEL   13
    1    H    GLY 752           H        GLY 752  56.741 -15.736   2.095
    2    HA3  GLY 752           HA2      GLY 752  58.571 -17.278   2.619
    3    HA2  GLY 752           HA3      GLY 752  58.856 -16.309   4.054

  No H/Q in entry =           3
  In of MODEL   13
    1    H    ARG 753           H        ARG 753  55.623 -17.191   2.984
    2    HA   ARG 753           HA       ARG 753  55.433 -18.942   5.341
    3    HB2  ARG 753           HB2      ARG 753  53.210 -17.509   3.897
    4    HB3  ARG 753           HB3      ARG 753  53.060 -18.482   5.350
    5    HG2  ARG 753           HG2      ARG 753  54.583 -15.901   5.138
    6    HG3  ARG 753           HG3      ARG 753  52.953 -16.056   5.770
    7    HD2  ARG 753           HD2      ARG 753  53.862 -17.641   7.498
    8    HD3  ARG 753           HD3      ARG 753  55.482 -17.214   6.935
    9    HE   ARG 753           HE       ARG 753  54.500 -14.833   7.351
   10   HH11  ARG 753          HH11      ARG 753  54.458 -17.668   9.517
   11   HH12  ARG 753          HH12      ARG 753  54.184 -16.749  10.910
   12   HH21  ARG 753          HH21      ARG 753  54.159 -13.606   9.308
   13   HH22  ARG 753          HH22      ARG 753  54.017 -14.419  10.793

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ASN 754           H        ASN 754  54.499 -20.960   5.076
    2    HA   ASN 754           HA       ASN 754  54.207 -21.819   2.288
    3    HB2  ASN 754           HB2      ASN 754  54.794 -23.465   4.756
    4    HB3  ASN 754           HB3      ASN 754  54.614 -24.105   3.130
    5   HD21  ASN 754          HD21      ASN 754  56.808 -24.220   4.970
    6   HD22  ASN 754          HD22      ASN 754  58.169 -23.473   4.216

  No H/Q in entry =           6
  In of MODEL   13
    1    H    TYR 755           H        TYR 755  52.274 -22.271   1.615
    2    HA   TYR 755           HA       TYR 755  50.362 -23.460   3.436
    3    HB2  TYR 755           HB2      TYR 755  49.888 -21.043   1.712
    4    HB3  TYR 755           HB3      TYR 755  48.569 -22.108   2.175
    5    HD1  TYR 755           HD1      TYR 755  47.481 -21.726   4.262
    6    HD2  TYR 755           HD2      TYR 755  51.263 -19.953   3.540
    7    HE1  TYR 755           HE1      TYR 755  47.253 -20.391   6.324
    8    HE2  TYR 755           HE2      TYR 755  51.042 -18.617   5.571
    9    HH   TYR 755           HH       TYR 755  49.242 -17.748   7.030

  No H/Q in entry =           9
  In of MODEL   13
    1    H    THR 756           H        THR 756  49.091 -24.907   2.481
    2    HA   THR 756           HA       THR 756  49.930 -25.741  -0.178
    3    HB   THR 756           HB       THR 756  48.337 -27.167   1.960
    4    HG1  THR 756           HG1      THR 756  50.235 -27.543   2.803
    5   HG22  THR 756          HG21      THR 756  48.802 -29.178   0.635
    6   HG21  THR 756          HG22      THR 756  49.619 -28.167  -0.576
    7   HG23  THR 756          HG23      THR 756  47.889 -27.969  -0.276

  No H/Q in entry =           7
  In of MODEL   13
    1    H    LEU 757           H        LEU 757  48.378 -25.968  -1.836
    2    HA   LEU 757           HA       LEU 757  45.960 -24.481  -1.405
    3    HB2  LEU 757           HB2      LEU 757  47.184 -25.686  -3.868
    4    HB3  LEU 757           HB3      LEU 757  45.550 -25.063  -3.868
    5    HG   LEU 757           HG       LEU 757  46.958 -23.423  -4.809
    6   HD12  LEU 757          HD11      LEU 757  46.235 -22.619  -2.003
    7   HD11  LEU 757          HD12      LEU 757  45.194 -22.566  -3.420
    8   HD13  LEU 757          HD13      LEU 757  46.601 -21.510  -3.319
    9   HD23  LEU 757          HD21      LEU 757  48.871 -22.415  -3.619
   10   HD22  LEU 757          HD22      LEU 757  49.121 -24.133  -3.936
   11   HD21  LEU 757          HD23      LEU 757  48.666 -23.593  -2.320

  No H/Q in entry =          11
  In of MODEL   13
    1    H    THR 758           H        THR 758  43.998 -25.185  -1.288
    2    HA   THR 758           HA       THR 758  43.522 -28.019  -1.650
    3    HB   THR 758           HB       THR 758  41.843 -27.743   0.288
    4    HG1  THR 758           HG1      THR 758  42.439 -25.265   0.220
    5   HG22  THR 758          HG21      THR 758  44.796 -27.560   0.916
    6   HG21  THR 758          HG22      THR 758  43.919 -29.034   0.513
    7   HG23  THR 758          HG23      THR 758  43.553 -28.172   2.004

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLY 759           H        GLY 759  40.807 -28.017  -1.370
    2    HA3  GLY 759           HA2      GLY 759  40.065 -26.492  -3.707
    3    HA2  GLY 759           HA3      GLY 759  39.135 -27.763  -2.908

  No H/Q in entry =           3
  In of MODEL   13
    1    H    ARG 760           H        ARG 760  37.664 -25.777  -3.516
    2    HA   ARG 760           HA       ARG 760  37.628 -23.709  -1.448
    3    HB2  ARG 760           HB2      ARG 760  35.715 -22.791  -2.758
    4    HB3  ARG 760           HB3      ARG 760  37.180 -23.019  -3.708
    5    HG2  ARG 760           HG2      ARG 760  35.575 -23.840  -5.174
    6    HG3  ARG 760           HG3      ARG 760  36.107 -25.280  -4.297
    7    HD2  ARG 760           HD2      ARG 760  34.156 -25.135  -2.830
    8    HD3  ARG 760           HD3      ARG 760  33.588 -23.716  -3.717
    9    HE   ARG 760           HE       ARG 760  34.117 -26.033  -5.322
   10   HH11  ARG 760          HH11      ARG 760  31.570 -24.448  -3.412
   11   HH12  ARG 760          HH12      ARG 760  30.307 -25.112  -4.358
   12   HH21  ARG 760          HH21      ARG 760  32.360 -26.889  -6.582
   13   HH22  ARG 760          HH22      ARG 760  30.755 -26.506  -6.142

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ASP 761           H        ASP 761  36.644 -26.737  -1.701
    2    HA   ASP 761           HA       ASP 761  33.999 -26.534  -0.588
    3    HB2  ASP 761           HB2      ASP 761  33.963 -28.963  -0.702
    4    HB3  ASP 761           HB3      ASP 761  34.555 -28.295  -2.217

  No H/Q in entry =           4
  In of MODEL   13
    1    H    SER 762           H        SER 762  37.201 -26.756   0.575
    2    HA   SER 762           HA       SER 762  36.548 -28.253   2.927
    3    HB2  SER 762           HB2      SER 762  38.973 -27.658   3.526
    4    HB3  SER 762           HB3      SER 762  38.671 -28.717   2.154
    5    HG   SER 762           HG       SER 762  39.599 -27.309   0.946

  No H/Q in entry =           5
  In of MODEL   13
    1    H    CYS 763           H        CYS 763  37.111 -24.814   2.272
    2    HA   CYS 763           HA       CYS 763  36.478 -24.399   5.093
    3    HB2  CYS 763           HB2      CYS 763  37.512 -22.273   5.013
    4    HB3  CYS 763           HB3      CYS 763  38.647 -23.387   4.267

  No H/Q in entry =           4
  In of MODEL   13
    1    H    THR 764           H        THR 764  35.238 -22.297   5.420
    2    HA   THR 764           HA       THR 764  33.007 -22.306   3.578
    3    HB   THR 764           HB       THR 764  33.415 -20.694   6.122
    4    HG1  THR 764           HG1      THR 764  33.352 -23.133   6.179
    5   HG22  THR 764          HG21      THR 764  30.915 -21.381   4.558
    6   HG21  THR 764          HG22      THR 764  31.707 -19.808   4.588
    7   HG23  THR 764          HG23      THR 764  30.970 -20.451   6.059

  No H/Q in entry =           7
  In of MODEL   13
    1    H    LEU 765           H        LEU 765  33.507 -21.302   1.799
    2    HA   LEU 765           HA       LEU 765  35.282 -19.031   1.856
    3    HB2  LEU 765           HB2      LEU 765  35.287 -21.118   0.302
    4    HB3  LEU 765           HB3      LEU 765  34.050 -20.217  -0.553
    5    HG   LEU 765           HG       LEU 765  35.680 -18.352  -0.820
    6   HD12  LEU 765          HD11      LEU 765  38.038 -18.868  -0.418
    7   HD11  LEU 765          HD12      LEU 765  37.531 -20.377   0.366
    8   HD13  LEU 765          HD13      LEU 765  37.081 -18.838   1.066
    9   HD22  LEU 765          HD21      LEU 765  36.945 -19.457  -2.575
   10   HD21  LEU 765          HD22      LEU 765  35.272 -20.026  -2.584
   11   HD23  LEU 765          HD23      LEU 765  36.547 -21.030  -1.888

  No H/Q in entry =          11
  In of MODEL   13
    1    HA   PRO 766           HA       PRO 766  31.885 -16.139   1.412
    2    HB2  PRO 766           HB2      PRO 766  33.397 -13.989   0.598
    3    HB3  PRO 766           HB3      PRO 766  33.190 -14.477   2.272
    4    HG2  PRO 766           HG2      PRO 766  35.490 -14.878   0.455
    5    HG3  PRO 766           HG3      PRO 766  35.465 -14.683   2.211
    6    HD2  PRO 766           HD2      PRO 766  35.818 -17.069   0.881
    7    HD3  PRO 766           HD3      PRO 766  35.264 -16.938   2.554

  No H/Q in entry =           7
  In of MODEL   13
    1    H    ALA 767           H        ALA 767  34.358 -16.032  -1.156
    2    HA   ALA 767           HA       ALA 767  32.533 -14.877  -3.070
    3    HB3  ALA 767           HB1      ALA 767  34.457 -14.850  -4.527
    4    HB1  ALA 767           HB2      ALA 767  35.325 -15.877  -3.376
    5    HB2  ALA 767           HB3      ALA 767  34.871 -14.229  -2.916

  No H/Q in entry =           5
  In of MODEL   13
    1    H    SER 768           H        SER 768  32.120 -17.626  -2.083
    2    HA   SER 768           HA       SER 768  32.610 -19.353  -4.336
    3    HB2  SER 768           HB2      SER 768  32.735 -20.211  -2.031
    4    HB3  SER 768           HB3      SER 768  31.025 -19.864  -1.798
    5    HG   SER 768           HG       SER 768  30.631 -21.710  -2.646

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA 769           H        ALA 769  30.148 -17.162  -3.407
    2    HA   ALA 769           HA       ALA 769  28.417 -18.104  -5.551
    3    HB2  ALA 769           HB1      ALA 769  27.447 -17.619  -2.731
    4    HB3  ALA 769           HB2      ALA 769  27.551 -19.192  -3.526
    5    HB1  ALA 769           HB3      ALA 769  26.427 -17.973  -4.125

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLU 770           H        GLU 770  26.537 -16.435  -5.759
    2    HA   GLU 770           HA       GLU 770  27.680 -13.830  -6.043
    3    HB2  GLU 770           HB2      GLU 770  25.463 -13.191  -6.891
    4    HB3  GLU 770           HB3      GLU 770  26.041 -14.657  -7.663
    5    HG2  GLU 770           HG2      GLU 770  24.634 -15.983  -6.165
    6    HG3  GLU 770           HG3      GLU 770  24.044 -14.508  -5.426

  No H/Q in entry =           6
  In of MODEL   13
    1    H    LYS 771           H        LYS 771  26.780 -11.877  -5.020
    2    HA   LYS 771           HA       LYS 771  25.644 -12.446  -2.392
    3    HB2  LYS 771           HB2      LYS 771  28.083 -10.737  -2.904
    4    HB3  LYS 771           HB3      LYS 771  27.248 -10.881  -1.363
    5    HG2  LYS 771           HG2      LYS 771  28.535 -13.185  -2.831
    6    HG3  LYS 771           HG3      LYS 771  29.297 -12.287  -1.521
    7    HD2  LYS 771           HD2      LYS 771  27.778 -13.113   0.077
    8    HD3  LYS 771           HD3      LYS 771  26.609 -13.603  -1.144
    9    HE2  LYS 771           HE2      LYS 771  27.967 -15.374  -1.865
   10    HE3  LYS 771           HE3      LYS 771  29.337 -14.859  -0.868
   11    HZ1  LYS 771           HZ1      LYS 771  27.931 -15.312   1.093
   12    HZ3  LYS 771           HZ2      LYS 771  28.208 -16.692   0.191
   13    HZ2  LYS 771           HZ3      LYS 771  26.717 -15.912   0.086

  No H/Q in entry =          13
  In of MODEL   13
    1    H    ALA 772           H        ALA 772  25.330 -10.159  -1.265
    2    HA   ALA 772           HA       ALA 772  23.883  -8.440  -3.163
    3    HB2  ALA 772           HB1      ALA 772  22.389  -9.934  -1.835
    4    HB1  ALA 772           HB2      ALA 772  22.131  -8.225  -1.546
    5    HB3  ALA 772           HB3      ALA 772  23.025  -9.186  -0.365

  No H/Q in entry =           5
  In of MODEL   13
    1    H    CYS 773           H        CYS 773  23.169  -6.427  -1.491
    2    HA   CYS 773           HA       CYS 773  25.619  -5.025  -1.379
    3    HB2  CYS 773           HB2      CYS 773  22.925  -4.207  -0.294
    4    HB3  CYS 773           HB3      CYS 773  24.295  -3.145  -0.595

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLY 774           H        GLY 774  26.856  -4.441   0.249
    2    HA3  GLY 774           HA2      GLY 774  26.975  -3.898   2.641
    3    HA2  GLY 774           HA3      GLY 774  26.269  -5.491   2.930

  No H/Q in entry =           3
  In of MODEL   13
    1    H    ALA 775           H        ALA 775  27.756  -6.621   0.679
    2    HA   ALA 775           HA       ALA 775  30.516  -6.100   1.118
    3    HB3  ALA 775           HB1      ALA 775  29.415  -8.801   1.947
    4    HB2  ALA 775           HB2      ALA 775  30.132  -7.603   3.016
    5    HB1  ALA 775           HB3      ALA 775  31.123  -8.397   1.795

  No H/Q in entry =           5
  In of MODEL   13
    1    H    CYS 776           H        CYS 776  30.813  -5.780  -0.973
    2    HA   CYS 776           HA       CYS 776  30.314  -8.058  -2.718
    3    HB2  CYS 776           HB2      CYS 776  30.081  -5.120  -3.408
    4    HB3  CYS 776           HB3      CYS 776  30.059  -6.414  -4.589

  No H/Q in entry =           4
  In of MODEL   13
    1    HA   PRO 777           HA       PRO 777  34.726  -7.539  -3.200
    2    HB2  PRO 777           HB2      PRO 777  35.056  -9.585  -4.976
    3    HB3  PRO 777           HB3      PRO 777  34.867  -9.853  -3.239
    4    HG2  PRO 777           HG2      PRO 777  32.875 -10.135  -5.437
    5    HG3  PRO 777           HG3      PRO 777  33.111 -11.134  -3.997
    6    HD2  PRO 777           HD2      PRO 777  31.157  -9.246  -4.246
    7    HD3  PRO 777           HD3      PRO 777  31.836  -9.766  -2.691

  No H/Q in entry =           7
  In of MODEL   13
    1    H    LEU 778           H        LEU 778  36.145  -7.527  -5.271
    2    HA   LEU 778           HA       LEU 778  35.792  -5.372  -6.782
    3    HB2  LEU 778           HB2      LEU 778  37.315  -6.337  -8.498
    4    HB3  LEU 778           HB3      LEU 778  37.879  -6.463  -6.848
    5    HG   LEU 778           HG       LEU 778  36.563  -8.804  -8.234
    6   HD11  LEU 778          HD11      LEU 778  38.429  -8.122  -9.636
    7   HD13  LEU 778          HD12      LEU 778  38.731  -9.638  -8.783
    8   HD12  LEU 778          HD13      LEU 778  39.502  -8.152  -8.223
    9   HD23  LEU 778          HD21      LEU 778  37.943 -10.096  -6.643
   10   HD22  LEU 778          HD22      LEU 778  36.774  -9.053  -5.862
   11   HD21  LEU 778          HD23      LEU 778  38.468  -8.589  -5.887

  No H/Q in entry =          11
  In of MODEL   13
    1    H    TRP 779           H        TRP 779  34.747  -8.549  -8.049
    2    HA   TRP 779           HA       TRP 779  33.636  -7.418 -10.441
    3    HB2  TRP 779           HB2      TRP 779  32.713  -9.785 -10.759
    4    HB3  TRP 779           HB3      TRP 779  34.465  -9.631 -10.662
    5    HD1  TRP 779           HD1      TRP 779  31.484 -10.623  -8.389
    6    HE1  TRP 779           HE1      TRP 779  32.382 -12.198  -6.570
    7    HE3  TRP 779           HE3      TRP 779  36.431 -10.591  -9.649
    8    HZ2  TRP 779           HZ2      TRP 779  34.877 -13.264  -5.778
    9    HZ3  TRP 779           HZ3      TRP 779  37.984 -11.913  -8.311
   10    HH2  TRP 779           HH2      TRP 779  37.213 -13.216  -6.421

  No H/Q in entry =          10
  In of MODEL   13
    1    H    GLY 780           H        GLY 780  32.452  -7.308  -7.352
    2    HA3  GLY 780           HA2      GLY 780  29.667  -7.564  -8.256
    3    HA2  GLY 780           HA3      GLY 780  30.212  -7.799  -6.595

  No H/Q in entry =           3
  In of MODEL   13
    1    H    LYS 781           H        LYS 781  28.339  -5.851  -7.962
    2    HA   LYS 781           HA       LYS 781  29.356  -3.469  -6.532
    3    HB2  LYS 781           HB2      LYS 781  30.031  -3.321  -8.908
    4    HB3  LYS 781           HB3      LYS 781  28.310  -3.341  -9.321
    5    HG2  LYS 781           HG2      LYS 781  27.910  -1.386  -8.066
    6    HG3  LYS 781           HG3      LYS 781  29.544  -1.415  -7.413
    7    HD2  LYS 781           HD2      LYS 781  30.397  -1.083  -9.701
    8    HD3  LYS 781           HD3      LYS 781  28.718  -0.903 -10.248
    9    HE2  LYS 781           HE2      LYS 781  28.368   0.863  -8.692
   10    HE3  LYS 781           HE3      LYS 781  29.990   0.605  -8.055
   11    HZ1  LYS 781           HZ1      LYS 781  29.401   1.534 -10.848
   12    HZ3  LYS 781           HZ2      LYS 781  30.928   1.341 -10.151
   13    HZ2  LYS 781           HZ3      LYS 781  29.899   2.525  -9.575

  No H/Q in entry =          13
  In of MODEL   13
    1    H    CYS 782           H        CYS 782  27.890  -2.892  -5.198
    2    HA   CYS 782           HA       CYS 782  25.099  -3.448  -5.673
    3    HB2  CYS 782           HB2      CYS 782  25.960  -3.504  -3.370
    4    HB3  CYS 782           HB3      CYS 782  26.459  -1.818  -3.504

  No H/Q in entry =           4
  In of MODEL   13
    1    H    ASP 783           H        ASP 783  24.305  -2.384  -7.302
    2    HA   ASP 783           HA       ASP 783  24.940   0.483  -7.494
    3    HB2  ASP 783           HB2      ASP 783  25.696  -1.144  -9.381
    4    HB3  ASP 783           HB3      ASP 783  23.997  -1.170  -9.838

  No H/Q in entry =           4
  In of MODEL   13
    1    H    ALA 784           H        ALA 784  23.040   1.498  -9.001
    2    HA   ALA 784           HA       ALA 784  20.832   1.424  -7.145
    3    HB3  ALA 784           HB1      ALA 784  20.114   3.460  -8.232
    4    HB2  ALA 784           HB2      ALA 784  21.318   3.228  -9.498
    5    HB1  ALA 784           HB3      ALA 784  21.832   3.545  -7.841

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLU 785           H        GLU 785  21.340  -0.626  -9.375
    2    HA   GLU 785           HA       GLU 785  19.327  -0.725 -11.285
    3    HB2  GLU 785           HB2      GLU 785  20.340  -3.026  -9.585
    4    HB3  GLU 785           HB3      GLU 785  19.507  -3.179 -11.123
    5    HG2  GLU 785           HG2      GLU 785  22.170  -1.833 -10.755
    6    HG3  GLU 785           HG3      GLU 785  21.958  -3.508 -11.258

  No H/Q in entry =           6
  In of MODEL   13
    1    H    SER 786           H        SER 786  19.249  -2.223  -8.100
    2    HA   SER 786           HA       SER 786  16.598  -1.253  -7.481
    3    HB2  SER 786           HB2      SER 786  17.221  -4.238  -7.565
    4    HB3  SER 786           HB3      SER 786  15.723  -3.517  -6.981
    5    HG   SER 786           HG       SER 786  16.198  -2.588  -9.413

  No H/Q in entry =           5
  In of MODEL   13
    1    H    SER 787           H        SER 787  19.401  -0.972  -6.693
    2    HA   SER 787           HA       SER 787  20.910  -1.187  -5.092
    3    HB2  SER 787           HB2      SER 787  18.438  -1.120  -3.343
    4    HB3  SER 787           HB3      SER 787  20.082  -0.841  -2.762
    5    HG   SER 787           HG       SER 787  20.214   0.976  -4.015

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LYS 788           H        LYS 788  21.334  -3.203  -6.032
    2    HA   LYS 788           HA       LYS 788  21.393  -5.379  -4.108
    3    HB2  LYS 788           HB2      LYS 788  20.729  -7.005  -5.824
    4    HB3  LYS 788           HB3      LYS 788  19.417  -5.868  -5.558
    5    HG2  LYS 788           HG2      LYS 788  20.042  -4.660  -7.590
    6    HG3  LYS 788           HG3      LYS 788  21.377  -5.784  -7.848
    7    HD2  LYS 788           HD2      LYS 788  19.776  -7.630  -8.031
    8    HD3  LYS 788           HD3      LYS 788  18.446  -6.495  -7.784
    9    HE2  LYS 788           HE2      LYS 788  19.135  -5.284  -9.800
   10    HE3  LYS 788           HE3      LYS 788  20.424  -6.453 -10.053
   11    HZ1  LYS 788           HZ1      LYS 788  17.535  -7.146  -9.989
   12    HZ3  LYS 788           HZ2      LYS 788  18.796  -8.178 -10.421
   13    HZ2  LYS 788           HZ3      LYS 788  18.415  -6.850 -11.379

  No H/Q in entry =          13
  In of MODEL   13
    1    H    CYS 789           H        CYS 789  22.965  -7.049  -5.167
    2    HA   CYS 789           HA       CYS 789  25.147  -5.374  -6.154
    3    HB2  CYS 789           HB2      CYS 789  25.334  -6.761  -4.004
    4    HB3  CYS 789           HB3      CYS 789  25.304  -8.178  -5.036

  No H/Q in entry =           4
  In of MODEL   13
    1    H    VAL 790           H        VAL 790  25.655  -5.553  -8.160
    2    HA   VAL 790           HA       VAL 790  24.575  -7.787  -9.720
    3    HB   VAL 790           HB       VAL 790  23.861  -5.463 -10.350
    4   HG13  VAL 790          HG11      VAL 790  25.830  -4.200  -9.831
    5   HG12  VAL 790          HG12      VAL 790  25.405  -3.966 -11.527
    6   HG11  VAL 790          HG13      VAL 790  26.737  -5.033 -11.092
    7   HG21  VAL 790          HG21      VAL 790  25.449  -6.907 -12.470
    8   HG23  VAL 790          HG22      VAL 790  24.233  -5.666 -12.783
    9   HG22  VAL 790          HG23      VAL 790  23.762  -7.195 -12.038

  No H/Q in entry =           9
  In of MODEL   13
    1    H    CYS 791           H        CYS 791  25.979  -8.719 -11.343
    2    HA   CYS 791           HA       CYS 791  28.753  -8.738 -10.438
    3    HB2  CYS 791           HB2      CYS 791  27.437 -10.635 -12.399
    4    HB3  CYS 791           HB3      CYS 791  28.908 -10.859 -11.473

  No H/Q in entry =           4
  In of MODEL   13
    1    H    ARG 792           H        ARG 792  30.111  -7.625 -11.506
    2    HA   ARG 792           HA       ARG 792  29.569  -6.147 -13.842
    3    HB2  ARG 792           HB2      ARG 792  32.190  -6.859 -12.494
    4    HB3  ARG 792           HB3      ARG 792  32.054  -5.701 -13.805
    5    HG2  ARG 792           HG2      ARG 792  30.796  -4.198 -12.464
    6    HG3  ARG 792           HG3      ARG 792  30.553  -5.413 -11.214
    7    HD2  ARG 792           HD2      ARG 792  32.230  -3.794 -10.507
    8    HD3  ARG 792           HD3      ARG 792  32.959  -5.376 -10.717
    9    HE   ARG 792           HE       ARG 792  33.183  -3.581 -12.975
   10   HH11  ARG 792          HH11      ARG 792  34.718  -4.781 -10.026
   11   HH12  ARG 792          HH12      ARG 792  36.285  -4.280 -10.436
   12   HH21  ARG 792          HH21      ARG 792  35.421  -2.865 -13.565
   13   HH22  ARG 792          HH22      ARG 792  36.684  -3.253 -12.460

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLU 793           H        GLU 793  30.347  -6.468 -15.958
    2    HA   GLU 793           HA       GLU 793  30.402  -9.156 -16.851
    3    HB2  GLU 793           HB2      GLU 793  31.233  -6.629 -18.279
    4    HB3  GLU 793           HB3      GLU 793  31.066  -8.198 -19.052
    5    HG2  GLU 793           HG2      GLU 793  28.688  -8.215 -18.444
    6    HG3  GLU 793           HG3      GLU 793  28.884  -6.614 -17.737

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ALA 794           H        ALA 794  32.202 -10.130 -18.086
    2    HA   ALA 794           HA       ALA 794  34.539 -10.198 -16.454
    3    HB3  ALA 794           HB1      ALA 794  35.362 -11.826 -18.085
    4    HB1  ALA 794           HB2      ALA 794  33.999 -11.466 -19.141
    5    HB2  ALA 794           HB3      ALA 794  33.722 -12.205 -17.562

  No H/Q in entry =           5
  In of MODEL   13
    1    H    SER 795           H        SER 795  33.571  -8.415 -19.135
    2    HA   SER 795           HA       SER 795  36.122  -7.714 -20.202
    3    HB2  SER 795           HB2      SER 795  33.438  -6.393 -20.563
    4    HB3  SER 795           HB3      SER 795  34.796  -6.435 -21.694
    5    HG   SER 795           HG       SER 795  34.261  -8.344 -22.322

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLU 796           H        GLU 796  34.012  -6.770 -17.665
    2    HA   GLU 796           HA       GLU 796  35.116  -4.121 -17.473
    3    HB2  GLU 796           HB2      GLU 796  32.707  -4.204 -17.339
    4    HB3  GLU 796           HB3      GLU 796  32.754  -5.474 -16.137
    5    HG2  GLU 796           HG2      GLU 796  32.097  -3.275 -15.222
    6    HG3  GLU 796           HG3      GLU 796  33.550  -3.967 -14.498

  No H/Q in entry =           6
  In of MODEL   13
    1    H    CYS 797           H        CYS 797  37.010  -5.485 -17.162
    2    HA   CYS 797           HA       CYS 797  37.560  -5.849 -14.279
    3    HB2  CYS 797           HB2      CYS 797  38.180  -7.700 -15.893
    4    HB3  CYS 797           HB3      CYS 797  39.328  -6.599 -16.637

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLU 798           H        GLU 798  38.921  -4.392 -13.270
    2    HA   GLU 798           HA       GLU 798  40.136  -2.277 -14.954
    3    HB2  GLU 798           HB2      GLU 798  37.911  -1.631 -14.140
    4    HB3  GLU 798           HB3      GLU 798  38.434  -1.934 -12.498
    5    HG2  GLU 798           HG2      GLU 798  40.082  -0.131 -12.713
    6    HG3  GLU 798           HG3      GLU 798  39.476   0.195 -14.342

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU 799           H        GLU 799  39.825  -3.780 -11.839
    2    HA   GLU 799           HA       GLU 799  42.107  -2.554 -10.703
    3    HB2  GLU 799           HB2      GLU 799  41.633  -4.195  -8.827
    4    HB3  GLU 799           HB3      GLU 799  40.405  -2.990  -9.177
    5    HG2  GLU 799           HG2      GLU 799  40.265  -5.733 -10.346
    6    HG3  GLU 799           HG3      GLU 799  39.685  -5.421  -8.706

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLU 800           H        GLU 800  43.770  -3.981  -9.574
    2    HA   GLU 800           HA       GLU 800  44.888  -5.648 -11.653
    3    HB2  GLU 800           HB2      GLU 800  46.170  -4.294  -9.290
    4    HB3  GLU 800           HB3      GLU 800  47.004  -5.442 -10.315
    5    HG2  GLU 800           HG2      GLU 800  46.720  -3.984 -12.222
    6    HG3  GLU 800           HG3      GLU 800  45.806  -2.841 -11.234

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLY 801           H        GLY 801  43.323  -7.157 -11.003
    2    HA3  GLY 801           HA2      GLY 801  43.817  -8.742  -8.631
    3    HA2  GLY 801           HA3      GLY 801  42.778  -9.206  -9.980

  No H/Q in entry =           3
  In of MODEL   13
    1    H    PHE 802           H        PHE 802  44.044 -11.321  -9.364
    2    HA   PHE 802           HA       PHE 802  46.628 -11.343 -10.672
    3    HB2  PHE 802           HB2      PHE 802  45.187 -13.221  -8.843
    4    HB3  PHE 802           HB3      PHE 802  46.512 -13.796  -9.840
    5    HD1  PHE 802           HD1      PHE 802  46.329 -10.448  -8.289
    6    HD2  PHE 802           HD2      PHE 802  48.009 -14.343  -8.134
    7    HE1  PHE 802           HE1      PHE 802  47.931  -9.681  -6.636
    8    HE2  PHE 802           HE2      PHE 802  49.610 -13.597  -6.468
    9    HZ   PHE 802           HZ       PHE 802  49.586 -11.249  -5.697

  No H/Q in entry =           9
  In of MODEL   13
    1    H    SER 803           H        SER 803  47.074 -13.264 -11.948
    2    HA   SER 803           HA       SER 803  44.819 -13.954 -13.671
    3    HB2  SER 803           HB2      SER 803  47.740 -14.629 -14.097
    4    HB3  SER 803           HB3      SER 803  46.402 -14.664 -15.264
    5    HG   SER 803           HG       SER 803  46.743 -12.666 -15.677

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ILE 804           H        ILE 804  43.971 -15.881 -13.371
    2    HA   ILE 804           HA       ILE 804  45.445 -17.798 -11.731
    3    HB   ILE 804           HB       ILE 804  43.396 -18.556 -10.643
    4   HG12  ILE 804          HG12      ILE 804  41.780 -17.865 -12.470
    5   HG13  ILE 804          HG13      ILE 804  41.245 -17.506 -10.840
    6   HG22  ILE 804          HG21      ILE 804  43.811 -15.600 -10.304
    7   HG21  ILE 804          HG22      ILE 804  44.689 -16.890  -9.479
    8   HG23  ILE 804          HG23      ILE 804  42.968 -16.638  -9.162
    9   HD13  ILE 804          HD11      ILE 804  40.678 -15.691 -12.298
   10   HD12  ILE 804          HD12      ILE 804  42.315 -15.552 -12.874
   11   HD11  ILE 804          HD13      ILE 804  41.937 -15.144 -11.196

  No H/Q in entry =          11
  In of MODEL   13
    1    H    CYS 805           H        CYS 805  44.486 -20.026 -11.916
    2    HA   CYS 805           HA       CYS 805  43.910 -20.561 -14.767
    3    HB2  CYS 805           HB2      CYS 805  46.160 -21.330 -13.727
    4    HB3  CYS 805           HB3      CYS 805  45.177 -22.373 -12.704

  No H/Q in entry =           4
  In of MODEL   13
    1    H    VAL 806           H        VAL 806  41.931 -21.201 -15.090
    2    HA   VAL 806           HA       VAL 806  40.736 -22.664 -12.892
    3    HB   VAL 806           HB       VAL 806  40.025 -20.332 -12.786
    4   HG12  VAL 806          HG11      VAL 806  38.662 -19.335 -14.509
    5   HG11  VAL 806          HG12      VAL 806  39.029 -20.724 -15.541
    6   HG13  VAL 806          HG13      VAL 806  40.326 -19.660 -15.002
    7   HG23  VAL 806          HG21      VAL 806  37.788 -22.082 -13.746
    8   HG22  VAL 806          HG22      VAL 806  37.648 -20.616 -12.754
    9   HG21  VAL 806          HG23      VAL 806  38.435 -22.053 -12.108

  No H/Q in entry =           9
  In of MODEL   13
    1    H    GLU 807           H        GLU 807  39.695 -24.445 -13.407
    2    HA   GLU 807           HA       GLU 807  39.719 -25.364 -16.129
    3    HB2  GLU 807           HB2      GLU 807  40.362 -26.867 -14.307
    4    HB3  GLU 807           HB3      GLU 807  38.787 -26.663 -13.566
    5    HG2  GLU 807           HG2      GLU 807  37.758 -27.690 -15.552
    6    HG3  GLU 807           HG3      GLU 807  39.368 -27.951 -16.217

  No H/Q in entry =           6
  In of MODEL   13
    1    H    VAL 808           H        VAL 808  38.218 -24.736 -17.339
    2    HA   VAL 808           HA       VAL 808  35.424 -24.729 -16.457
    3    HB   VAL 808           HB       VAL 808  36.776 -22.737 -18.250
    4   HG11  VAL 808          HG11      VAL 808  34.557 -23.151 -18.950
    5   HG13  VAL 808          HG12      VAL 808  34.750 -21.510 -18.320
    6   HG12  VAL 808          HG13      VAL 808  33.934 -22.750 -17.337
    7   HG22  VAL 808          HG21      VAL 808  37.463 -22.277 -16.066
    8   HG21  VAL 808          HG22      VAL 808  35.810 -22.352 -15.465
    9   HG23  VAL 808          HG23      VAL 808  36.299 -21.055 -16.562

  No H/Q in entry =           9
  In of MODEL   13
    1    H    ASN 809           H        ASN 809  34.135 -25.702 -18.028
    2    HA   ASN 809           HA       ASN 809  33.565 -26.956 -19.786
    3    HB2  ASN 809           HB2      ASN 809  35.844 -25.486 -21.046
    4    HB3  ASN 809           HB3      ASN 809  34.932 -26.678 -21.946
    5   HD21  ASN 809          HD21      ASN 809  35.208 -23.869 -22.341
    6   HD22  ASN 809          HD22      ASN 809  33.599 -23.212 -22.274

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLY 810           H        GLY 810  35.985 -27.536 -17.911
    2    HA3  GLY 810           HA2      GLY 810  36.874 -29.677 -17.439
    3    HA2  GLY 810           HA3      GLY 810  36.664 -30.095 -19.135

  No H/Q in entry =           3
  In of MODEL   13
    1    H    LYS 811           H        LYS 811  37.901 -27.167 -19.437
    2    HA   LYS 811           HA       LYS 811  40.656 -28.174 -19.435
    3    HB2  LYS 811           HB2      LYS 811  39.352 -26.184 -21.304
    4    HB3  LYS 811           HB3      LYS 811  41.045 -26.659 -21.347
    5    HG2  LYS 811           HG2      LYS 811  40.411 -28.953 -21.852
    6    HG3  LYS 811           HG3      LYS 811  38.709 -28.519 -21.769
    7    HD2  LYS 811           HD2      LYS 811  39.417 -28.652 -24.083
    8    HD3  LYS 811           HD3      LYS 811  39.027 -26.986 -23.668
    9    HE2  LYS 811           HE2      LYS 811  41.391 -26.457 -23.441
   10    HE3  LYS 811           HE3      LYS 811  41.821 -28.140 -23.723
   11    HZ3  LYS 811           HZ1      LYS 811  40.965 -27.957 -25.968
   12    HZ2  LYS 811           HZ2      LYS 811  42.096 -26.744 -25.711
   13    HZ1  LYS 811           HZ3      LYS 811  40.450 -26.383 -25.684

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLU 812           H        GLU 812  42.321 -26.688 -18.913
    2    HA   GLU 812           HA       GLU 812  41.435 -24.706 -16.966
    3    HB2  GLU 812           HB2      GLU 812  44.161 -25.883 -17.530
    4    HB3  GLU 812           HB3      GLU 812  43.815 -24.715 -16.265
    5    HG2  GLU 812           HG2      GLU 812  42.376 -26.285 -15.141
    6    HG3  GLU 812           HG3      GLU 812  42.562 -27.444 -16.454

  No H/Q in entry =           6
  In of MODEL   13
    1    H    GLN 813           H        GLN 813  41.068 -22.793 -17.716
    2    HA   GLN 813           HA       GLN 813  42.902 -21.631 -19.725
    3    HB2  GLN 813           HB2      GLN 813  40.632 -21.850 -20.529
    4    HB3  GLN 813           HB3      GLN 813  39.989 -21.082 -19.084
    5    HG2  GLN 813           HG2      GLN 813  41.004 -19.042 -19.687
    6    HG3  GLN 813           HG3      GLN 813  41.746 -19.723 -21.143
    7   HE21  GLN 813          HE21      GLN 813  38.934 -18.474 -19.701
    8   HE22  GLN 813          HE22      GLN 813  37.851 -18.557 -21.040

  No H/Q in entry =           8
  In of MODEL   13
    1    H    THR 814           H        THR 814  43.715 -19.599 -19.299
    2    HA   THR 814           HA       THR 814  43.883 -18.882 -16.488
    3    HB   THR 814           HB       THR 814  45.096 -17.523 -18.883
    4    HG1  THR 814           HG1      THR 814  46.146 -19.237 -19.047
    5   HG23  THR 814          HG21      THR 814  46.772 -16.700 -17.272
    6   HG22  THR 814          HG22      THR 814  45.907 -17.517 -15.971
    7   HG21  THR 814          HG23      THR 814  45.143 -16.183 -16.834

  No H/Q in entry =           7
  In of MODEL   13
    1    H    MET 815           H        MET 815  42.793 -17.222 -15.635
    2    HA   MET 815           HA       MET 815  41.561 -15.311 -17.502
    3    HB2  MET 815           HB2      MET 815  40.273 -16.297 -14.967
    4    HB3  MET 815           HB3      MET 815  39.581 -15.158 -16.113
    5    HG2  MET 815           HG2      MET 815  39.711 -17.077 -17.811
    6    HG3  MET 815           HG3      MET 815  40.092 -18.051 -16.401
    7    HE1  MET 815           HE1      MET 815  38.309 -19.598 -17.034
    8    HE3  MET 815           HE2      MET 815  37.703 -18.625 -18.380
    9    HE2  MET 815           HE3      MET 815  36.579 -19.239 -17.156

  No H/Q in entry =           9
  In of MODEL   13
    1    H    SER 816           H        SER 816  41.131 -13.281 -16.520
    2    HA   SER 816           HA       SER 816  42.997 -12.560 -14.448
    3    HB2  SER 816           HB2      SER 816  40.910 -10.981 -15.976
    4    HB3  SER 816           HB3      SER 816  42.111 -10.269 -14.890
    5    HG   SER 816           HG       SER 816  42.345 -10.765 -17.451

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLU 817           H        GLU 817  42.275 -11.849 -12.418
    2    HA   GLU 817           HA       GLU 817  40.551 -13.240 -10.943
    3    HB2  GLU 817           HB2      GLU 817  42.086 -11.114 -10.491
    4    HB3  GLU 817           HB3      GLU 817  40.485 -10.382 -10.350
    5    HG2  GLU 817           HG2      GLU 817  40.848 -11.038  -8.187
    6    HG3  GLU 817           HG3      GLU 817  40.031 -12.461  -8.845

  No H/Q in entry =           6
  In of MODEL   13
    1    H    CYS 818           H        CYS 818  39.683 -10.108 -12.421
    2    HA   CYS 818           HA       CYS 818  37.086  -9.805 -11.521
    3    HB2  CYS 818           HB2      CYS 818  37.900  -9.075 -14.307
    4    HB3  CYS 818           HB3      CYS 818  36.796  -8.230 -13.233

  No H/Q in entry =           4
  In of MODEL   13
    1    H    GLU 819           H        GLU 819  38.330 -11.557 -14.308
    2    HA   GLU 819           HA       GLU 819  35.811 -12.051 -15.488
    3    HB2  GLU 819           HB2      GLU 819  37.768 -11.898 -16.842
    4    HB3  GLU 819           HB3      GLU 819  38.546 -13.190 -15.947
    5    HG2  GLU 819           HG2      GLU 819  37.140 -14.801 -16.842
    6    HG3  GLU 819           HG3      GLU 819  36.023 -13.608 -17.504

  No H/Q in entry =           6
  In of MODEL   13
    1    H    ALA 820           H        ALA 820  38.183 -14.177 -13.910
    2    HA   ALA 820           HA       ALA 820  36.620 -16.463 -13.926
    3    HB2  ALA 820           HB1      ALA 820  38.101 -17.301 -12.152
    4    HB3  ALA 820           HB2      ALA 820  38.739 -15.658 -11.977
    5    HB1  ALA 820           HB3      ALA 820  38.968 -16.540 -13.488

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLY 821           H        GLY 821  36.508 -13.692 -11.853
    2    HA3  GLY 821           HA2      GLY 821  34.868 -14.947  -9.830
    3    HA2  GLY 821           HA3      GLY 821  35.361 -13.258  -9.889

  No H/Q in entry =           3
  In of MODEL   13
    1    H    ALA 822           H        ALA 822  34.448 -12.674 -12.529
    2    HA   ALA 822           HA       ALA 822  31.785 -11.972 -12.023
    3    HB1  ALA 822           HB1      ALA 822  33.180 -12.116 -14.703
    4    HB2  ALA 822           HB2      ALA 822  33.263 -10.766 -13.576
    5    HB3  ALA 822           HB3      ALA 822  31.723 -11.190 -14.317

  No H/Q in entry =           5
  In of MODEL   13
    1    H    LEU 823           H        LEU 823  33.168 -14.524 -14.029
    2    HA   LEU 823           HA       LEU 823  30.753 -15.617 -14.951
    3    HB2  LEU 823           HB2      LEU 823  33.483 -16.854 -14.547
    4    HB3  LEU 823           HB3      LEU 823  32.151 -17.831 -15.042
    5    HG   LEU 823           HG       LEU 823  33.461 -17.282 -16.977
    6   HD13  LEU 823          HD11      LEU 823  31.813 -16.319 -18.445
    7   HD12  LEU 823          HD12      LEU 823  30.917 -15.712 -17.059
    8   HD11  LEU 823          HD13      LEU 823  31.065 -17.452 -17.316
    9   HD22  LEU 823          HD21      LEU 823  34.508 -15.209 -16.243
   10   HD21  LEU 823          HD22      LEU 823  32.960 -14.377 -16.351
   11   HD23  LEU 823          HD23      LEU 823  33.731 -14.998 -17.811

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ARG 824           H        ARG 824  32.471 -16.049 -12.011
    2    HA   ARG 824           HA       ARG 824  31.056 -18.311 -10.995
    3    HB2  ARG 824           HB2      ARG 824  33.324 -17.444 -10.426
    4    HB3  ARG 824           HB3      ARG 824  32.537 -16.182  -9.499
    5    HG2  ARG 824           HG2      ARG 824  31.630 -17.785  -7.979
    6    HG3  ARG 824           HG3      ARG 824  32.223 -19.139  -8.942
    7    HD2  ARG 824           HD2      ARG 824  33.778 -17.099  -7.403
    8    HD3  ARG 824           HD3      ARG 824  33.860 -18.869  -7.263
    9    HE   ARG 824           HE       ARG 824  34.866 -17.243  -9.504
   10   HH11  ARG 824          HH11      ARG 824  35.071 -20.213  -7.623
   11   HH12  ARG 824          HH12      ARG 824  36.542 -20.712  -8.248
   12   HH21  ARG 824          HH21      ARG 824  36.783 -17.841 -10.425
   13   HH22  ARG 824          HH22      ARG 824  37.615 -19.258  -9.934

  No H/Q in entry =          13
  In of MODEL   13
    1    H    CYS 825           H        CYS 825  30.881 -14.830 -10.570
    2    HA   CYS 825           HA       CYS 825  28.884 -14.731  -8.600
    3    HB2  CYS 825           HB2      CYS 825  30.465 -12.849  -9.280
    4    HB3  CYS 825           HB3      CYS 825  29.484 -12.658 -10.711

  No H/Q in entry =           4
  In of MODEL   13
    1    H    ARG 826           H        ARG 826  28.767 -14.750 -12.133
    2    HA   ARG 826           HA       ARG 826  25.972 -14.207 -12.180
    3    HB2  ARG 826           HB2      ARG 826  26.081 -14.678 -14.584
    4    HB3  ARG 826           HB3      ARG 826  27.257 -13.459 -14.062
    5    HG2  ARG 826           HG2      ARG 826  28.953 -15.252 -14.164
    6    HG3  ARG 826           HG3      ARG 826  27.712 -16.325 -14.818
    7    HD2  ARG 826           HD2      ARG 826  28.680 -13.741 -16.036
    8    HD3  ARG 826           HD3      ARG 826  28.957 -15.374 -16.650
    9    HE   ARG 826           HE       ARG 826  26.362 -15.365 -16.593
   10   HH11  ARG 826          HH11      ARG 826  28.530 -12.827 -17.821
   11   HH12  ARG 826          HH12      ARG 826  27.375 -12.204 -18.908
   12   HH21  ARG 826          HH21      ARG 826  24.836 -14.503 -18.073
   13   HH22  ARG 826          HH22      ARG 826  25.236 -13.174 -19.067

  No H/Q in entry =          13
  In of MODEL   13
    1    H    GLY 827           H        GLY 827  27.825 -17.180 -12.216
    2    HA3  GLY 827           HA2      GLY 827  26.341 -18.990 -11.233
    3    HA2  GLY 827           HA3      GLY 827  25.269 -18.581 -12.568

  No H/Q in entry =           3
  In of MODEL   13
    1    H    GLN 828           H        GLN 828  28.148 -18.189 -13.881
    2    HA   GLN 828           HA       GLN 828  28.145 -20.593 -15.394
    3    HB2  GLN 828           HB2      GLN 828  29.185 -18.454 -16.152
    4    HB3  GLN 828           HB3      GLN 828  30.415 -18.657 -14.917
    5    HG2  GLN 828           HG2      GLN 828  31.532 -19.435 -16.772
    6    HG3  GLN 828           HG3      GLN 828  30.852 -20.923 -16.138
    7   HE21  GLN 828          HE21      GLN 828  28.115 -20.030 -17.168
    8   HE22  GLN 828          HE22      GLN 828  28.200 -20.381 -18.846

  No H/Q in entry =           8
  In of MODEL   13
    1    H    SER 829           H        SER 829  29.564 -22.424 -15.253
    2    HA   SER 829           HA       SER 829  30.561 -22.923 -12.577
    3    HB2  SER 829           HB2      SER 829  30.223 -24.765 -14.934
    4    HB3  SER 829           HB3      SER 829  30.589 -25.254 -13.277
    5    HG   SER 829           HG       SER 829  28.346 -23.677 -13.748

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ILE 830           H        ILE 830  32.636 -22.820 -12.155
    2    HA   ILE 830           HA       ILE 830  34.756 -23.159 -14.152
    3    HB   ILE 830           HB       ILE 830  35.883 -21.116 -13.460
    4   HG12  ILE 830          HG12      ILE 830  35.035 -20.912 -11.102
    5   HG13  ILE 830          HG13      ILE 830  34.984 -19.379 -11.895
    6   HG23  ILE 830          HG21      ILE 830  34.499 -19.340 -14.412
    7   HG22  ILE 830          HG22      ILE 830  33.108 -20.429 -14.347
    8   HG21  ILE 830          HG23      ILE 830  34.496 -20.830 -15.358
    9   HD12  ILE 830          HD11      ILE 830  32.648 -21.195 -11.388
   10   HD11  ILE 830          HD12      ILE 830  32.579 -19.700 -12.319
   11   HD13  ILE 830          HD13      ILE 830  33.026 -19.656 -10.615

  No H/Q in entry =          11
  In of MODEL   13
    1    H    SER 831           H        SER 831  36.524 -24.104 -13.115
    2    HA   SER 831           HA       SER 831  36.256 -24.482 -10.228
    3    HB2  SER 831           HB2      SER 831  37.227 -26.335 -12.369
    4    HB3  SER 831           HB3      SER 831  37.331 -26.654 -10.642
    5    HG   SER 831           HG       SER 831  34.837 -25.897 -11.483

  No H/Q in entry =           5
  In of MODEL   13
    1    H    VAL 832           H        VAL 832  37.821 -23.186  -9.350
    2    HA   VAL 832           HA       VAL 832  40.223 -22.513 -10.710
    3    HB   VAL 832           HB       VAL 832  39.379 -22.156  -7.833
    4   HG13  VAL 832          HG11      VAL 832  41.869 -22.314  -7.918
    5   HG12  VAL 832          HG12      VAL 832  41.359 -20.662  -7.566
    6   HG11  VAL 832          HG13      VAL 832  41.894 -21.094  -9.191
    7   HG23  VAL 832          HG21      VAL 832  39.738 -20.233 -10.102
    8   HG22  VAL 832          HG22      VAL 832  39.248 -19.814  -8.456
    9   HG21  VAL 832          HG23      VAL 832  38.219 -20.845  -9.454

  No H/Q in entry =           9
  In of MODEL   13
    1    H    THR 833           H        THR 833  41.711 -23.930 -11.187
    2    HA   THR 833           HA       THR 833  42.152 -26.198  -9.483
    3    HB   THR 833           HB       THR 833  43.703 -26.822 -11.366
    4    HG1  THR 833           HG1      THR 833  43.686 -25.598 -13.187
    5   HG22  THR 833          HG21      THR 833  40.827 -26.247 -12.078
    6   HG21  THR 833          HG22      THR 833  41.402 -27.670 -11.210
    7   HG23  THR 833          HG23      THR 833  41.877 -27.408 -12.889

  No H/Q in entry =           7
  In of MODEL   13
    1    H    SER 834           H        SER 834  43.637 -23.213 -10.464
    2    HA   SER 834           HA       SER 834  45.617 -23.546  -8.392
    3    HB2  SER 834           HB2      SER 834  46.345 -22.992 -11.277
    4    HB3  SER 834           HB3      SER 834  47.445 -22.921  -9.908
    5    HG   SER 834           HG       SER 834  46.208 -25.230  -9.796

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ILE 835           H        ILE 835  46.273 -21.612  -7.556
    2    HA   ILE 835           HA       ILE 835  44.818 -19.219  -8.438
    3    HB   ILE 835           HB       ILE 835  45.283 -18.271  -6.354
    4   HG12  ILE 835          HG12      ILE 835  47.729 -18.590  -6.209
    5   HG13  ILE 835          HG13      ILE 835  46.946 -19.018  -4.703
    6   HG22  ILE 835          HG21      ILE 835  44.997 -21.193  -5.828
    7   HG21  ILE 835          HG22      ILE 835  43.720 -20.018  -6.124
    8   HG23  ILE 835          HG23      ILE 835  44.699 -19.909  -4.655
    9   HD13  ILE 835          HD11      ILE 835  48.733 -20.514  -5.226
   10   HD12  ILE 835          HD12      ILE 835  47.980 -20.893  -6.788
   11   HD11  ILE 835          HD13      ILE 835  47.180 -21.365  -5.282

  No H/Q in entry =          11
  In of MODEL   13
    1    H    ARG 836           H        ARG 836  47.140 -20.659  -9.639
    2    HA   ARG 836           HA       ARG 836  48.932 -18.391 -10.153
    3    HB2  ARG 836           HB2      ARG 836  49.397 -21.318 -10.747
    4    HB3  ARG 836           HB3      ARG 836  50.575 -20.019 -10.796
    5    HG2  ARG 836           HG2      ARG 836  50.387 -19.799  -8.352
    6    HG3  ARG 836           HG3      ARG 836  49.271 -21.163  -8.354
    7    HD2  ARG 836           HD2      ARG 836  51.042 -22.457  -9.516
    8    HD3  ARG 836           HD3      ARG 836  52.147 -21.136  -9.166
    9    HE   ARG 836           HE       ARG 836  50.734 -22.672  -7.099
   10   HH11  ARG 836          HH11      ARG 836  53.617 -20.875  -8.169
   11   HH12  ARG 836          HH12      ARG 836  54.568 -21.320  -6.843
   12   HH21  ARG 836          HH21      ARG 836  52.062 -23.263  -5.231
   13   HH22  ARG 836          HH22      ARG 836  53.651 -22.723  -5.106

  No H/Q in entry =          13
  In of MODEL   13
    1    HA   PRO 837           HA       PRO 837  46.836 -18.598 -14.111
    2    HB2  PRO 837           HB2      PRO 837  48.847 -17.872 -15.825
    3    HB3  PRO 837           HB3      PRO 837  47.940 -16.724 -14.838
    4    HG2  PRO 837           HG2      PRO 837  50.649 -17.896 -14.373
    5    HG3  PRO 837           HG3      PRO 837  50.075 -16.248 -14.082
    6    HD2  PRO 837           HD2      PRO 837  50.364 -18.061 -12.096
    7    HD3  PRO 837           HD3      PRO 837  49.118 -16.801 -12.066

  No H/Q in entry =           7
  In of MODEL   13
    1    H    CYS 838           H        CYS 838  46.884 -19.755 -16.256
    2    HA   CYS 838           HA       CYS 838  48.297 -22.313 -16.006
    3    HB2  CYS 838           HB2      CYS 838  46.523 -21.496 -18.309
    4    HB3  CYS 838           HB3      CYS 838  46.864 -23.110 -17.746

  No H/Q in entry =           4
  In of MODEL   13
    1    H    ALA 839           H        ALA 839  49.006 -22.957 -18.476
    2    HA   ALA 839           HA       ALA 839  50.684 -20.823 -19.464
    3    HB2  ALA 839           HB1      ALA 839  50.225 -23.636 -20.467
    4    HB1  ALA 839           HB2      ALA 839  51.541 -23.107 -19.418
    5    HB3  ALA 839           HB3      ALA 839  51.447 -22.521 -21.083

  No H/Q in entry =           5
  In of MODEL   13
    1    H    ALA 840           H        ALA 840  47.585 -21.812 -19.768
    2    HA   ALA 840           HA       ALA 840  46.952 -21.232 -22.481
    3    HB1  ALA 840           HB1      ALA 840  45.137 -21.263 -20.083
    4    HB2  ALA 840           HB2      ALA 840  45.550 -22.668 -21.060
    5    HB3  ALA 840           HB3      ALA 840  44.638 -21.334 -21.772

  No H/Q in entry =           5
  In of MODEL   13
    1    H    GLU 841           H        GLU 841  48.337 -19.197 -22.312
    2    HA   GLU 841           HA       GLU 841  46.621 -16.915 -21.594
    3    HB2  GLU 841           HB2      GLU 841  49.571 -16.943 -22.230
    4    HB3  GLU 841           HB3      GLU 841  48.643 -15.502 -21.856
    5    HG2  GLU 841           HG2      GLU 841  48.139 -16.505 -19.630
    6    HG3  GLU 841           HG3      GLU 841  49.261 -17.805 -20.031

  No H/Q in entry =           6
  In of MODEL   13
    1    H    THR 842           H        THR 842  48.207 -18.494 -24.108
    2    HA   THR 842           HA       THR 842  47.414 -16.535 -26.134
    3    HB   THR 842           HB       THR 842  48.796 -19.173 -26.653
    4    HG1  THR 842           HG1      THR 842  49.827 -16.790 -25.512
    5   HG21  THR 842          HG21      THR 842  49.035 -16.422 -27.900
    6   HG23  THR 842          HG22      THR 842  48.131 -17.774 -28.581
    7   HG22  THR 842          HG23      THR 842  49.888 -17.870 -28.432

  No H/Q in entry =           7
  In of MODEL   13
    1    H    GLN 843           H        GLN 843  45.796 -18.594 -24.440
    2    HA   GLN 843           HA       GLN 843  44.316 -19.812 -26.610
    3    HB2  GLN 843           HB2      GLN 843  45.024 -20.984 -23.917
    4    HB3  GLN 843           HB3      GLN 843  43.779 -21.647 -24.957
    5    HG2  GLN 843           HG2      GLN 843  46.708 -21.404 -25.637
    6    HG3  GLN 843           HG3      GLN 843  45.886 -22.880 -25.145
    7   HE21  GLN 843          HE21      GLN 843  43.478 -22.287 -26.718
    8   HE22  GLN 843          HE22      GLN 843  43.897 -22.515 -28.369

  No H/Q in entry =           8
  In of MODEL   14
    1    H1   GLY 689           H3       GLY 689  77.856  -3.802 -23.346
    2    H2   GLY 689           H2       GLY 689  77.752  -5.283 -24.159
    3    H3   GLY 689           H1       GLY 689  76.723  -3.991 -24.577
    4    HA2  GLY 689           HA2      GLY 689  76.721  -5.442 -22.022
    5    HA3  GLY 689           HA3      GLY 689  75.514  -5.564 -23.300

  No H/Q in entry =           5
  In of MODEL   14
    1    H    SER 690           H        SER 690  74.150  -4.949 -21.465
    2    HA   SER 690           HA       SER 690  72.671  -3.567 -20.557
    3    HB2  SER 690           HB2      SER 690  73.490  -1.550 -19.332
    4    HB3  SER 690           HB3      SER 690  74.471  -2.969 -19.005
    5    HG   SER 690           HG       SER 690  75.703  -1.958 -20.942

  No H/Q in entry =           5
  In of MODEL   14
    1    H    HIS 691           H        HIS 691  72.015  -0.951 -20.566
    2    HA   HIS 691           HA       HIS 691  71.430  -0.561 -23.376
    3    HB2  HIS 691           HB2      HIS 691  70.410   0.924 -20.933
    4    HB3  HIS 691           HB3      HIS 691  69.889   1.208 -22.579
    5    HD1  HIS 691           HD1      HIS 691  68.894  -0.526 -19.630
    6    HD2  HIS 691           HD2      HIS 691  68.708  -1.326 -23.706
    7    HE1  HIS 691           HE1      HIS 691  67.098  -2.217 -19.895
    8    HE2  HIS 691           HE2      HIS 691  66.819  -2.474 -22.377

  No H/Q in entry =           8
  In of MODEL   14
    1    H    MET 692           H        MET 692  72.322   1.002 -24.544
    2    HA   MET 692           HA       MET 692  74.469   2.529 -23.381
    3    HB2  MET 692           HB2      MET 692  73.363   2.516 -26.200
    4    HB3  MET 692           HB3      MET 692  74.743   3.469 -25.693
    5    HG2  MET 692           HG2      MET 692  75.586   1.553 -26.789
    6    HG3  MET 692           HG3      MET 692  75.882   1.334 -25.068
    7    HE2  MET 692           HE1      MET 692  72.696  -0.919 -27.541
    8    HE1  MET 692           HE2      MET 692  73.846   0.243 -28.206
    9    HE3  MET 692           HE3      MET 692  72.540   0.790 -27.155

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ASN 693           H        ASN 693  71.272   3.026 -24.534
    2    HA   ASN 693           HA       ASN 693  71.357   5.856 -23.776
    3    HB2  ASN 693           HB2      ASN 693  69.162   6.061 -24.872
    4    HB3  ASN 693           HB3      ASN 693  70.288   5.287 -25.976
    5   HD21  ASN 693          HD21      ASN 693  67.401   4.916 -24.105
    6   HD22  ASN 693          HD22      ASN 693  66.935   3.382 -24.709

  No H/Q in entry =           6
  In of MODEL   14
    1    HA   PRO 694           HA       PRO 694  69.344   5.012 -19.897
    2    HB2  PRO 694           HB2      PRO 694  67.275   7.049 -20.423
    3    HB3  PRO 694           HB3      PRO 694  68.466   6.985 -19.122
    4    HG2  PRO 694           HG2      PRO 694  68.702   8.754 -21.117
    5    HG3  PRO 694           HG3      PRO 694  70.123   7.965 -20.404
    6    HD2  PRO 694           HD2      PRO 694  68.710   7.366 -22.972
    7    HD3  PRO 694           HD3      PRO 694  70.454   7.415 -22.631

  No H/Q in entry =           7
  In of MODEL   14
    1    H    LEU 695           H        LEU 695  67.548   3.977 -18.998
    2    HA   LEU 695           HA       LEU 695  65.999   2.426 -20.830
    3    HB2  LEU 695           HB2      LEU 695  66.881   2.024 -18.302
    4    HB3  LEU 695           HB3      LEU 695  65.268   2.579 -17.941
    5    HG   LEU 695           HG       LEU 695  66.081   0.106 -19.446
    6   HD12  LEU 695          HD11      LEU 695  64.517   0.478 -16.913
    7   HD11  LEU 695          HD12      LEU 695  66.182  -0.083 -17.047
    8   HD13  LEU 695          HD13      LEU 695  64.868  -1.062 -17.695
    9   HD22  LEU 695          HD21      LEU 695  64.169   1.034 -20.603
   10   HD21  LEU 695          HD22      LEU 695  63.297   1.196 -19.084
   11   HD23  LEU 695          HD23      LEU 695  63.697  -0.407 -19.706

  No H/Q in entry =          11
  In of MODEL   14
    1    H    THR 696           H        THR 696  64.683   3.797 -21.980
    2    HA   THR 696           HA       THR 696  63.201   5.868 -20.828
    3    HB   THR 696           HB       THR 696  63.827   6.124 -23.120
    4    HG1  THR 696           HG1      THR 696  61.947   7.142 -22.785
    5   HG21  THR 696          HG21      THR 696  62.194   3.667 -23.760
    6   HG23  THR 696          HG22      THR 696  63.954   3.798 -23.824
    7   HG22  THR 696          HG23      THR 696  62.960   4.719 -24.950

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLN 697           H        GLN 697  62.064   2.633 -21.942
    2    HA   GLN 697           HA       GLN 697  59.595   3.209 -20.507
    3    HB2  GLN 697           HB2      GLN 697  60.349   0.833 -22.214
    4    HB3  GLN 697           HB3      GLN 697  58.854   0.928 -21.301
    5    HG2  GLN 697           HG2      GLN 697  59.716   2.697 -23.566
    6    HG3  GLN 697           HG3      GLN 697  58.466   1.453 -23.616
    7   HE21  GLN 697          HE21      GLN 697  56.513   1.835 -22.470
    8   HE22  GLN 697          HE22      GLN 697  56.019   3.434 -22.071

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ALA 698           H        ALA 698  60.767   3.340 -18.534
    2    HA   ALA 698           HA       ALA 698  61.851   0.837 -17.532
    3    HB1  ALA 698           HB1      ALA 698  61.760   3.501 -16.129
    4    HB3  ALA 698           HB2      ALA 698  63.116   2.937 -17.108
    5    HB2  ALA 698           HB3      ALA 698  62.665   2.071 -15.635

  No H/Q in entry =           5
  In of MODEL   14
    1    H    VAL 699           H        VAL 699  60.092  -0.248 -17.700
    2    HA   VAL 699           HA       VAL 699  58.116   0.144 -15.691
    3    HB   VAL 699           HB       VAL 699  57.193  -1.875 -16.672
    4   HG11  VAL 699          HG11      VAL 699  57.813   0.327 -18.653
    5   HG13  VAL 699          HG12      VAL 699  56.452   0.282 -17.531
    6   HG12  VAL 699          HG13      VAL 699  56.529  -0.860 -18.871
    7   HG23  VAL 699          HG21      VAL 699  59.431  -1.698 -18.696
    8   HG22  VAL 699          HG22      VAL 699  58.038  -2.773 -18.823
    9   HG21  VAL 699          HG23      VAL 699  59.191  -2.975 -17.504

  No H/Q in entry =           9
  In of MODEL   14
    1    HA   PRO 700           HA       PRO 700  60.467  -2.613 -13.123
    2    HB2  PRO 700           HB2      PRO 700  58.599  -3.181 -11.243
    3    HB3  PRO 700           HB3      PRO 700  59.469  -1.649 -11.314
    4    HG2  PRO 700           HG2      PRO 700  56.670  -2.266 -12.045
    5    HG3  PRO 700           HG3      PRO 700  57.379  -0.730 -11.523
    6    HD2  PRO 700           HD2      PRO 700  56.739  -1.494 -14.179
    7    HD3  PRO 700           HD3      PRO 700  57.661  -0.067 -13.669

  No H/Q in entry =           7
  In of MODEL   14
    1    H    LYS 701           H        LYS 701  60.884  -4.702 -13.064
    2    HA   LYS 701           HA       LYS 701  58.919  -6.425 -14.354
    3    HB2  LYS 701           HB2      LYS 701  61.863  -6.959 -13.872
    4    HB3  LYS 701           HB3      LYS 701  60.762  -8.076 -14.654
    5    HG2  LYS 701           HG2      LYS 701  61.920  -7.066 -16.418
    6    HG3  LYS 701           HG3      LYS 701  60.369  -6.225 -16.360
    7    HD2  LYS 701           HD2      LYS 701  61.413  -4.384 -15.128
    8    HD3  LYS 701           HD3      LYS 701  62.967  -5.222 -15.202
    9    HE2  LYS 701           HE2      LYS 701  61.350  -4.222 -17.541
   10    HE3  LYS 701           HE3      LYS 701  62.833  -3.506 -16.917
   11    HZ2  LYS 701           HZ1      LYS 701  62.583  -6.207 -18.117
   12    HZ1  LYS 701           HZ2      LYS 701  63.993  -5.573 -17.496
   13    HZ3  LYS 701           HZ3      LYS 701  63.274  -4.864 -18.844

  No H/Q in entry =          13
  In of MODEL   14
    1    H    CYS 702           H        CYS 702  57.746  -6.245 -12.407
    2    HA   CYS 702           HA       CYS 702  58.661  -8.124 -10.336
    3    HB2  CYS 702           HB2      CYS 702  56.582  -5.964  -9.929
    4    HB3  CYS 702           HB3      CYS 702  57.494  -6.842  -8.725

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLN 703           H        GLN 703  57.076  -9.646  -9.689
    2    HA   GLN 703           HA       GLN 703  55.065 -10.200 -11.631
    3    HB2  GLN 703           HB2      GLN 703  55.819 -11.453  -9.019
    4    HB3  GLN 703           HB3      GLN 703  54.413 -11.989  -9.926
    5    HG2  GLN 703           HG2      GLN 703  57.239 -11.958 -10.950
    6    HG3  GLN 703           HG3      GLN 703  56.383 -13.379 -10.349
    7   HE21  GLN 703          HE21      GLN 703  56.729 -11.150 -12.961
    8   HE22  GLN 703          HE22      GLN 703  55.720 -11.980 -14.079

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ARG 704           H        ARG 704  52.854 -10.946 -10.529
    2    HA   ARG 704           HA       ARG 704  51.592  -8.427 -10.098
    3    HB2  ARG 704           HB2      ARG 704  50.328 -11.176  -9.925
    4    HB3  ARG 704           HB3      ARG 704  49.430  -9.673  -9.928
    5    HG2  ARG 704           HG2      ARG 704  49.239 -10.166 -12.138
    6    HG3  ARG 704           HG3      ARG 704  50.798  -9.351 -12.208
    7    HD2  ARG 704           HD2      ARG 704  51.653 -11.839 -11.698
    8    HD3  ARG 704           HD3      ARG 704  50.132 -12.227 -12.464
    9    HE   ARG 704           HE       ARG 704  51.905 -10.359 -13.815
   10   HH11  ARG 704          HH11      ARG 704  50.260 -13.543 -13.963
   11   HH12  ARG 704          HH12      ARG 704  50.894 -13.912 -15.492
   12   HH21  ARG 704          HH21      ARG 704  52.703 -10.930 -15.928
   13   HH22  ARG 704          HH22      ARG 704  52.298 -12.435 -16.606

  No H/Q in entry =          13
  In of MODEL   14
    1    H    TRP 705           H        TRP 705  52.838 -10.701  -7.948
    2    HA   TRP 705           HA       TRP 705  51.372  -9.567  -5.657
    3    HB2  TRP 705           HB2      TRP 705  52.290 -11.524  -4.425
    4    HB3  TRP 705           HB3      TRP 705  51.289 -11.983  -5.799
    5    HD1  TRP 705           HD1      TRP 705  54.862 -12.066  -4.542
    6    HE1  TRP 705           HE1      TRP 705  56.233 -13.630  -5.999
    7    HE3  TRP 705           HE3      TRP 705  51.418 -12.978  -8.216
    8    HZ2  TRP 705           HZ2      TRP 705  55.907 -15.082  -8.420
    9    HZ3  TRP 705           HZ3      TRP 705  52.027 -14.456 -10.044
   10    HH2  TRP 705           HH2      TRP 705  54.226 -15.499 -10.149

  No H/Q in entry =          10
  In of MODEL   14
    1    H    GLU 706           H        GLU 706  53.832  -8.651  -7.355
    2    HA   GLU 706           HA       GLU 706  55.551  -7.997  -5.081
    3    HB2  GLU 706           HB2      GLU 706  56.319  -8.454  -7.959
    4    HB3  GLU 706           HB3      GLU 706  57.408  -7.857  -6.710
    5    HG2  GLU 706           HG2      GLU 706  57.095 -10.012  -5.540
    6    HG3  GLU 706           HG3      GLU 706  56.121 -10.564  -6.907

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LYS 707           H        LYS 707  56.726  -5.992  -5.417
    2    HA   LYS 707           HA       LYS 707  55.602  -4.106  -7.283
    3    HB2  LYS 707           HB2      LYS 707  55.117  -2.432  -5.513
    4    HB3  LYS 707           HB3      LYS 707  54.060  -3.831  -5.437
    5    HG2  LYS 707           HG2      LYS 707  55.454  -4.737  -3.602
    6    HG3  LYS 707           HG3      LYS 707  56.420  -3.264  -3.654
    7    HD2  LYS 707           HD2      LYS 707  53.441  -3.340  -3.126
    8    HD3  LYS 707           HD3      LYS 707  54.671  -3.270  -1.869
    9    HE2  LYS 707           HE2      LYS 707  54.256  -1.194  -4.033
   10    HE3  LYS 707           HE3      LYS 707  53.666  -1.071  -2.382
   11    HZ1  LYS 707           HZ1      LYS 707  56.557  -1.261  -3.113
   12    HZ3  LYS 707           HZ2      LYS 707  55.927  -1.025  -1.575
   13    HZ2  LYS 707           HZ3      LYS 707  55.736   0.157  -2.744

  No H/Q in entry =          13
  In of MODEL   14
    1    H    LEU 708           H        LEU 708  56.839  -2.160  -7.391
    2    HA   LEU 708           HA       LEU 708  59.633  -2.661  -7.188
    3    HB2  LEU 708           HB2      LEU 708  58.740  -1.522  -9.049
    4    HB3  LEU 708           HB3      LEU 708  58.048  -0.248  -8.051
    5    HG   LEU 708           HG       LEU 708  60.434   0.374  -7.441
    6   HD12  LEU 708          HD11      LEU 708  62.210  -0.362  -8.942
    7   HD11  LEU 708          HD12      LEU 708  61.089  -1.480  -9.719
    8   HD13  LEU 708          HD13      LEU 708  61.524  -1.703  -8.024
    9   HD22  LEU 708          HD21      LEU 708  59.150   1.668  -9.041
   10   HD21  LEU 708          HD22      LEU 708  59.620   0.566 -10.335
   11   HD23  LEU 708          HD23      LEU 708  60.837   1.570  -9.546

  No H/Q in entry =          11
  In of MODEL   14
    1    H    GLN 709           H        GLN 709  60.819  -2.341  -5.498
    2    HA   GLN 709           HA       GLN 709  60.171  -0.410  -3.383
    3    HB2  GLN 709           HB2      GLN 709  59.717  -2.783  -3.253
    4    HB3  GLN 709           HB3      GLN 709  61.441  -3.059  -3.378
    5    HG2  GLN 709           HG2      GLN 709  59.944  -1.659  -1.191
    6    HG3  GLN 709           HG3      GLN 709  60.468  -3.293  -1.656
    7   HE21  GLN 709          HE21      GLN 709  61.148  -1.266   0.512
    8   HE22  GLN 709          HE22      GLN 709  62.744  -1.811   0.867

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ASN 710           H        ASN 710  61.979   0.821  -3.278
    2    HA   ASN 710           HA       ASN 710  64.330   1.248  -2.947
    3    HB2  ASN 710           HB2      ASN 710  63.349  -0.926  -1.823
    4    HB3  ASN 710           HB3      ASN 710  64.462  -1.707  -2.763
    5   HD21  ASN 710          HD21      ASN 710  64.529  -1.657  -0.061
    6   HD22  ASN 710          HD22      ASN 710  66.010  -0.938   0.501

  No H/Q in entry =           6
  In of MODEL   14
    1    H    SER 711           H        SER 711  63.432   0.748  -5.745
    2    HA   SER 711           HA       SER 711  64.221   0.405  -7.809
    3    HB2  SER 711           HB2      SER 711  66.845   0.118  -6.365
    4    HB3  SER 711           HB3      SER 711  66.699   0.243  -8.132
    5    HG   SER 711           HG       SER 711  66.112   2.147  -6.113

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ARG 712           H        ARG 712  63.482  -2.088  -5.866
    2    HA   ARG 712           HA       ARG 712  64.381  -4.068  -7.822
    3    HB2  ARG 712           HB2      ARG 712  64.837  -5.629  -6.045
    4    HB3  ARG 712           HB3      ARG 712  65.787  -4.183  -5.752
    5    HG2  ARG 712           HG2      ARG 712  63.989  -3.480  -4.048
    6    HG3  ARG 712           HG3      ARG 712  63.259  -5.022  -4.389
    7    HD2  ARG 712           HD2      ARG 712  64.711  -5.044  -2.368
    8    HD3  ARG 712           HD3      ARG 712  65.132  -6.245  -3.591
    9    HE   ARG 712           HE       ARG 712  66.558  -3.731  -3.739
   10   HH11  ARG 712          HH11      ARG 712  66.607  -7.042  -2.474
   11   HH12  ARG 712          HH12      ARG 712  68.300  -7.132  -2.414
   12   HH21  ARG 712          HH21      ARG 712  68.865  -3.864  -3.647
   13   HH22  ARG 712          HH22      ARG 712  69.613  -5.281  -3.083

  No H/Q in entry =          13
  In of MODEL   14
    1    H    CYS 713           H        CYS 713  62.991  -6.178  -7.087
    2    HA   CYS 713           HA       CYS 713  60.285  -5.173  -6.653
    3    HB2  CYS 713           HB2      CYS 713  61.196  -7.688  -8.069
    4    HB3  CYS 713           HB3      CYS 713  59.519  -7.213  -7.823

  No H/Q in entry =           4
  In of MODEL   14
    1    H    VAL 714           H        VAL 714  59.533  -5.660  -4.697
    2    HA   VAL 714           HA       VAL 714  60.327  -8.197  -3.495
    3    HB   VAL 714           HB       VAL 714  60.151  -7.316  -1.259
    4   HG12  VAL 714          HG11      VAL 714  61.954  -5.674  -1.137
    5   HG11  VAL 714          HG12      VAL 714  61.863  -5.482  -2.886
    6   HG13  VAL 714          HG13      VAL 714  62.322  -7.037  -2.194
    7   HG23  VAL 714          HG21      VAL 714  59.784  -4.903  -0.790
    8   HG22  VAL 714          HG22      VAL 714  58.370  -5.744  -1.439
    9   HG21  VAL 714          HG23      VAL 714  59.332  -4.701  -2.491

  No H/Q in entry =           9
  In of MODEL   14
    1    H    CYS 715           H        CYS 715  58.441  -8.539  -1.635
    2    HA   CYS 715           HA       CYS 715  56.191  -8.899  -3.422
    3    HB2  CYS 715           HB2      CYS 715  56.258  -9.715  -0.539
    4    HB3  CYS 715           HB3      CYS 715  55.487 -10.515  -1.906

  No H/Q in entry =           4
  In of MODEL   14
    1    H    LYS 716           H        LYS 716  54.069  -8.210  -2.800
    2    HA   LYS 716           HA       LYS 716  53.893  -5.591  -1.684
    3    HB2  LYS 716           HB2      LYS 716  51.731  -7.608  -2.361
    4    HB3  LYS 716           HB3      LYS 716  51.443  -5.910  -2.030
    5    HG2  LYS 716           HG2      LYS 716  52.676  -5.275  -4.019
    6    HG3  LYS 716           HG3      LYS 716  53.119  -6.954  -4.306
    7    HD2  LYS 716           HD2      LYS 716  51.308  -6.328  -5.791
    8    HD3  LYS 716           HD3      LYS 716  50.714  -7.495  -4.614
    9    HE2  LYS 716           HE2      LYS 716  49.672  -5.718  -3.334
   10    HE3  LYS 716           HE3      LYS 716  50.356  -4.505  -4.414
   11    HZ3  LYS 716           HZ1      LYS 716  48.080  -4.898  -4.980
   12    HZ2  LYS 716           HZ2      LYS 716  48.306  -6.555  -5.170
   13    HZ1  LYS 716           HZ3      LYS 716  49.033  -5.474  -6.224

  No H/Q in entry =          13
  In of MODEL   14
    1    H    MET 717           H        MET 717  51.623  -5.620  -0.104
    2    HA   MET 717           HA       MET 717  52.463  -7.208   2.210
    3    HB2  MET 717           HB2      MET 717  50.740  -4.716   2.063
    4    HB3  MET 717           HB3      MET 717  51.057  -5.605   3.537
    5    HG2  MET 717           HG2      MET 717  53.290  -4.429   1.933
    6    HG3  MET 717           HG3      MET 717  52.365  -3.435   3.049
    7    HE3  MET 717           HE1      MET 717  53.789  -7.285   3.557
    8    HE2  MET 717           HE2      MET 717  55.348  -6.802   4.221
    9    HE1  MET 717           HE3      MET 717  54.911  -6.345   2.578

  No H/Q in entry =           9
  In of MODEL   14
    1    HA   PRO 718           HA       PRO 718  48.996  -9.750   1.161
    2    HB2  PRO 718           HB2      PRO 718  48.734 -11.113   3.526
    3    HB3  PRO 718           HB3      PRO 718  49.969 -11.479   2.316
    4    HG2  PRO 718           HG2      PRO 718  50.198  -9.880   4.834
    5    HG3  PRO 718           HG3      PRO 718  51.335 -11.056   4.148
    6    HD2  PRO 718           HD2      PRO 718  51.706  -8.394   3.924
    7    HD3  PRO 718           HD3      PRO 718  52.205  -9.524   2.648

  No H/Q in entry =           7
  In of MODEL   14
    1    H    TYR 719           H        TYR 719  48.971  -7.647   3.858
    2    HA   TYR 719           HA       TYR 719  46.155  -8.033   4.402
    3    HB2  TYR 719           HB2      TYR 719  46.505  -6.290   6.167
    4    HB3  TYR 719           HB3      TYR 719  47.491  -7.729   6.352
    5    HD1  TYR 719           HD1      TYR 719  47.513  -4.138   5.598
    6    HD2  TYR 719           HD2      TYR 719  49.914  -7.617   6.095
    7    HE1  TYR 719           HE1      TYR 719  49.527  -2.725   5.783
    8    HE2  TYR 719           HE2      TYR 719  51.921  -6.201   6.273
    9    HH   TYR 719           HH       TYR 719  52.671  -4.082   5.703

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLU 720           H        GLU 720  47.940  -6.274   2.254
    2    HA   GLU 720           HA       GLU 720  46.097  -4.033   2.098
    3    HB2  GLU 720           HB2      GLU 720  48.681  -4.781   0.822
    4    HB3  GLU 720           HB3      GLU 720  47.695  -3.503   0.108
    5    HG2  GLU 720           HG2      GLU 720  48.753  -3.566   2.927
    6    HG3  GLU 720           HG3      GLU 720  49.454  -2.648   1.588

  No H/Q in entry =           6
  In of MODEL   14
    1    H    CYS 721           H        CYS 721  46.185  -7.109   1.163
    2    HA   CYS 721           HA       CYS 721  45.288  -6.809  -1.533
    3    HB2  CYS 721           HB2      CYS 721  45.737  -9.139   0.248
    4    HB3  CYS 721           HB3      CYS 721  45.007  -9.304  -1.336

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLY 722           H        GLY 722  43.417  -5.666  -1.297
    2    HA3  GLY 722           HA2      GLY 722  41.183  -6.956   0.029
    3    HA2  GLY 722           HA3      GLY 722  41.146  -5.396  -0.790

  No H/Q in entry =           3
  In of MODEL   14
    1    HA   PRO 723           HA       PRO 723  39.348  -7.189  -4.394
    2    HB2  PRO 723           HB2      PRO 723  41.345  -5.876  -6.143
    3    HB3  PRO 723           HB3      PRO 723  39.595  -5.648  -6.087
    4    HG2  PRO 723           HG2      PRO 723  41.250  -3.774  -5.172
    5    HG3  PRO 723           HG3      PRO 723  39.718  -4.122  -4.350
    6    HD2  PRO 723           HD2      PRO 723  42.492  -4.985  -3.628
    7    HD3  PRO 723           HD3      PRO 723  41.197  -4.372  -2.581

  No H/Q in entry =           7
  In of MODEL   14
    1    H    SER 724           H        SER 724  39.777  -9.414  -4.366
    2    HA   SER 724           HA       SER 724  41.415 -10.526  -6.289
    3    HB2  SER 724           HB2      SER 724  42.778 -11.836  -4.502
    4    HB3  SER 724           HB3      SER 724  43.323 -10.227  -4.971
    5    HG   SER 724           HG       SER 724  41.763  -9.706  -3.056

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU 725           H        LEU 725  41.201 -12.857  -6.209
    2    HA   LEU 725           HA       LEU 725  38.486 -13.588  -5.472
    3    HB2  LEU 725           HB2      LEU 725  40.718 -14.935  -6.882
    4    HB3  LEU 725           HB3      LEU 725  39.342 -15.886  -6.347
    5    HG   LEU 725           HG       LEU 725  39.133 -13.508  -8.186
    6   HD11  LEU 725          HD11      LEU 725  40.534 -15.323  -9.174
    7   HD13  LEU 725          HD12      LEU 725  38.977 -15.148  -9.980
    8   HD12  LEU 725          HD13      LEU 725  39.231 -16.468  -8.837
    9   HD22  LEU 725          HD21      LEU 725  37.108 -14.103  -7.006
   10   HD21  LEU 725          HD22      LEU 725  37.296 -15.784  -7.515
   11   HD23  LEU 725          HD23      LEU 725  37.009 -14.519  -8.717

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ASP 726           H        ASP 726  37.890 -14.417  -3.576
    2    HA   ASP 726           HA       ASP 726  39.875 -15.447  -1.802
    3    HB2  ASP 726           HB2      ASP 726  36.854 -15.495  -1.561
    4    HB3  ASP 726           HB3      ASP 726  37.937 -16.165  -0.350

  No H/Q in entry =           4
  In of MODEL   14
    1    H    VAL 727           H        VAL 727  40.630 -17.376  -1.612
    2    HA   VAL 727           HA       VAL 727  39.206 -19.551  -2.889
    3    HB   VAL 727           HB       VAL 727  41.362 -20.483  -3.640
    4   HG11  VAL 727          HG11      VAL 727  40.813 -17.744  -4.761
    5   HG13  VAL 727          HG12      VAL 727  40.090 -19.266  -5.287
    6   HG12  VAL 727          HG13      VAL 727  41.810 -18.966  -5.544
    7   HG23  VAL 727          HG21      VAL 727  43.393 -19.093  -3.772
    8   HG22  VAL 727          HG22      VAL 727  42.902 -19.426  -2.110
    9   HG21  VAL 727          HG23      VAL 727  42.569 -17.851  -2.827

  No H/Q in entry =           9
  In of MODEL   14
    1    H    CYS 728           H        CYS 728  40.331 -21.721  -2.060
    2    HA   CYS 728           HA       CYS 728  40.622 -21.326   0.819
    3    HB2  CYS 728           HB2      CYS 728  39.850 -23.798  -0.723
    4    HB3  CYS 728           HB3      CYS 728  40.009 -23.692   1.020

  No H/Q in entry =           4
  In of MODEL   14
    1    H    ALA 729           H        ALA 729  42.426 -21.810   1.769
    2    HA   ALA 729           HA       ALA 729  44.390 -23.309   0.232
    3    HB3  ALA 729           HB1      ALA 729  44.990 -20.981   0.177
    4    HB2  ALA 729           HB2      ALA 729  46.097 -21.836   1.258
    5    HB1  ALA 729           HB3      ALA 729  44.776 -20.864   1.921

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLN 730           H        GLN 730  45.761 -24.520   1.540
    2    HA   GLN 730           HA       GLN 730  44.615 -25.097   4.152
    3    HB2  GLN 730           HB2      GLN 730  44.651 -26.991   2.591
    4    HB3  GLN 730           HB3      GLN 730  46.390 -26.817   2.427
    5    HG2  GLN 730           HG2      GLN 730  46.753 -27.429   4.681
    6    HG3  GLN 730           HG3      GLN 730  45.037 -27.373   5.054
    7   HE21  GLN 730          HE21      GLN 730  44.900 -29.513   5.699
    8   HE22  GLN 730          HE22      GLN 730  45.103 -30.824   4.604

  No H/Q in entry =           8
  In of MODEL   14
    1    H    ASP 731           H        ASP 731  45.621 -24.567   5.791
    2    HA   ASP 731           HA       ASP 731  48.075 -23.156   5.805
    3    HB2  ASP 731           HB2      ASP 731  46.187 -22.852   7.431
    4    HB3  ASP 731           HB3      ASP 731  46.574 -24.426   8.110

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLU 732           H        GLU 732  50.156 -23.973   6.111
    2    HA   GLU 732           HA       GLU 732  50.405 -26.824   5.970
    3    HB2  GLU 732           HB2      GLU 732  52.390 -24.591   5.911
    4    HB3  GLU 732           HB3      GLU 732  52.911 -26.267   6.043
    5    HG2  GLU 732           HG2      GLU 732  51.169 -25.179   3.847
    6    HG3  GLU 732           HG3      GLU 732  52.913 -25.414   3.728

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ARG 733           H        ARG 733  50.671 -24.491   8.462
    2    HA   ARG 733           HA       ARG 733  52.153 -26.155  10.251
    3    HB2  ARG 733           HB2      ARG 733  52.214 -23.681  10.346
    4    HB3  ARG 733           HB3      ARG 733  50.512 -23.669  10.775
    5    HG2  ARG 733           HG2      ARG 733  51.838 -23.298  12.745
    6    HG3  ARG 733           HG3      ARG 733  51.067 -24.881  12.855
    7    HD2  ARG 733           HD2      ARG 733  53.382 -25.017  13.592
    8    HD3  ARG 733           HD3      ARG 733  53.153 -25.929  12.100
    9    HE   ARG 733           HE       ARG 733  54.155 -23.191  11.917
   10   HH11  ARG 733          HH11      ARG 733  54.882 -26.649  11.742
   11   HH12  ARG 733          HH12      ARG 733  56.310 -26.449  10.849
   12   HH21  ARG 733          HH21      ARG 733  56.082 -22.899  10.748
   13   HH22  ARG 733          HH22      ARG 733  57.017 -24.241  10.245

  No H/Q in entry =          13
  In of MODEL   14
    1    H    SER 734           H        SER 734  48.823 -25.054  10.003
    2    HA   SER 734           HA       SER 734  47.954 -26.811  12.144
    3    HB2  SER 734           HB2      SER 734  47.102 -24.496  12.046
    4    HB3  SER 734           HB3      SER 734  46.455 -24.821  10.453
    5    HG   SER 734           HG       SER 734  45.642 -26.588  12.390

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LYS 735           H        LYS 735  47.779 -26.730   8.615
    2    HA   LYS 735           HA       LYS 735  46.876 -27.956   7.061
    3    HB2  LYS 735           HB2      LYS 735  46.621 -30.073   9.193
    4    HB3  LYS 735           HB3      LYS 735  46.218 -30.342   7.505
    5    HG2  LYS 735           HG2      LYS 735  48.910 -29.716   8.682
    6    HG3  LYS 735           HG3      LYS 735  48.411 -31.216   7.894
    7    HD2  LYS 735           HD2      LYS 735  48.028 -29.783   5.808
    8    HD3  LYS 735           HD3      LYS 735  48.876 -28.508   6.666
    9    HE2  LYS 735           HE2      LYS 735  49.982 -31.201   5.880
   10    HE3  LYS 735           HE3      LYS 735  50.437 -29.624   5.258
   11    HZ1  LYS 735           HZ1      LYS 735  51.295 -29.050   7.468
   12    HZ3  LYS 735           HZ2      LYS 735  52.052 -30.387   6.791
   13    HZ2  LYS 735           HZ3      LYS 735  50.914 -30.612   8.016

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ARG 736           H        ARG 736  45.260 -26.263   8.756
    2    HA   ARG 736           HA       ARG 736  42.600 -27.361   8.312
    3    HB2  ARG 736           HB2      ARG 736  41.767 -25.388   9.433
    4    HB3  ARG 736           HB3      ARG 736  43.031 -26.112  10.413
    5    HG2  ARG 736           HG2      ARG 736  44.606 -24.443   9.647
    6    HG3  ARG 736           HG3      ARG 736  43.375 -23.748   8.596
    7    HD2  ARG 736           HD2      ARG 736  43.572 -22.469  10.532
    8    HD3  ARG 736           HD3      ARG 736  42.005 -23.258  10.570
    9    HE   ARG 736           HE       ARG 736  44.239 -24.449  12.038
   10   HH11  ARG 736          HH11      ARG 736  40.995 -23.023  12.138
   11   HH12  ARG 736          HH12      ARG 736  40.838 -23.069  13.824
   12   HH21  ARG 736          HH21      ARG 736  44.045 -24.536  14.390
   13   HH22  ARG 736          HH22      ARG 736  42.630 -23.967  15.144

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ILE 737           H        ILE 737  41.164 -26.392   6.813
    2    HA   ILE 737           HA       ILE 737  42.513 -25.025   4.644
    3    HB   ILE 737           HB       ILE 737  39.564 -25.671   4.768
    4   HG12  ILE 737          HG12      ILE 737  40.864 -27.777   5.290
    5   HG13  ILE 737          HG13      ILE 737  39.934 -27.860   3.804
    6   HG22  ILE 737          HG21      ILE 737  41.470 -25.670   2.435
    7   HG21  ILE 737          HG22      ILE 737  40.713 -24.223   3.017
    8   HG23  ILE 737          HG23      ILE 737  39.703 -25.543   2.392
    9   HD11  ILE 737          HD11      ILE 737  42.896 -27.364   4.014
   10   HD13  ILE 737          HD12      ILE 737  41.950 -27.464   2.522
   11   HD12  ILE 737          HD13      ILE 737  42.117 -28.881   3.552

  No H/Q in entry =          11
  In of MODEL   14
    1    H    LEU 738           H        LEU 738  42.489 -22.845   4.662
    2    HA   LEU 738           HA       LEU 738  40.219 -21.553   5.966
    3    HB2  LEU 738           HB2      LEU 738  41.531 -19.860   6.959
    4    HB3  LEU 738           HB3      LEU 738  42.294 -21.370   7.418
    5    HG   LEU 738           HG       LEU 738  43.263 -19.373   5.367
    6   HD11  LEU 738          HD11      LEU 738  44.334 -20.110   8.077
    7   HD13  LEU 738          HD12      LEU 738  43.537 -18.599   7.635
    8   HD12  LEU 738          HD13      LEU 738  45.102 -19.009   6.936
    9   HD22  LEU 738          HD21      LEU 738  45.272 -20.713   5.210
   10   HD21  LEU 738          HD22      LEU 738  43.834 -21.612   4.717
   11   HD23  LEU 738          HD23      LEU 738  44.558 -21.924   6.298

  No H/Q in entry =          11
  In of MODEL   14
    1    HA   PRO 739           HA       PRO 739  39.916 -19.264   2.251
    2    HB2  PRO 739           HB2      PRO 739  38.762 -17.011   3.097
    3    HB3  PRO 739           HB3      PRO 739  37.877 -18.552   3.033
    4    HG2  PRO 739           HG2      PRO 739  39.088 -17.153   5.377
    5    HG3  PRO 739           HG3      PRO 739  37.558 -18.045   5.275
    6    HD2  PRO 739           HD2      PRO 739  39.893 -19.091   6.302
    7    HD3  PRO 739           HD3      PRO 739  38.592 -20.072   5.583

  No H/Q in entry =           7
  In of MODEL   14
    1    H    LEU 740           H        LEU 740  41.721 -18.660   1.438
    2    HA   LEU 740           HA       LEU 740  42.984 -16.164   2.346
    3    HB2  LEU 740           HB2      LEU 740  44.257 -18.645   1.237
    4    HB3  LEU 740           HB3      LEU 740  45.034 -17.077   1.174
    5    HG   LEU 740           HG       LEU 740  44.232 -18.521   3.702
    6   HD13  LEU 740          HD11      LEU 740  46.618 -18.784   4.025
    7   HD12  LEU 740          HD12      LEU 740  46.922 -17.995   2.473
    8   HD11  LEU 740          HD13      LEU 740  46.093 -19.552   2.525
    9   HD23  LEU 740          HD21      LEU 740  45.555 -16.743   4.807
   10   HD22  LEU 740          HD22      LEU 740  44.111 -16.123   4.015
   11   HD21  LEU 740          HD23      LEU 740  45.687 -15.914   3.251

  No H/Q in entry =          11
  In of MODEL   14
    1    H    THR 741           H        THR 741  42.962 -14.667   0.892
    2    HA   THR 741           HA       THR 741  41.673 -15.200  -1.607
    3    HB   THR 741           HB       THR 741  42.942 -12.590  -0.844
    4    HG1  THR 741           HG1      THR 741  40.527 -13.488   0.376
    5   HG21  THR 741          HG21      THR 741  41.468 -12.798  -2.812
    6   HG23  THR 741          HG22      THR 741  40.825 -11.693  -1.599
    7   HG22  THR 741          HG23      THR 741  40.162 -13.319  -1.753

  No H/Q in entry =           7
  In of MODEL   14
    1    H    VAL 742           H        VAL 742  42.617 -14.736  -3.656
    2    HA   VAL 742           HA       VAL 742  45.017 -15.886  -4.286
    3    HB   VAL 742           HB       VAL 742  43.858 -13.533  -5.749
    4   HG12  VAL 742          HG11      VAL 742  44.861 -14.449  -7.730
    5   HG11  VAL 742          HG12      VAL 742  45.673 -15.689  -6.761
    6   HG13  VAL 742          HG13      VAL 742  46.047 -13.967  -6.522
    7   HG21  VAL 742          HG21      VAL 742  43.230 -16.450  -6.036
    8   HG23  VAL 742          HG22      VAL 742  42.758 -15.159  -7.161
    9   HG22  VAL 742          HG23      VAL 742  42.176 -15.127  -5.495

  No H/Q in entry =           9
  In of MODEL   14
    1    H    CYS 743           H        CYS 743  44.537 -12.362  -4.124
    2    HA   CYS 743           HA       CYS 743  47.195 -11.693  -4.453
    3    HB2  CYS 743           HB2      CYS 743  45.373 -10.078  -4.672
    4    HB3  CYS 743           HB3      CYS 743  45.056 -10.158  -2.962

  No H/Q in entry =           4
  In of MODEL   14
    1    H    LYS 744           H        LYS 744  45.274 -12.165  -1.474
    2    HA   LYS 744           HA       LYS 744  47.220 -11.501   0.384
    3    HB2  LYS 744           HB2      LYS 744  44.927 -13.463   0.608
    4    HB3  LYS 744           HB3      LYS 744  45.977 -13.072   1.955
    5    HG2  LYS 744           HG2      LYS 744  45.247 -10.705   1.776
    6    HG3  LYS 744           HG3      LYS 744  44.117 -11.187   0.502
    7    HD2  LYS 744           HD2      LYS 744  42.950 -12.653   2.029
    8    HD3  LYS 744           HD3      LYS 744  44.148 -12.368   3.286
    9    HE2  LYS 744           HE2      LYS 744  42.151 -11.111   3.786
   10    HE3  LYS 744           HE3      LYS 744  43.444 -10.000   3.373
   11    HZ3  LYS 744           HZ1      LYS 744  42.424  -9.657   1.194
   12    HZ2  LYS 744           HZ2      LYS 744  41.322  -9.384   2.415
   13    HZ1  LYS 744           HZ3      LYS 744  41.225 -10.810   1.546

  No H/Q in entry =          13
  In of MODEL   14
    1    H    MET 745           H        MET 745  46.275 -14.789  -0.543
    2    HA   MET 745           HA       MET 745  48.368 -16.162   0.771
    3    HB2  MET 745           HB2      MET 745  47.124 -17.830   0.240
    4    HB3  MET 745           HB3      MET 745  46.048 -16.770  -0.655
    5    HG2  MET 745           HG2      MET 745  46.500 -18.399  -2.252
    6    HG3  MET 745           HG3      MET 745  47.695 -17.172  -2.602
    7    HE1  MET 745           HE1      MET 745  47.006 -20.630  -1.109
    8    HE3  MET 745           HE2      MET 745  47.701 -19.855   0.318
    9    HE2  MET 745           HE3      MET 745  48.573 -21.154  -0.499

  No H/Q in entry =           9
  In of MODEL   14
    1    H    HIS 746           H        HIS 746  48.232 -14.938  -2.666
    2    HA   HIS 746           HA       HIS 746  50.697 -16.082  -3.468
    3    HB2  HIS 746           HB2      HIS 746  48.947 -13.985  -4.479
    4    HB3  HIS 746           HB3      HIS 746  50.644 -13.617  -4.758
    5    HD1  HIS 746           HD1      HIS 746  51.900 -15.990  -5.895
    6    HD2  HIS 746           HD2      HIS 746  47.867 -15.211  -6.552
    7    HE1  HIS 746           HE1      HIS 746  51.335 -17.164  -8.020
    8    HE2  HIS 746           HE2      HIS 746  48.857 -16.833  -8.319

  No H/Q in entry =           8
  In of MODEL   14
    1    H    VAL 747           H        VAL 747  50.013 -12.889  -2.081
    2    HA   VAL 747           HA       VAL 747  52.718 -12.076  -2.059
    3    HB   VAL 747           HB       VAL 747  50.273 -11.067  -0.591
    4   HG11  VAL 747          HG11      VAL 747  52.305 -10.572   0.696
    5   HG13  VAL 747          HG12      VAL 747  51.590  -9.119   0.011
    6   HG12  VAL 747          HG13      VAL 747  53.021  -9.834  -0.735
    7   HG23  VAL 747          HG21      VAL 747  51.850  -9.951  -2.888
    8   HG22  VAL 747          HG22      VAL 747  50.397  -9.235  -2.170
    9   HG21  VAL 747          HG23      VAL 747  50.303 -10.785  -3.010

  No H/Q in entry =           9
  In of MODEL   14
    1    H    LEU 748           H        LEU 748  50.577 -13.401   0.294
    2    HA   LEU 748           HA       LEU 748  52.103 -13.691   2.581
    3    HB2  LEU 748           HB2      LEU 748  49.828 -13.982   2.700
    4    HB3  LEU 748           HB3      LEU 748  49.750 -14.834   1.211
    5    HG   LEU 748           HG       LEU 748  48.824 -16.074   2.935
    6   HD12  LEU 748          HD11      LEU 748  51.384 -17.418   2.267
    7   HD11  LEU 748          HD12      LEU 748  49.917 -17.328   1.288
    8   HD13  LEU 748          HD13      LEU 748  49.868 -18.142   2.843
    9   HD23  LEU 748          HD21      LEU 748  49.983 -16.881   4.834
   10   HD22  LEU 748          HD22      LEU 748  49.778 -15.129   4.813
   11   HD21  LEU 748          HD23      LEU 748  51.381 -15.844   4.461

  No H/Q in entry =          11
  In of MODEL   14
    1    H    HIS 749           H        HIS 749  51.872 -15.737  -0.270
    2    HA   HIS 749           HA       HIS 749  53.612 -17.815   0.497
    3    HB2  HIS 749           HB2      HIS 749  51.964 -17.894  -1.391
    4    HB3  HIS 749           HB3      HIS 749  52.966 -16.757  -2.273
    5    HD1  HIS 749           HD1      HIS 749  54.971 -17.721  -3.544
    6    HD2  HIS 749           HD2      HIS 749  52.946 -20.459  -1.209
    7    HE1  HIS 749           HE1      HIS 749  55.910 -19.928  -4.195
    8    HE2  HIS 749           HE2      HIS 749  55.003 -21.477  -2.461

  No H/Q in entry =           8
  In of MODEL   14
    1    H    CYS 750           H        CYS 750  54.041 -14.767  -1.180
    2    HA   CYS 750           HA       CYS 750  56.795 -15.168  -1.835
    3    HB2  CYS 750           HB2      CYS 750  55.181 -13.718  -3.107
    4    HB3  CYS 750           HB3      CYS 750  55.206 -12.569  -1.792

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLN 751           H        GLN 751  55.038 -13.794   0.837
    2    HA   GLN 751           HA       GLN 751  57.088 -12.473   2.237
    3    HB2  GLN 751           HB2      GLN 751  54.793 -14.072   3.395
    4    HB3  GLN 751           HB3      GLN 751  55.781 -12.929   4.274
    5    HG2  GLN 751           HG2      GLN 751  53.978 -12.237   1.973
    6    HG3  GLN 751           HG3      GLN 751  53.511 -12.097   3.654
    7   HE21  GLN 751          HE21      GLN 751  55.137 -10.705   1.035
    8   HE22  GLN 751          HE22      GLN 751  55.644  -9.243   1.797

  No H/Q in entry =           8
  In of MODEL   14
    1    H    GLY 752           H        GLY 752  56.417 -15.838   1.737
    2    HA3  GLY 752           HA2      GLY 752  58.248 -17.402   2.036
    3    HA2  GLY 752           HA3      GLY 752  58.667 -16.532   3.507

  No H/Q in entry =           3
  In of MODEL   14
    1    H    ARG 753           H        ARG 753  55.345 -16.782   3.225
    2    HA   ARG 753           HA       ARG 753  55.313 -18.785   5.318
    3    HB2  ARG 753           HB2      ARG 753  53.006 -17.257   4.088
    4    HB3  ARG 753           HB3      ARG 753  52.953 -18.204   5.571
    5    HG2  ARG 753           HG2      ARG 753  54.568 -15.688   5.142
    6    HG3  ARG 753           HG3      ARG 753  53.062 -15.808   6.051
    7    HD2  ARG 753           HD2      ARG 753  54.101 -17.205   7.699
    8    HD3  ARG 753           HD3      ARG 753  55.563 -17.351   6.726
    9    HE   ARG 753           HE       ARG 753  55.034 -14.646   7.284
   10   HH11  ARG 753          HH11      ARG 753  56.217 -17.564   8.902
   11   HH12  ARG 753          HH12      ARG 753  57.210 -16.721   9.990
   12   HH21  ARG 753          HH21      ARG 753  56.454 -13.500   8.745
   13   HH22  ARG 753          HH22      ARG 753  57.360 -14.356   9.897

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ASN 754           H        ASN 754  54.206 -20.735   5.175
    2    HA   ASN 754           HA       ASN 754  54.204 -21.729   2.416
    3    HB2  ASN 754           HB2      ASN 754  54.393 -23.362   4.945
    4    HB3  ASN 754           HB3      ASN 754  54.624 -23.931   3.299
    5   HD21  ASN 754          HD21      ASN 754  56.063 -22.550   6.039
    6   HD22  ASN 754          HD22      ASN 754  57.653 -22.370   5.409

  No H/Q in entry =           6
  In of MODEL   14
    1    H    TYR 755           H        TYR 755  52.360 -22.211   1.528
    2    HA   TYR 755           HA       TYR 755  50.205 -23.310   3.095
    3    HB2  TYR 755           HB2      TYR 755  50.113 -20.740   1.605
    4    HB3  TYR 755           HB3      TYR 755  48.654 -21.702   1.632
    5    HD1  TYR 755           HD1      TYR 755  47.525 -22.108   3.763
    6    HD2  TYR 755           HD2      TYR 755  50.927 -19.628   3.517
    7    HE1  TYR 755           HE1      TYR 755  47.020 -21.200   5.981
    8    HE2  TYR 755           HE2      TYR 755  50.436 -18.682   5.672
    9    HH   TYR 755           HH       TYR 755  48.170 -20.221   7.760

  No H/Q in entry =           9
  In of MODEL   14
    1    H    THR 756           H        THR 756  48.777 -24.509   1.894
    2    HA   THR 756           HA       THR 756  49.680 -25.237  -0.795
    3    HB   THR 756           HB       THR 756  48.219 -26.763   1.380
    4    HG1  THR 756           HG1      THR 756  50.189 -27.256   1.942
    5   HG23  THR 756          HG21      THR 756  48.313 -28.713  -0.076
    6   HG22  THR 756          HG22      THR 756  49.094 -27.743  -1.338
    7   HG21  THR 756          HG23      THR 756  47.429 -27.397  -0.858

  No H/Q in entry =           7
  In of MODEL   14
    1    H    LEU 757           H        LEU 757  47.931 -25.420  -2.395
    2    HA   LEU 757           HA       LEU 757  45.608 -23.946  -1.487
    3    HB2  LEU 757           HB2      LEU 757  46.551 -24.471  -4.285
    4    HB3  LEU 757           HB3      LEU 757  45.039 -23.673  -3.893
    5    HG   LEU 757           HG       LEU 757  46.857 -22.265  -2.436
    6   HD11  LEU 757          HD11      LEU 757  48.741 -23.323  -3.460
    7   HD13  LEU 757          HD12      LEU 757  48.647 -21.627  -3.941
    8   HD12  LEU 757          HD13      LEU 757  48.152 -22.889  -5.068
    9   HD22  LEU 757          HD21      LEU 757  45.004 -21.369  -3.610
   10   HD21  LEU 757          HD22      LEU 757  45.767 -21.696  -5.175
   11   HD23  LEU 757          HD23      LEU 757  46.467 -20.504  -4.069

  No H/Q in entry =          11
  In of MODEL   14
    1    H    THR 758           H        THR 758  43.509 -24.552  -2.015
    2    HA   THR 758           HA       THR 758  43.143 -27.374  -2.566
    3    HB   THR 758           HB       THR 758  41.535 -27.434  -0.571
    4    HG1  THR 758           HG1      THR 758  42.493 -24.898  -0.396
    5   HG23  THR 758          HG21      THR 758  43.307 -27.909   1.071
    6   HG22  THR 758          HG22      THR 758  44.474 -27.047   0.085
    7   HG21  THR 758          HG23      THR 758  43.763 -28.546  -0.509

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLY 759           H        GLY 759  40.544 -27.664  -2.461
    2    HA3  GLY 759           HA2      GLY 759  39.586 -25.926  -4.510
    3    HA2  GLY 759           HA3      GLY 759  38.701 -27.249  -3.773

  No H/Q in entry =           3
  In of MODEL   14
    1    H    ARG 760           H        ARG 760  37.716 -24.666  -4.461
    2    HA   ARG 760           HA       ARG 760  37.567 -22.804  -2.349
    3    HB2  ARG 760           HB2      ARG 760  35.782 -21.732  -3.657
    4    HB3  ARG 760           HB3      ARG 760  37.125 -22.210  -4.682
    5    HG2  ARG 760           HG2      ARG 760  35.285 -22.814  -5.967
    6    HG3  ARG 760           HG3      ARG 760  35.698 -24.326  -5.162
    7    HD2  ARG 760           HD2      ARG 760  33.969 -23.632  -3.389
    8    HD3  ARG 760           HD3      ARG 760  33.420 -22.448  -4.573
    9    HE   ARG 760           HE       ARG 760  33.614 -25.174  -5.502
   10   HH11  ARG 760          HH11      ARG 760  31.444 -22.641  -4.248
   11   HH12  ARG 760          HH12      ARG 760  30.033 -23.505  -4.614
   12   HH21  ARG 760          HH21      ARG 760  31.656 -26.369  -5.919
   13   HH22  ARG 760          HH22      ARG 760  30.144 -25.682  -5.573

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ASP 761           H        ASP 761  36.091 -25.768  -2.621
    2    HA   ASP 761           HA       ASP 761  33.802 -25.055  -0.958
    3    HB2  ASP 761           HB2      ASP 761  33.321 -26.420  -2.902
    4    HB3  ASP 761           HB3      ASP 761  34.519 -27.602  -2.420

  No H/Q in entry =           4
  In of MODEL   14
    1    H    SER 762           H        SER 762  36.978 -26.157  -0.553
    2    HA   SER 762           HA       SER 762  36.479 -27.959   1.597
    3    HB2  SER 762           HB2      SER 762  39.052 -26.628   0.743
    4    HB3  SER 762           HB3      SER 762  38.919 -27.989   1.854
    5    HG   SER 762           HG       SER 762  37.551 -28.575  -0.332

  No H/Q in entry =           5
  In of MODEL   14
    1    H    CYS 763           H        CYS 763  37.124 -24.473   1.411
    2    HA   CYS 763           HA       CYS 763  37.213 -24.432   4.345
    3    HB2  CYS 763           HB2      CYS 763  38.175 -22.237   4.211
    4    HB3  CYS 763           HB3      CYS 763  39.093 -23.271   3.133

  No H/Q in entry =           4
  In of MODEL   14
    1    H    THR 764           H        THR 764  36.117 -22.380   5.214
    2    HA   THR 764           HA       THR 764  33.535 -22.146   3.931
    3    HB   THR 764           HB       THR 764  34.497 -20.929   6.541
    4    HG1  THR 764           HG1      THR 764  33.113 -23.395   6.057
    5   HG23  THR 764          HG21      THR 764  32.089 -20.810   7.059
    6   HG22  THR 764          HG22      THR 764  31.717 -21.527   5.492
    7   HG21  THR 764          HG23      THR 764  32.457 -19.927   5.576

  No H/Q in entry =           7
  In of MODEL   14
    1    H    LEU 765           H        LEU 765  33.770 -20.913   2.248
    2    HA   LEU 765           HA       LEU 765  35.586 -18.681   2.237
    3    HB2  LEU 765           HB2      LEU 765  34.988 -20.518   0.418
    4    HB3  LEU 765           HB3      LEU 765  33.701 -19.377   0.070
    5    HG   LEU 765           HG       LEU 765  35.367 -17.651  -0.451
    6   HD12  LEU 765          HD11      LEU 765  37.730 -18.341  -0.646
    7   HD11  LEU 765          HD12      LEU 765  37.303 -19.868   0.149
    8   HD13  LEU 765          HD13      LEU 765  37.142 -18.351   1.018
    9   HD22  LEU 765          HD21      LEU 765  34.514 -19.107  -2.217
   10   HD21  LEU 765          HD22      LEU 765  35.792 -20.272  -1.870
   11   HD23  LEU 765          HD23      LEU 765  36.202 -18.679  -2.501

  No H/Q in entry =          11
  In of MODEL   14
    1    HA   PRO 766           HA       PRO 766  32.329 -15.789   3.216
    2    HB2  PRO 766           HB2      PRO 766  33.332 -13.556   1.945
    3    HB3  PRO 766           HB3      PRO 766  33.838 -14.108   3.543
    4    HG2  PRO 766           HG2      PRO 766  35.173 -14.464   0.905
    5    HG3  PRO 766           HG3      PRO 766  35.894 -14.188   2.501
    6    HD2  PRO 766           HD2      PRO 766  35.828 -16.618   1.292
    7    HD3  PRO 766           HD3      PRO 766  35.807 -16.442   3.049

  No H/Q in entry =           7
  In of MODEL   14
    1    H    ALA 767           H        ALA 767  33.469 -16.067  -0.088
    2    HA   ALA 767           HA       ALA 767  30.724 -15.574  -0.967
    3    HB1  ALA 767           HB1      ALA 767  32.036 -13.558  -1.421
    4    HB3  ALA 767           HB2      ALA 767  31.463 -14.343  -2.894
    5    HB2  ALA 767           HB3      ALA 767  33.151 -14.519  -2.402

  No H/Q in entry =           5
  In of MODEL   14
    1    H    SER 768           H        SER 768  30.228 -17.603  -1.330
    2    HA   SER 768           HA       SER 768  31.503 -18.813  -3.661
    3    HB2  SER 768           HB2      SER 768  32.199 -20.082  -1.602
    4    HB3  SER 768           HB3      SER 768  30.500 -20.353  -1.234
    5    HG   SER 768           HG       SER 768  30.616 -21.991  -2.394

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA 769           H        ALA 769  28.632 -19.470  -1.582
    2    HA   ALA 769           HA       ALA 769  27.034 -19.388  -4.030
    3    HB1  ALA 769           HB1      ALA 769  26.848 -21.467  -2.725
    4    HB2  ALA 769           HB2      ALA 769  25.325 -20.579  -2.760
    5    HB3  ALA 769           HB3      ALA 769  26.337 -20.532  -1.315

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLU 770           H        GLU 770  25.396 -17.966  -4.218
    2    HA   GLU 770           HA       GLU 770  24.288 -16.051  -4.046
    3    HB2  GLU 770           HB2      GLU 770  24.571 -16.516  -1.094
    4    HB3  GLU 770           HB3      GLU 770  23.599 -15.222  -1.794
    5    HG2  GLU 770           HG2      GLU 770  22.247 -16.922  -2.935
    6    HG3  GLU 770           HG3      GLU 770  23.197 -18.177  -2.139

  No H/Q in entry =           6
  In of MODEL   14
    1    H    LYS 771           H        LYS 771  25.193 -14.315  -4.786
    2    HA   LYS 771           HA       LYS 771  27.677 -13.529  -3.589
    3    HB2  LYS 771           HB2      LYS 771  26.539 -11.977  -5.896
    4    HB3  LYS 771           HB3      LYS 771  28.188 -12.431  -5.562
    5    HG2  LYS 771           HG2      LYS 771  26.075 -14.350  -6.519
    6    HG3  LYS 771           HG3      LYS 771  27.282 -13.576  -7.532
    7    HD2  LYS 771           HD2      LYS 771  28.974 -14.930  -6.747
    8    HD3  LYS 771           HD3      LYS 771  28.186 -15.164  -5.175
    9    HE2  LYS 771           HE2      LYS 771  26.646 -16.580  -5.979
   10    HE3  LYS 771           HE3      LYS 771  26.915 -16.200  -7.688
   11    HZ2  LYS 771           HZ1      LYS 771  28.665 -17.838  -5.871
   12    HZ1  LYS 771           HZ2      LYS 771  29.100 -17.343  -7.438
   13    HZ3  LYS 771           HZ3      LYS 771  27.779 -18.348  -7.214

  No H/Q in entry =          13
  In of MODEL   14
    1    H    ALA 772           H        ALA 772  27.793 -11.382  -2.540
    2    HA   ALA 772           HA       ALA 772  25.462  -9.696  -2.565
    3    HB2  ALA 772           HB1      ALA 772  24.802 -11.383  -0.907
    4    HB1  ALA 772           HB2      ALA 772  25.065  -9.811  -0.151
    5    HB3  ALA 772           HB3      ALA 772  26.285 -11.075  -0.004

  No H/Q in entry =           5
  In of MODEL   14
    1    H    CYS 773           H        CYS 773  25.808  -7.768  -1.246
    2    HA   CYS 773           HA       CYS 773  28.231  -6.482  -1.578
    3    HB2  CYS 773           HB2      CYS 773  26.403  -5.969   0.760
    4    HB3  CYS 773           HB3      CYS 773  27.386  -4.811  -0.127

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLY 774           H        GLY 774  30.101  -6.477  -0.422
    2    HA3  GLY 774           HA2      GLY 774  30.948  -6.546   1.941
    3    HA2  GLY 774           HA3      GLY 774  30.166  -8.122   2.017

  No H/Q in entry =           3
  In of MODEL   14
    1    H    ALA 775           H        ALA 775  30.896  -8.665  -0.821
    2    HA   ALA 775           HA       ALA 775  33.740  -8.390  -0.961
    3    HB1  ALA 775           HB1      ALA 775  34.246 -10.783  -1.107
    4    HB3  ALA 775           HB2      ALA 775  32.565 -11.167  -0.739
    5    HB2  ALA 775           HB3      ALA 775  33.574 -10.377   0.473

  No H/Q in entry =           5
  In of MODEL   14
    1    H    CYS 776           H        CYS 776  33.471  -7.409  -2.824
    2    HA   CYS 776           HA       CYS 776  33.806  -8.620  -5.175
    3    HB2  CYS 776           HB2      CYS 776  31.600  -8.277  -6.436
    4    HB3  CYS 776           HB3      CYS 776  31.599  -9.619  -5.311

  No H/Q in entry =           4
  In of MODEL   14
    1    HA   PRO 777           HA       PRO 777  34.089  -4.144  -5.713
    2    HB2  PRO 777           HB2      PRO 777  36.743  -3.852  -5.568
    3    HB3  PRO 777           HB3      PRO 777  35.737  -3.962  -4.123
    4    HG2  PRO 777           HG2      PRO 777  37.580  -5.960  -5.284
    5    HG3  PRO 777           HG3      PRO 777  37.050  -5.772  -3.612
    6    HD2  PRO 777           HD2      PRO 777  36.020  -7.641  -5.558
    7    HD3  PRO 777           HD3      PRO 777  35.466  -7.369  -3.904

  No H/Q in entry =           7
  In of MODEL   14
    1    H    LEU 778           H        LEU 778  36.002  -6.687  -7.278
    2    HA   LEU 778           HA       LEU 778  36.660  -4.876  -9.480
    3    HB2  LEU 778           HB2      LEU 778  38.285  -6.581 -10.275
    4    HB3  LEU 778           HB3      LEU 778  38.578  -5.950  -8.657
    5    HG   LEU 778           HG       LEU 778  37.192  -8.581  -8.961
    6   HD11  LEU 778          HD11      LEU 778  39.217  -8.703 -10.383
    7   HD13  LEU 778          HD12      LEU 778  39.317  -9.679  -8.914
    8   HD12  LEU 778          HD13      LEU 778  40.185  -8.140  -9.004
    9   HD23  LEU 778          HD21      LEU 778  39.184  -7.540  -6.983
   10   HD22  LEU 778          HD22      LEU 778  38.207  -9.006  -6.853
   11   HD21  LEU 778          HD23      LEU 778  37.443  -7.414  -6.794

  No H/Q in entry =          11
  In of MODEL   14
    1    H    TRP 779           H        TRP 779  34.947  -7.906  -9.015
    2    HA   TRP 779           HA       TRP 779  34.375  -7.956 -11.877
    3    HB2  TRP 779           HB2      TRP 779  33.428 -10.250 -11.375
    4    HB3  TRP 779           HB3      TRP 779  35.163 -10.077 -11.153
    5    HD1  TRP 779           HD1      TRP 779  31.914 -10.261  -9.011
    6    HE1  TRP 779           HE1      TRP 779  32.565 -11.175  -6.698
    7    HE3  TRP 779           HE3      TRP 779  36.955 -10.547  -9.645
    8    HZ2  TRP 779           HZ2      TRP 779  34.962 -11.924  -5.329
    9    HZ3  TRP 779           HZ3      TRP 779  38.336 -11.373  -7.799
   10    HH2  TRP 779           HH2      TRP 779  37.335 -12.040  -5.692

  No H/Q in entry =          10
  In of MODEL   14
    1    H    GLY 780           H        GLY 780  33.124  -6.482  -9.348
    2    HA3  GLY 780           HA2      GLY 780  30.656  -5.985 -10.410
    3    HA2  GLY 780           HA3      GLY 780  30.463  -7.327  -9.276

  No H/Q in entry =           3
  In of MODEL   14
    1    H    LYS 781           H        LYS 781  29.134  -5.389  -8.348
    2    HA   LYS 781           HA       LYS 781  30.634  -4.515  -6.075
    3    HB2  LYS 781           HB2      LYS 781  30.394  -2.192  -6.336
    4    HB3  LYS 781           HB3      LYS 781  31.337  -2.827  -7.676
    5    HG2  LYS 781           HG2      LYS 781  29.386  -2.653  -9.146
    6    HG3  LYS 781           HG3      LYS 781  28.421  -2.054  -7.796
    7    HD2  LYS 781           HD2      LYS 781  30.848  -0.722  -8.990
    8    HD3  LYS 781           HD3      LYS 781  29.173  -0.203  -9.180
    9    HE2  LYS 781           HE2      LYS 781  29.017   0.186  -6.765
   10    HE3  LYS 781           HE3      LYS 781  30.679  -0.365  -6.575
   11    HZ3  LYS 781           HZ1      LYS 781  31.429   1.486  -7.914
   12    HZ2  LYS 781           HZ2      LYS 781  30.539   2.056  -6.620
   13    HZ1  LYS 781           HZ3      LYS 781  29.852   2.022  -8.137

  No H/Q in entry =          13
  In of MODEL   14
    1    H    CYS 782           H        CYS 782  29.258  -2.847  -4.851
    2    HA   CYS 782           HA       CYS 782  26.398  -3.323  -5.059
    3    HB2  CYS 782           HB2      CYS 782  27.252  -4.858  -3.314
    4    HB3  CYS 782           HB3      CYS 782  28.142  -3.539  -2.571

  No H/Q in entry =           4
  In of MODEL   14
    1    H    ASP 783           H        ASP 783  25.256  -1.436  -4.235
    2    HA   ASP 783           HA       ASP 783  26.833   1.006  -4.327
    3    HB2  ASP 783           HB2      ASP 783  23.855   0.559  -3.964
    4    HB3  ASP 783           HB3      ASP 783  24.582   2.151  -3.929

  No H/Q in entry =           4
  In of MODEL   14
    1    H    ALA 784           H        ALA 784  25.605   2.647  -2.580
    2    HA   ALA 784           HA       ALA 784  26.672   1.892  -0.046
    3    HB1  ALA 784           HB1      ALA 784  25.928   4.093   0.687
    4    HB3  ALA 784           HB2      ALA 784  24.965   4.272  -0.780
    5    HB2  ALA 784           HB3      ALA 784  26.723   4.207  -0.883

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLU 785           H        GLU 785  24.109   0.730  -1.409
    2    HA   GLU 785           HA       GLU 785  22.419   0.573   0.998
    3    HB2  GLU 785           HB2      GLU 785  21.715  -0.095  -1.868
    4    HB3  GLU 785           HB3      GLU 785  20.622  -0.065  -0.495
    5    HG2  GLU 785           HG2      GLU 785  20.836   2.331  -0.348
    6    HG3  GLU 785           HG3      GLU 785  22.012   2.322  -1.665

  No H/Q in entry =           6
  In of MODEL   14
    1    H    SER 786           H        SER 786  22.801  -1.380   1.975
    2    HA   SER 786           HA       SER 786  24.249  -3.396   0.514
    3    HB2  SER 786           HB2      SER 786  23.261  -3.368   3.370
    4    HB3  SER 786           HB3      SER 786  24.406  -4.517   2.679
    5    HG   SER 786           HG       SER 786  24.751  -1.721   3.008

  No H/Q in entry =           5
  In of MODEL   14
    1    H    SER 787           H        SER 787  23.080  -4.598  -0.850
    2    HA   SER 787           HA       SER 787  20.841  -6.076   0.227
    3    HB2  SER 787           HB2      SER 787  19.849  -4.022  -0.726
    4    HB3  SER 787           HB3      SER 787  20.588  -4.388  -2.281
    5    HG   SER 787           HG       SER 787  18.511  -5.683  -0.923

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LYS 788           H        LYS 788  22.588  -5.447  -2.895
    2    HA   LYS 788           HA       LYS 788  23.032  -8.312  -3.149
    3    HB2  LYS 788           HB2      LYS 788  22.119  -8.380  -5.376
    4    HB3  LYS 788           HB3      LYS 788  20.878  -7.798  -4.265
    5    HG2  LYS 788           HG2      LYS 788  21.327  -5.503  -4.976
    6    HG3  LYS 788           HG3      LYS 788  22.577  -6.098  -6.068
    7    HD2  LYS 788           HD2      LYS 788  20.849  -7.382  -7.277
    8    HD3  LYS 788           HD3      LYS 788  19.623  -6.662  -6.228
    9    HE2  LYS 788           HE2      LYS 788  21.486  -5.199  -8.101
   10    HE3  LYS 788           HE3      LYS 788  19.757  -5.428  -8.322
   11    HZ1  LYS 788           HZ1      LYS 788  19.429  -4.115  -6.252
   12    HZ3  LYS 788           HZ2      LYS 788  20.173  -3.233  -7.483
   13    HZ2  LYS 788           HZ3      LYS 788  21.087  -3.807  -6.205

  No H/Q in entry =          13
  In of MODEL   14
    1    H    CYS 789           H        CYS 789  24.406  -8.662  -5.176
    2    HA   CYS 789           HA       CYS 789  26.191  -6.394  -5.645
    3    HB2  CYS 789           HB2      CYS 789  27.327  -7.999  -4.199
    4    HB3  CYS 789           HB3      CYS 789  26.901  -9.317  -5.278

  No H/Q in entry =           4
  In of MODEL   14
    1    H    VAL 790           H        VAL 790  26.353  -5.908  -7.723
    2    HA   VAL 790           HA       VAL 790  25.290  -7.854  -9.629
    3    HB   VAL 790           HB       VAL 790  24.103  -5.706  -9.661
    4   HG11  VAL 790          HG11      VAL 790  26.749  -4.528 -10.446
    5   HG13  VAL 790          HG12      VAL 790  25.872  -4.200  -8.946
    6   HG12  VAL 790          HG13      VAL 790  25.220  -3.649 -10.502
    7   HG21  VAL 790          HG21      VAL 790  25.741  -6.190 -12.141
    8   HG23  VAL 790          HG22      VAL 790  24.273  -5.215 -12.084
    9   HG22  VAL 790          HG23      VAL 790  24.196  -6.944 -11.735

  No H/Q in entry =           9
  In of MODEL   14
    1    H    CYS 791           H        CYS 791  26.523  -8.646 -11.062
    2    HA   CYS 791           HA       CYS 791  29.350  -7.848 -11.007
    3    HB2  CYS 791           HB2      CYS 791  28.162 -10.558 -11.445
    4    HB3  CYS 791           HB3      CYS 791  29.881 -10.159 -11.533

  No H/Q in entry =           4
  In of MODEL   14
    1    H    ARG 792           H        ARG 792  30.602  -7.995 -12.643
    2    HA   ARG 792           HA       ARG 792  29.439  -7.103 -15.170
    3    HB2  ARG 792           HB2      ARG 792  32.344  -7.246 -14.383
    4    HB3  ARG 792           HB3      ARG 792  31.598  -6.226 -15.593
    5    HG2  ARG 792           HG2      ARG 792  31.218  -5.942 -12.625
    6    HG3  ARG 792           HG3      ARG 792  32.345  -4.987 -13.595
    7    HD2  ARG 792           HD2      ARG 792  30.386  -4.174 -14.879
    8    HD3  ARG 792           HD3      ARG 792  29.352  -5.065 -13.752
    9    HE   ARG 792           HE       ARG 792  31.245  -3.279 -12.523
   10   HH11  ARG 792          HH11      ARG 792  27.908  -3.664 -13.619
   11   HH12  ARG 792          HH12      ARG 792  27.357  -2.263 -12.828
   12   HH21  ARG 792          HH21      ARG 792  30.556  -1.501 -11.471
   13   HH22  ARG 792          HH22      ARG 792  28.913  -0.960 -11.536

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLU 793           H        GLU 793  30.927  -7.923 -17.036
    2    HA   GLU 793           HA       GLU 793  31.582 -10.703 -16.521
    3    HB2  GLU 793           HB2      GLU 793  30.817  -9.423 -19.158
    4    HB3  GLU 793           HB3      GLU 793  31.345 -11.094 -18.976
    5    HG2  GLU 793           HG2      GLU 793  29.453 -11.429 -17.374
    6    HG3  GLU 793           HG3      GLU 793  28.880  -9.828 -17.828

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ALA 794           H        ALA 794  33.281 -11.237 -18.635
    2    HA   ALA 794           HA       ALA 794  35.636 -10.420 -17.306
    3    HB3  ALA 794           HB1      ALA 794  36.790 -11.849 -18.808
    4    HB1  ALA 794           HB2      ALA 794  35.424 -11.857 -19.921
    5    HB2  ALA 794           HB3      ALA 794  35.272 -12.625 -18.340

  No H/Q in entry =           5
  In of MODEL   14
    1    H    SER 795           H        SER 795  33.924  -8.943 -19.821
    2    HA   SER 795           HA       SER 795  36.350  -7.739 -20.806
    3    HB2  SER 795           HB2      SER 795  33.553  -7.513 -21.900
    4    HB3  SER 795           HB3      SER 795  35.037  -6.980 -22.696
    5    HG   SER 795           HG       SER 795  33.931  -9.434 -22.545

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLU 796           H        GLU 796  34.428  -7.144 -18.296
    2    HA   GLU 796           HA       GLU 796  34.812  -4.267 -18.495
    3    HB2  GLU 796           HB2      GLU 796  32.451  -4.781 -19.113
    4    HB3  GLU 796           HB3      GLU 796  32.247  -5.588 -17.566
    5    HG2  GLU 796           HG2      GLU 796  32.540  -3.483 -16.398
    6    HG3  GLU 796           HG3      GLU 796  32.868  -2.659 -17.919

  No H/Q in entry =           6
  In of MODEL   14
    1    H    CYS 797           H        CYS 797  36.538  -5.864 -17.272
    2    HA   CYS 797           HA       CYS 797  36.020  -6.236 -14.485
    3    HB2  CYS 797           HB2      CYS 797  38.710  -5.872 -15.840
    4    HB3  CYS 797           HB3      CYS 797  38.359  -6.559 -14.252

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLU 798           H        GLU 798  36.030  -4.645 -12.916
    2    HA   GLU 798           HA       GLU 798  36.846  -1.994 -13.775
    3    HB2  GLU 798           HB2      GLU 798  35.378  -2.844 -11.267
    4    HB3  GLU 798           HB3      GLU 798  35.665  -1.177 -11.768
    5    HG2  GLU 798           HG2      GLU 798  34.409  -1.689 -13.875
    6    HG3  GLU 798           HG3      GLU 798  33.981  -3.241 -13.171

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU 799           H        GLU 799  38.569  -4.300 -12.879
    2    HA   GLU 799           HA       GLU 799  40.701  -2.796 -11.830
    3    HB2  GLU 799           HB2      GLU 799  39.592  -3.139  -9.677
    4    HB3  GLU 799           HB3      GLU 799  39.340  -4.829 -10.053
    5    HG2  GLU 799           HG2      GLU 799  41.087  -4.546  -8.372
    6    HG3  GLU 799           HG3      GLU 799  41.739  -5.250  -9.844

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLU 800           H        GLU 800  42.640  -4.146 -11.844
    2    HA   GLU 800           HA       GLU 800  42.326  -6.398 -13.654
    3    HB2  GLU 800           HB2      GLU 800  44.650  -4.484 -13.447
    4    HB3  GLU 800           HB3      GLU 800  44.550  -5.867 -14.527
    5    HG2  GLU 800           HG2      GLU 800  42.634  -4.806 -15.657
    6    HG3  GLU 800           HG3      GLU 800  42.826  -3.402 -14.604

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLY 801           H        GLY 801  42.121  -7.662 -12.055
    2    HA3  GLY 801           HA2      GLY 801  43.977  -7.987  -9.910
    3    HA2  GLY 801           HA3      GLY 801  42.694  -9.107 -10.304

  No H/Q in entry =           3
  In of MODEL   14
    1    H    PHE 802           H        PHE 802  44.228 -10.680  -9.710
    2    HA   PHE 802           HA       PHE 802  46.672 -11.149 -11.085
    3    HB2  PHE 802           HB2      PHE 802  45.009 -12.784  -9.219
    4    HB3  PHE 802           HB3      PHE 802  46.426 -13.467 -10.005
    5    HD1  PHE 802           HD1      PHE 802  45.293 -10.727  -7.785
    6    HD2  PHE 802           HD2      PHE 802  48.551 -13.050  -9.185
    7    HE1  PHE 802           HE1      PHE 802  46.709  -9.748  -6.097
    8    HE2  PHE 802           HE2      PHE 802  49.977 -12.065  -7.484
    9    HZ   PHE 802           HZ       PHE 802  49.073 -10.404  -5.921

  No H/Q in entry =           9
  In of MODEL   14
    1    H    SER 803           H        SER 803  47.026 -13.504 -11.909
    2    HA   SER 803           HA       SER 803  44.944 -14.249 -13.774
    3    HB2  SER 803           HB2      SER 803  47.253 -15.136 -14.917
    4    HB3  SER 803           HB3      SER 803  46.519 -13.570 -15.286
    5    HG   SER 803           HG       SER 803  47.930 -12.565 -14.101

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ILE 804           H        ILE 804  44.194 -16.231 -13.320
    2    HA   ILE 804           HA       ILE 804  45.887 -18.047 -11.754
    3    HB   ILE 804           HB       ILE 804  44.092 -18.706 -10.310
    4   HG12  ILE 804          HG12      ILE 804  42.174 -18.499 -11.906
    5   HG13  ILE 804          HG13      ILE 804  41.816 -17.822 -10.329
    6   HG23  ILE 804          HG21      ILE 804  43.625 -16.665  -9.033
    7   HG22  ILE 804          HG22      ILE 804  44.180 -15.705 -10.400
    8   HG21  ILE 804          HG23      ILE 804  45.310 -16.759  -9.555
    9   HD13  ILE 804          HD11      ILE 804  40.889 -16.445 -12.061
   10   HD12  ILE 804          HD12      ILE 804  42.446 -16.320 -12.861
   11   HD11  ILE 804          HD13      ILE 804  42.206 -15.564 -11.282

  No H/Q in entry =          11
  In of MODEL   14
    1    H    CYS 805           H        CYS 805  44.656 -20.281 -11.631
    2    HA   CYS 805           HA       CYS 805  43.786 -20.957 -14.366
    3    HB2  CYS 805           HB2      CYS 805  45.936 -21.958 -13.685
    4    HB3  CYS 805           HB3      CYS 805  45.150 -22.650 -12.272

  No H/Q in entry =           4
  In of MODEL   14
    1    H    VAL 806           H        VAL 806  41.833 -21.740 -14.544
    2    HA   VAL 806           HA       VAL 806  40.616 -22.873 -12.197
    3    HB   VAL 806           HB       VAL 806  39.935 -20.513 -12.303
    4   HG13  VAL 806          HG11      VAL 806  38.588 -19.657 -14.114
    5   HG12  VAL 806          HG12      VAL 806  38.887 -21.159 -15.001
    6   HG11  VAL 806          HG13      VAL 806  40.231 -20.087 -14.606
    7   HG22  VAL 806          HG21      VAL 806  38.313 -22.124 -11.444
    8   HG21  VAL 806          HG22      VAL 806  37.758 -22.414 -13.075
    9   HG23  VAL 806          HG23      VAL 806  37.503 -20.823 -12.328

  No H/Q in entry =           9
  In of MODEL   14
    1    H    GLU 807           H        GLU 807  39.448 -24.617 -12.633
    2    HA   GLU 807           HA       GLU 807  39.588 -25.644 -15.300
    3    HB2  GLU 807           HB2      GLU 807  40.080 -27.021 -13.263
    4    HB3  GLU 807           HB3      GLU 807  38.391 -26.875 -12.824
    5    HG2  GLU 807           HG2      GLU 807  37.718 -28.040 -14.779
    6    HG3  GLU 807           HG3      GLU 807  39.398 -28.101 -15.349

  No H/Q in entry =           6
  In of MODEL   14
    1    H    VAL 808           H        VAL 808  38.091 -25.516 -16.693
    2    HA   VAL 808           HA       VAL 808  35.303 -25.112 -16.033
    3    HB   VAL 808           HB       VAL 808  36.321 -22.838 -16.117
    4   HG12  VAL 808          HG11      VAL 808  37.062 -23.484 -18.941
    5   HG11  VAL 808          HG12      VAL 808  38.155 -23.225 -17.586
    6   HG13  VAL 808          HG13      VAL 808  37.170 -21.891 -18.192
    7   HG21  VAL 808          HG21      VAL 808  34.460 -23.406 -18.418
    8   HG23  VAL 808          HG22      VAL 808  34.856 -21.804 -17.806
    9   HG22  VAL 808          HG23      VAL 808  33.997 -22.954 -16.767

  No H/Q in entry =           9
  In of MODEL   14
    1    H    ASN 809           H        ASN 809  34.037 -25.984 -17.706
    2    HA   ASN 809           HA       ASN 809  33.484 -27.130 -19.609
    3    HB2  ASN 809           HB2      ASN 809  35.850 -25.592 -20.503
    4    HB3  ASN 809           HB3      ASN 809  35.121 -26.740 -21.651
    5   HD21  ASN 809          HD21      ASN 809  35.078 -23.674 -20.186
    6   HD22  ASN 809          HD22      ASN 809  33.660 -23.052 -20.927

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLY 810           H        GLY 810  35.609 -28.150 -17.598
    2    HA3  GLY 810           HA2      GLY 810  36.523 -30.289 -17.345
    3    HA2  GLY 810           HA3      GLY 810  36.201 -30.570 -19.056

  No H/Q in entry =           3
  In of MODEL   14
    1    H    LYS 811           H        LYS 811  37.655 -27.657 -18.819
    2    HA   LYS 811           HA       LYS 811  40.344 -28.727 -19.385
    3    HB2  LYS 811           HB2      LYS 811  38.952 -26.222 -20.357
    4    HB3  LYS 811           HB3      LYS 811  40.607 -26.669 -20.715
    5    HG2  LYS 811           HG2      LYS 811  39.914 -28.490 -22.071
    6    HG3  LYS 811           HG3      LYS 811  38.245 -28.351 -21.509
    7    HD2  LYS 811           HD2      LYS 811  38.569 -27.424 -23.778
    8    HD3  LYS 811           HD3      LYS 811  38.011 -26.214 -22.623
    9    HE2  LYS 811           HE2      LYS 811  40.299 -25.374 -22.393
   10    HE3  LYS 811           HE3      LYS 811  40.879 -26.596 -23.523
   11    HZ2  LYS 811           HZ1      LYS 811  40.565 -24.416 -24.588
   12    HZ1  LYS 811           HZ2      LYS 811  38.940 -24.426 -24.161
   13    HZ3  LYS 811           HZ3      LYS 811  39.512 -25.553 -25.243

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLU 812           H        GLU 812  42.075 -27.239 -18.640
    2    HA   GLU 812           HA       GLU 812  41.113 -25.494 -16.517
    3    HB2  GLU 812           HB2      GLU 812  43.812 -26.808 -16.847
    4    HB3  GLU 812           HB3      GLU 812  43.538 -25.489 -15.715
    5    HG2  GLU 812           HG2      GLU 812  41.800 -26.822 -14.607
    6    HG3  GLU 812           HG3      GLU 812  42.139 -28.151 -15.710

  No H/Q in entry =           6
  In of MODEL   14
    1    H    GLN 813           H        GLN 813  40.901 -23.541 -16.970
    2    HA   GLN 813           HA       GLN 813  42.498 -22.437 -19.140
    3    HB2  GLN 813           HB2      GLN 813  40.206 -22.589 -19.780
    4    HB3  GLN 813           HB3      GLN 813  39.669 -21.868 -18.269
    5    HG2  GLN 813           HG2      GLN 813  40.606 -19.739 -18.937
    6    HG3  GLN 813           HG3      GLN 813  41.244 -20.456 -20.417
    7   HE21  GLN 813          HE21      GLN 813  39.274 -18.286 -19.927
    8   HE22  GLN 813          HE22      GLN 813  37.913 -18.699 -20.891

  No H/Q in entry =           8
  In of MODEL   14
    1    H    THR 814           H        THR 814  43.588 -20.690 -18.790
    2    HA   THR 814           HA       THR 814  43.900 -19.636 -16.130
    3    HB   THR 814           HB       THR 814  45.067 -18.732 -18.777
    4    HG1  THR 814           HG1      THR 814  46.926 -20.060 -17.851
    5   HG22  THR 814          HG21      THR 814  46.890 -17.831 -17.382
    6   HG21  THR 814          HG22      THR 814  46.035 -18.363 -15.932
    7   HG23  THR 814          HG23      THR 814  45.337 -17.112 -16.959

  No H/Q in entry =           7
  In of MODEL   14
    1    H    MET 815           H        MET 815  42.797 -17.883 -15.458
    2    HA   MET 815           HA       MET 815  41.630 -16.148 -17.521
    3    HB2  MET 815           HB2      MET 815  40.252 -16.878 -14.939
    4    HB3  MET 815           HB3      MET 815  39.633 -15.820 -16.192
    5    HG2  MET 815           HG2      MET 815  39.776 -17.887 -17.712
    6    HG3  MET 815           HG3      MET 815  40.005 -18.735 -16.186
    7    HE2  MET 815           HE1      MET 815  36.502 -19.860 -16.979
    8    HE1  MET 815           HE2      MET 815  38.216 -20.240 -16.666
    9    HE3  MET 815           HE3      MET 815  37.753 -19.482 -18.176

  No H/Q in entry =           9
  In of MODEL   14
    1    H    SER 816           H        SER 816  41.023 -14.089 -16.602
    2    HA   SER 816           HA       SER 816  43.060 -13.148 -14.788
    3    HB2  SER 816           HB2      SER 816  40.660 -11.671 -15.879
    4    HB3  SER 816           HB3      SER 816  42.130 -10.987 -15.173
    5    HG   SER 816           HG       SER 816  42.531 -12.713 -17.282

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLU 817           H        GLU 817  42.520 -12.254 -12.758
    2    HA   GLU 817           HA       GLU 817  40.893 -13.769 -11.131
    3    HB2  GLU 817           HB2      GLU 817  42.829 -12.269 -10.602
    4    HB3  GLU 817           HB3      GLU 817  41.694 -10.949 -10.743
    5    HG2  GLU 817           HG2      GLU 817  40.481 -11.549  -8.877
    6    HG3  GLU 817           HG3      GLU 817  41.207 -13.156  -8.816

  No H/Q in entry =           6
  In of MODEL   14
    1    H    CYS 818           H        CYS 818  40.246 -10.650 -12.636
    2    HA   CYS 818           HA       CYS 818  37.717 -10.225 -11.471
    3    HB2  CYS 818           HB2      CYS 818  37.419  -8.566 -13.261
    4    HB3  CYS 818           HB3      CYS 818  38.997  -8.417 -12.496

  No H/Q in entry =           4
  In of MODEL   14
    1    H    GLU 819           H        GLU 819  38.837 -11.879 -14.331
    2    HA   GLU 819           HA       GLU 819  36.381 -12.260 -15.645
    3    HB2  GLU 819           HB2      GLU 819  38.507 -12.360 -16.794
    4    HB3  GLU 819           HB3      GLU 819  39.021 -13.673 -15.752
    5    HG2  GLU 819           HG2      GLU 819  37.430 -15.148 -16.741
    6    HG3  GLU 819           HG3      GLU 819  36.784 -13.845 -17.735

  No H/Q in entry =           6
  In of MODEL   14
    1    H    ALA 820           H        ALA 820  38.457 -14.573 -13.895
    2    HA   ALA 820           HA       ALA 820  36.688 -16.668 -13.850
    3    HB2  ALA 820           HB1      ALA 820  38.007 -17.537 -11.949
    4    HB3  ALA 820           HB2      ALA 820  38.802 -15.963 -11.825
    5    HB1  ALA 820           HB3      ALA 820  39.007 -16.944 -13.275

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLY 821           H        GLY 821  37.078 -13.937 -11.635
    2    HA3  GLY 821           HA2      GLY 821  35.237 -14.791  -9.653
    3    HA2  GLY 821           HA3      GLY 821  35.832 -13.147  -9.884

  No H/Q in entry =           3
  In of MODEL   14
    1    H    ALA 822           H        ALA 822  34.901 -12.823 -12.555
    2    HA   ALA 822           HA       ALA 822  32.257 -12.071 -12.008
    3    HB1  ALA 822           HB1      ALA 822  33.589 -12.239 -14.735
    4    HB2  ALA 822           HB2      ALA 822  33.748 -10.892 -13.620
    5    HB3  ALA 822           HB3      ALA 822  32.172 -11.273 -14.283

  No H/Q in entry =           5
  In of MODEL   14
    1    H    LEU 823           H        LEU 823  33.677 -14.791 -13.772
    2    HA   LEU 823           HA       LEU 823  31.258 -16.015 -14.569
    3    HB2  LEU 823           HB2      LEU 823  34.001 -17.032 -14.015
    4    HB3  LEU 823           HB3      LEU 823  32.713 -18.191 -14.208
    5    HG   LEU 823           HG       LEU 823  32.271 -17.167 -16.464
    6   HD11  LEU 823          HD11      LEU 823  34.894 -15.796 -15.959
    7   HD13  LEU 823          HD12      LEU 823  33.323 -15.028 -16.191
    8   HD12  LEU 823          HD13      LEU 823  34.078 -15.918 -17.513
    9   HD23  LEU 823          HD21      LEU 823  34.965 -18.367 -15.988
   10   HD22  LEU 823          HD22      LEU 823  34.053 -18.388 -17.517
   11   HD21  LEU 823          HD23      LEU 823  33.432 -19.227 -16.087

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ARG 824           H        ARG 824  33.127 -16.229 -11.574
    2    HA   ARG 824           HA       ARG 824  31.552 -18.134 -10.215
    3    HB2  ARG 824           HB2      ARG 824  33.385 -15.968  -9.200
    4    HB3  ARG 824           HB3      ARG 824  32.543 -17.087  -8.141
    5    HG2  ARG 824           HG2      ARG 824  33.739 -18.937  -9.035
    6    HG3  ARG 824           HG3      ARG 824  34.491 -17.920 -10.280
    7    HD2  ARG 824           HD2      ARG 824  35.991 -18.417  -8.393
    8    HD3  ARG 824           HD3      ARG 824  35.661 -16.694  -8.548
    9    HE   ARG 824           HE       ARG 824  33.791 -17.583  -6.820
   10   HH11  ARG 824          HH11      ARG 824  37.341 -17.847  -6.826
   11   HH12  ARG 824          HH12      ARG 824  37.490 -17.678  -5.124
   12   HH21  ARG 824          HH21      ARG 824  34.077 -17.319  -4.398
   13   HH22  ARG 824          HH22      ARG 824  35.648 -17.383  -3.789

  No H/Q in entry =          13
  In of MODEL   14
    1    H    CYS 825           H        CYS 825  30.702 -15.055 -11.146
    2    HA   CYS 825           HA       CYS 825  28.825 -14.824  -8.906
    3    HB2  CYS 825           HB2      CYS 825  30.509 -12.952  -9.202
    4    HB3  CYS 825           HB3      CYS 825  29.746 -12.633 -10.750

  No H/Q in entry =           4
  In of MODEL   14
    1    H    ARG 826           H        ARG 826  29.306 -14.582 -12.387
    2    HA   ARG 826           HA       ARG 826  26.754 -13.987 -13.205
    3    HB2  ARG 826           HB2      ARG 826  28.907 -13.828 -14.453
    4    HB3  ARG 826           HB3      ARG 826  28.903 -15.576 -14.583
    5    HG2  ARG 826           HG2      ARG 826  26.881 -15.511 -15.806
    6    HG3  ARG 826           HG3      ARG 826  26.820 -13.745 -15.614
    7    HD2  ARG 826           HD2      ARG 826  27.711 -14.295 -17.832
    8    HD3  ARG 826           HD3      ARG 826  28.968 -13.563 -16.839
    9    HE   ARG 826           HE       ARG 826  28.949 -16.392 -16.711
   10   HH11  ARG 826          HH11      ARG 826  29.927 -13.721 -18.857
   11   HH12  ARG 826          HH12      ARG 826  31.232 -14.585 -19.545
   12   HH21  ARG 826          HH21      ARG 826  30.678 -17.580 -17.781
   13   HH22  ARG 826          HH22      ARG 826  31.652 -16.798 -18.945

  No H/Q in entry =          13
  In of MODEL   14
    1    H    GLY 827           H        GLY 827  28.361 -17.067 -12.497
    2    HA3  GLY 827           HA2      GLY 827  26.802 -18.765 -11.573
    3    HA2  GLY 827           HA3      GLY 827  25.738 -18.337 -12.906

  No H/Q in entry =           3
  In of MODEL   14
    1    H    GLN 828           H        GLN 828  29.186 -18.624 -13.373
    2    HA   GLN 828           HA       GLN 828  28.714 -20.854 -15.153
    3    HB2  GLN 828           HB2      GLN 828  30.185 -18.909 -15.792
    4    HB3  GLN 828           HB3      GLN 828  31.261 -19.412 -14.500
    5    HG2  GLN 828           HG2      GLN 828  31.916 -20.125 -16.786
    6    HG3  GLN 828           HG3      GLN 828  31.799 -21.446 -15.607
    7   HE21  GLN 828          HE21      GLN 828  30.476 -19.992 -18.453
    8   HE22  GLN 828          HE22      GLN 828  29.431 -21.280 -18.872

  No H/Q in entry =           8
  In of MODEL   14
    1    H    SER 829           H        SER 829  29.801 -22.842 -14.866
    2    HA   SER 829           HA       SER 829  30.312 -23.473 -12.073
    3    HB2  SER 829           HB2      SER 829  30.313 -25.315 -14.463
    4    HB3  SER 829           HB3      SER 829  30.073 -25.747 -12.767
    5    HG   SER 829           HG       SER 829  28.141 -24.596 -12.803

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ILE 830           H        ILE 830  32.348 -23.029 -11.498
    2    HA   ILE 830           HA       ILE 830  34.487 -23.937 -13.239
    3    HB   ILE 830           HB       ILE 830  35.839 -21.968 -12.885
    4   HG12  ILE 830          HG12      ILE 830  34.903 -21.217 -10.698
    5   HG13  ILE 830          HG13      ILE 830  35.108 -19.912 -11.850
    6   HG22  ILE 830          HG21      ILE 830  34.653 -20.333 -14.270
    7   HG21  ILE 830          HG22      ILE 830  33.182 -21.285 -14.038
    8   HG23  ILE 830          HG23      ILE 830  34.561 -21.991 -14.876
    9   HD11  ILE 830          HD11      ILE 830  32.689 -20.001 -12.349
   10   HD13  ILE 830          HD12      ILE 830  33.022 -19.613 -10.670
   11   HD12  ILE 830          HD13      ILE 830  32.499 -21.237 -11.106

  No H/Q in entry =          11
  In of MODEL   14
    1    H    SER 831           H        SER 831  36.369 -24.484 -12.201
    2    HA   SER 831           HA       SER 831  36.184 -24.638  -9.292
    3    HB2  SER 831           HB2      SER 831  37.358 -26.539 -11.285
    4    HB3  SER 831           HB3      SER 831  37.447 -26.730  -9.545
    5    HG   SER 831           HG       SER 831  35.492 -27.375 -11.274

  No H/Q in entry =           5
  In of MODEL   14
    1    H    VAL 832           H        VAL 832  37.604 -23.033  -8.659
    2    HA   VAL 832           HA       VAL 832  39.929 -22.353 -10.186
    3    HB   VAL 832           HB       VAL 832  39.272 -21.665  -7.306
    4   HG12  VAL 832          HG11      VAL 832  41.255 -20.397  -9.219
    5   HG11  VAL 832          HG12      VAL 832  41.666 -21.390  -7.828
    6   HG13  VAL 832          HG13      VAL 832  40.904 -19.818  -7.590
    7   HG21  VAL 832          HG21      VAL 832  37.561 -20.832  -8.819
    8   HG23  VAL 832          HG22      VAL 832  38.797 -20.074  -9.827
    9   HG22  VAL 832          HG23      VAL 832  38.518 -19.490  -8.187

  No H/Q in entry =           9
  In of MODEL   14
    1    H    THR 833           H        THR 833  41.611 -23.650 -10.373
    2    HA   THR 833           HA       THR 833  41.965 -25.692  -8.402
    3    HB   THR 833           HB       THR 833  43.581 -26.606 -10.113
    4    HG1  THR 833           HG1      THR 833  43.466 -25.646 -12.184
    5   HG23  THR 833          HG21      THR 833  41.253 -27.374 -10.029
    6   HG22  THR 833          HG22      THR 833  41.775 -27.255 -11.713
    7   HG21  THR 833          HG23      THR 833  40.754 -26.011 -11.023

  No H/Q in entry =           7
  In of MODEL   14
    1    H    SER 834           H        SER 834  43.655 -22.868  -9.663
    2    HA   SER 834           HA       SER 834  45.164 -22.743  -7.259
    3    HB2  SER 834           HB2      SER 834  46.558 -24.358  -8.494
    4    HB3  SER 834           HB3      SER 834  46.677 -23.209  -9.839
    5    HG   SER 834           HG       SER 834  48.387 -23.393  -8.092

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ILE 835           H        ILE 835  46.540 -20.935  -7.253
    2    HA   ILE 835           HA       ILE 835  45.353 -18.637  -8.539
    3    HB   ILE 835           HB       ILE 835  46.919 -17.369  -7.077
    4   HG12  ILE 835          HG12      ILE 835  47.651 -20.130  -6.054
    5   HG13  ILE 835          HG13      ILE 835  48.690 -19.043  -6.979
    6   HG23  ILE 835          HG21      ILE 835  45.752 -17.911  -4.977
    7   HG22  ILE 835          HG22      ILE 835  45.188 -19.422  -5.691
    8   HG21  ILE 835          HG23      ILE 835  44.639 -17.882  -6.347
    9   HD13  ILE 835          HD11      ILE 835  49.224 -19.068  -4.670
   10   HD12  ILE 835          HD12      ILE 835  47.564 -18.568  -4.287
   11   HD11  ILE 835          HD13      ILE 835  48.627 -17.478  -5.180

  No H/Q in entry =          11
  In of MODEL   14
    1    H    ARG 836           H        ARG 836  47.669 -20.841  -9.230
    2    HA   ARG 836           HA       ARG 836  49.494 -19.050 -10.616
    3    HB2  ARG 836           HB2      ARG 836  49.451 -22.039 -10.188
    4    HB3  ARG 836           HB3      ARG 836  50.562 -21.275 -11.306
    5    HG2  ARG 836           HG2      ARG 836  50.405 -20.745  -8.347
    6    HG3  ARG 836           HG3      ARG 836  51.606 -21.761  -9.152
    7    HD2  ARG 836           HD2      ARG 836  51.202 -18.789  -9.547
    8    HD3  ARG 836           HD3      ARG 836  52.542 -19.548  -8.714
    9    HE   ARG 836           HE       ARG 836  52.302 -20.486 -11.392
   10   HH11  ARG 836          HH11      ARG 836  53.744 -17.903  -9.432
   11   HH12  ARG 836          HH12      ARG 836  54.736 -17.353 -10.712
   12   HH21  ARG 836          HH21      ARG 836  53.706 -19.742 -13.057
   13   HH22  ARG 836          HH22      ARG 836  54.724 -18.401 -12.784

  No H/Q in entry =          13
  In of MODEL   14
    1    HA   PRO 837           HA       PRO 837  47.133 -19.483 -14.330
    2    HB2  PRO 837           HB2      PRO 837  49.063 -18.779 -16.128
    3    HB3  PRO 837           HB3      PRO 837  48.207 -17.607 -15.122
    4    HG2  PRO 837           HG2      PRO 837  50.915 -18.816 -14.732
    5    HG3  PRO 837           HG3      PRO 837  50.405 -17.134 -14.513
    6    HD2  PRO 837           HD2      PRO 837  50.709 -18.832 -12.441
    7    HD3  PRO 837           HD3      PRO 837  49.478 -17.553 -12.443

  No H/Q in entry =           7
  In of MODEL   14
    1    H    CYS 838           H        CYS 838  46.782 -21.082 -15.848
    2    HA   CYS 838           HA       CYS 838  48.685 -23.232 -15.844
    3    HB2  CYS 838           HB2      CYS 838  45.803 -23.091 -16.656
    4    HB3  CYS 838           HB3      CYS 838  46.818 -24.423 -17.193

  No H/Q in entry =           4
  In of MODEL   14
    1    H    ALA 839           H        ALA 839  48.478 -24.471 -18.203
    2    HA   ALA 839           HA       ALA 839  49.891 -22.754 -20.002
    3    HB3  ALA 839           HB1      ALA 839  50.196 -24.803 -21.293
    4    HB2  ALA 839           HB2      ALA 839  49.065 -25.642 -20.232
    5    HB1  ALA 839           HB3      ALA 839  50.594 -25.043 -19.591

  No H/Q in entry =           5
  In of MODEL   14
    1    H    ALA 840           H        ALA 840  47.000 -22.241 -19.603
    2    HA   ALA 840           HA       ALA 840  45.873 -22.749 -22.252
    3    HB1  ALA 840           HB1      ALA 840  44.761 -21.204 -19.924
    4    HB2  ALA 840           HB2      ALA 840  44.393 -22.890 -20.291
    5    HB3  ALA 840           HB3      ALA 840  43.868 -21.609 -21.391

  No H/Q in entry =           5
  In of MODEL   14
    1    H    GLU 841           H        GLU 841  47.166 -20.265 -20.279
    2    HA   GLU 841           HA       GLU 841  48.184 -18.317 -20.582
    3    HB2  GLU 841           HB2      GLU 841  48.321 -19.098 -23.470
    4    HB3  GLU 841           HB3      GLU 841  49.236 -17.796 -22.724
    5    HG2  GLU 841           HG2      GLU 841  50.328 -19.421 -21.258
    6    HG3  GLU 841           HG3      GLU 841  49.426 -20.717 -22.045

  No H/Q in entry =           6
  In of MODEL   14
    1    H    THR 842           H        THR 842  45.410 -18.682 -22.478
    2    HA   THR 842           HA       THR 842  44.070 -17.387 -23.602
    3    HB   THR 842           HB       THR 842  43.488 -15.110 -22.651
    4    HG1  THR 842           HG1      THR 842  45.647 -15.583 -21.170
    5   HG22  THR 842          HG21      THR 842  43.215 -17.523 -20.875
    6   HG21  THR 842          HG22      THR 842  42.142 -17.053 -22.194
    7   HG23  THR 842          HG23      THR 842  42.239 -16.061 -20.741

  No H/Q in entry =           7
  In of MODEL   14
    1    H    GLN 843           H        GLN 843  45.063 -17.407 -25.373
    2    HA   GLN 843           HA       GLN 843  46.952 -15.300 -25.979
    3    HB2  GLN 843           HB2      GLN 843  47.698 -16.850 -27.807
    4    HB3  GLN 843           HB3      GLN 843  47.968 -17.456 -26.184
    5    HG2  GLN 843           HG2      GLN 843  45.833 -18.786 -26.450
    6    HG3  GLN 843           HG3      GLN 843  45.851 -18.308 -28.143
    7   HE21  GLN 843          HE21      GLN 843  46.024 -20.951 -26.993
    8   HE22  GLN 843          HE22      GLN 843  47.511 -21.629 -27.543

  No H/Q in entry =           8
  In of MODEL   15
    1    H1   GLY 689           H1       GLY 689  54.295   7.124 -35.618
    2    H2   GLY 689           H3       GLY 689  54.670   8.147 -36.914
    3    H3   GLY 689           H2       GLY 689  53.468   6.955 -37.070
    4    HA2  GLY 689           HA2      GLY 689  56.352   6.465 -36.702
    5    HA3  GLY 689           HA3      GLY 689  55.447   6.249 -38.189

  No H/Q in entry =           5
  In of MODEL   15
    1    H    SER 690           H        SER 690  56.314   4.028 -37.954
    2    HA   SER 690           HA       SER 690  54.365   2.403 -36.544
    3    HB2  SER 690           HB2      SER 690  56.411   1.657 -38.638
    4    HB3  SER 690           HB3      SER 690  55.124   0.623 -38.015
    5    HG   SER 690           HG       SER 690  54.297   1.415 -39.790

  No H/Q in entry =           5
  In of MODEL   15
    1    H    HIS 691           H        HIS 691  54.990   1.055 -34.901
    2    HA   HIS 691           HA       HIS 691  57.789   1.294 -34.147
    3    HB2  HIS 691           HB2      HIS 691  57.130   0.556 -31.844
    4    HB3  HIS 691           HB3      HIS 691  56.410   2.079 -32.327
    5    HD1  HIS 691           HD1      HIS 691  54.057   2.260 -31.537
    6    HD2  HIS 691           HD2      HIS 691  55.092  -1.693 -32.316
    7    HE1  HIS 691           HE1      HIS 691  52.050   0.916 -30.972
    8    HE2  HIS 691           HE2      HIS 691  52.601  -1.396 -31.731

  No H/Q in entry =           8
  In of MODEL   15
    1    H    MET 692           H        MET 692  59.093  -0.308 -34.183
    2    HA   MET 692           HA       MET 692  58.095  -2.896 -35.100
    3    HB2  MET 692           HB2      MET 692  60.929  -1.956 -34.644
    4    HB3  MET 692           HB3      MET 692  60.446  -3.406 -35.508
    5    HG2  MET 692           HG2      MET 692  59.407  -2.017 -37.241
    6    HG3  MET 692           HG3      MET 692  59.897  -0.574 -36.358
    7    HE2  MET 692           HE1      MET 692  62.851  -1.626 -35.325
    8    HE1  MET 692           HE2      MET 692  62.446   0.003 -35.845
    9    HE3  MET 692           HE3      MET 692  63.823  -0.830 -36.564

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ASN 693           H        ASN 693  59.453  -1.260 -32.422
    2    HA   ASN 693           HA       ASN 693  59.800  -3.698 -30.865
    3    HB2  ASN 693           HB2      ASN 693  60.456  -0.801 -30.201
    4    HB3  ASN 693           HB3      ASN 693  60.769  -2.163 -29.146
    5   HD21  ASN 693          HD21      ASN 693  62.479  -3.517 -29.614
    6   HD22  ASN 693          HD22      ASN 693  63.701  -3.110 -30.767

  No H/Q in entry =           6
  In of MODEL   15
    1    HA   PRO 694           HA       PRO 694  55.927  -2.804 -28.825
    2    HB2  PRO 694           HB2      PRO 694  56.279  -4.138 -26.497
    3    HB3  PRO 694           HB3      PRO 694  56.057  -5.002 -28.022
    4    HG2  PRO 694           HG2      PRO 694  58.577  -4.418 -26.518
    5    HG3  PRO 694           HG3      PRO 694  58.082  -5.912 -27.333
    6    HD2  PRO 694           HD2      PRO 694  59.802  -4.096 -28.425
    7    HD3  PRO 694           HD3      PRO 694  58.761  -5.157 -29.388

  No H/Q in entry =           7
  In of MODEL   15
    1    H    LEU 695           H        LEU 695  55.556  -2.392 -26.102
    2    HA   LEU 695           HA       LEU 695  56.500   0.227 -25.730
    3    HB2  LEU 695           HB2      LEU 695  54.377  -0.827 -24.765
    4    HB3  LEU 695           HB3      LEU 695  55.396  -1.657 -23.621
    5    HG   LEU 695           HG       LEU 695  54.192   0.309 -22.687
    6   HD13  LEU 695          HD11      LEU 695  56.156  -0.444 -21.547
    7   HD12  LEU 695          HD12      LEU 695  56.093   1.323 -21.528
    8   HD11  LEU 695          HD13      LEU 695  57.183   0.491 -22.634
    9   HD23  LEU 695          HD21      LEU 695  56.009   1.917 -24.477
   10   HD22  LEU 695          HD22      LEU 695  54.938   2.567 -23.235
   11   HD21  LEU 695          HD23      LEU 695  54.262   1.752 -24.647

  No H/Q in entry =          11
  In of MODEL   15
    1    H    THR 696           H        THR 696  58.581   0.597 -25.526
    2    HA   THR 696           HA       THR 696  60.215  -1.284 -24.050
    3    HB   THR 696           HB       THR 696  61.120   0.870 -25.973
    4    HG1  THR 696           HG1      THR 696  59.732  -0.908 -26.834
    5   HG23  THR 696          HG21      THR 696  63.200  -0.434 -26.017
    6   HG22  THR 696          HG22      THR 696  62.506  -1.597 -24.890
    7   HG21  THR 696          HG23      THR 696  62.826   0.056 -24.363

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLN 697           H        GLN 697  59.779  -0.585 -22.042
    2    HA   GLN 697           HA       GLN 697  61.242   1.756 -21.135
    3    HB2  GLN 697           HB2      GLN 697  58.358   1.116 -20.469
    4    HB3  GLN 697           HB3      GLN 697  59.366   2.078 -19.408
    5    HG2  GLN 697           HG2      GLN 697  58.749   2.806 -22.262
    6    HG3  GLN 697           HG3      GLN 697  57.821   3.375 -20.881
    7   HE21  GLN 697          HE21      GLN 697  58.295   5.487 -21.164
    8   HE22  GLN 697          HE22      GLN 697  59.866   6.164 -20.932

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ALA 698           H        ALA 698  61.586   1.483 -18.731
    2    HA   ALA 698           HA       ALA 698  62.018  -1.332 -18.179
    3    HB1  ALA 698           HB1      ALA 698  62.711   1.061 -16.458
    4    HB2  ALA 698           HB2      ALA 698  63.814   0.317 -17.613
    5    HB3  ALA 698           HB3      ALA 698  63.252  -0.598 -16.214

  No H/Q in entry =           5
  In of MODEL   15
    1    H    VAL 699           H        VAL 699  60.011  -1.871 -18.308
    2    HA   VAL 699           HA       VAL 699  58.230  -1.070 -16.287
    3    HB   VAL 699           HB       VAL 699  56.853  -2.884 -17.270
    4   HG11  VAL 699          HG11      VAL 699  57.802  -0.667 -19.107
    5   HG13  VAL 699          HG12      VAL 699  56.519  -0.535 -17.902
    6   HG12  VAL 699          HG13      VAL 699  56.292  -1.549 -19.323
    7   HG22  VAL 699          HG21      VAL 699  57.400  -3.721 -19.509
    8   HG21  VAL 699          HG22      VAL 699  58.604  -4.215 -18.315
    9   HG23  VAL 699          HG23      VAL 699  58.953  -2.898 -19.433

  No H/Q in entry =           9
  In of MODEL   15
    1    HA   PRO 700           HA       PRO 700  59.726  -3.686 -13.176
    2    HB2  PRO 700           HB2      PRO 700  57.274  -4.303 -12.017
    3    HB3  PRO 700           HB3      PRO 700  58.318  -2.944 -11.604
    4    HG2  PRO 700           HG2      PRO 700  55.900  -3.015 -13.335
    5    HG3  PRO 700           HG3      PRO 700  56.500  -1.707 -12.302
    6    HD2  PRO 700           HD2      PRO 700  56.751  -1.659 -14.979
    7    HD3  PRO 700           HD3      PRO 700  57.983  -0.957 -13.913

  No H/Q in entry =           7
  In of MODEL   15
    1    H    LYS 701           H        LYS 701  60.360  -5.591 -13.343
    2    HA   LYS 701           HA       LYS 701  58.796  -7.683 -14.652
    3    HB2  LYS 701           HB2      LYS 701  61.690  -7.530 -13.770
    4    HB3  LYS 701           HB3      LYS 701  60.963  -8.974 -14.464
    5    HG2  LYS 701           HG2      LYS 701  61.103  -6.307 -15.858
    6    HG3  LYS 701           HG3      LYS 701  62.266  -7.615 -16.089
    7    HD2  LYS 701           HD2      LYS 701  60.479  -9.075 -16.895
    8    HD3  LYS 701           HD3      LYS 701  59.294  -7.811 -16.608
    9    HE2  LYS 701           HE2      LYS 701  61.625  -7.534 -18.499
   10    HE3  LYS 701           HE3      LYS 701  60.006  -8.030 -18.988
   11    HZ1  LYS 701           HZ1      LYS 701  60.674  -5.435 -17.688
   12    HZ3  LYS 701           HZ2      LYS 701  59.155  -5.950 -18.237
   13    HZ2  LYS 701           HZ3      LYS 701  60.387  -5.687 -19.336

  No H/Q in entry =          13
  In of MODEL   15
    1    H    CYS 702           H        CYS 702  57.930  -6.717 -12.279
    2    HA   CYS 702           HA       CYS 702  58.485  -8.785 -10.282
    3    HB2  CYS 702           HB2      CYS 702  56.753  -6.360  -9.845
    4    HB3  CYS 702           HB3      CYS 702  57.716  -7.257  -8.692

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLN 703           H        GLN 703  56.767 -10.079  -9.713
    2    HA   GLN 703           HA       GLN 703  54.545 -10.189 -11.538
    3    HB2  GLN 703           HB2      GLN 703  55.173 -11.719  -9.024
    4    HB3  GLN 703           HB3      GLN 703  53.816 -12.062 -10.079
    5    HG2  GLN 703           HG2      GLN 703  56.711 -12.190 -10.907
    6    HG3  GLN 703           HG3      GLN 703  55.744 -13.576 -10.411
    7   HE21  GLN 703          HE21      GLN 703  55.940 -14.636 -12.337
    8   HE22  GLN 703          HE22      GLN 703  55.203 -14.105 -13.799

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ARG 704           H        ARG 704  52.389 -10.744 -10.090
    2    HA   ARG 704           HA       ARG 704  51.771  -8.010  -9.427
    3    HB2  ARG 704           HB2      ARG 704  49.961 -10.402  -9.746
    4    HB3  ARG 704           HB3      ARG 704  49.375  -8.791  -9.352
    5    HG2  ARG 704           HG2      ARG 704  50.183  -7.895 -11.356
    6    HG3  ARG 704           HG3      ARG 704  51.045  -9.386 -11.779
    7    HD2  ARG 704           HD2      ARG 704  48.845 -10.486 -11.929
    8    HD3  ARG 704           HD3      ARG 704  48.063  -8.913 -11.665
    9    HE   ARG 704           HE       ARG 704  49.988  -9.058 -13.849
   10   HH11  ARG 704          HH11      ARG 704  46.486  -9.072 -13.084
   11   HH12  ARG 704          HH12      ARG 704  46.057  -8.854 -14.714
   12   HH21  ARG 704          HH21      ARG 704  49.335  -8.747 -15.976
   13   HH22  ARG 704          HH22      ARG 704  47.689  -8.624 -16.405

  No H/Q in entry =          13
  In of MODEL   15
    1    H    TRP 705           H        TRP 705  52.606 -10.674  -7.615
    2    HA   TRP 705           HA       TRP 705  51.466  -9.584  -5.145
    3    HB2  TRP 705           HB2      TRP 705  52.471 -11.622  -4.076
    4    HB3  TRP 705           HB3      TRP 705  51.310 -12.001  -5.337
    5    HD1  TRP 705           HD1      TRP 705  55.027 -12.291  -4.484
    6    HE1  TRP 705           HE1      TRP 705  56.131 -13.872  -6.165
    7    HE3  TRP 705           HE3      TRP 705  51.111 -12.879  -7.714
    8    HZ2  TRP 705           HZ2      TRP 705  55.418 -15.202  -8.567
    9    HZ3  TRP 705           HZ3      TRP 705  51.411 -14.330  -9.667
   10    HH2  TRP 705           HH2      TRP 705  53.523 -15.468 -10.075

  No H/Q in entry =          10
  In of MODEL   15
    1    H    GLU 706           H        GLU 706  53.865  -8.827  -7.070
    2    HA   GLU 706           HA       GLU 706  55.734  -8.209  -4.917
    3    HB2  GLU 706           HB2      GLU 706  56.271  -8.613  -7.850
    4    HB3  GLU 706           HB3      GLU 706  57.467  -8.109  -6.656
    5    HG2  GLU 706           HG2      GLU 706  57.156 -10.272  -5.532
    6    HG3  GLU 706           HG3      GLU 706  56.018 -10.734  -6.799

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LYS 707           H        LYS 707  56.872  -6.249  -5.238
    2    HA   LYS 707           HA       LYS 707  55.595  -4.302  -6.966
    3    HB2  LYS 707           HB2      LYS 707  55.622  -2.626  -5.158
    4    HB3  LYS 707           HB3      LYS 707  54.506  -3.942  -4.835
    5    HG2  LYS 707           HG2      LYS 707  55.987  -4.888  -3.220
    6    HG3  LYS 707           HG3      LYS 707  57.275  -3.766  -3.669
    7    HD2  LYS 707           HD2      LYS 707  55.895  -1.887  -2.890
    8    HD3  LYS 707           HD3      LYS 707  54.624  -3.022  -2.444
    9    HE2  LYS 707           HE2      LYS 707  55.961  -3.998  -0.760
   10    HE3  LYS 707           HE3      LYS 707  57.409  -3.175  -1.334
   11    HZ1  LYS 707           HZ1      LYS 707  55.041  -1.769  -0.224
   12    HZ3  LYS 707           HZ2      LYS 707  56.560  -1.105  -0.601
   13    HZ2  LYS 707           HZ3      LYS 707  56.415  -2.190   0.662

  No H/Q in entry =          13
  In of MODEL   15
    1    H    LEU 708           H        LEU 708  56.935  -2.519  -7.400
    2    HA   LEU 708           HA       LEU 708  59.754  -3.239  -7.321
    3    HB2  LEU 708           HB2      LEU 708  58.724  -2.713  -9.492
    4    HB3  LEU 708           HB3      LEU 708  58.263  -1.134  -8.896
    5    HG   LEU 708           HG       LEU 708  60.699  -0.593  -8.655
    6   HD13  LEU 708          HD11      LEU 708  61.598  -2.836  -8.515
    7   HD12  LEU 708          HD12      LEU 708  62.317  -1.966  -9.870
    8   HD11  LEU 708          HD13      LEU 708  61.063  -3.171 -10.161
    9   HD21  LEU 708          HD21      LEU 708  59.411   0.173 -10.578
   10   HD23  LEU 708          HD22      LEU 708  59.761  -1.332 -11.430
   11   HD22  LEU 708          HD23      LEU 708  61.065  -0.214 -11.046

  No H/Q in entry =          11
  In of MODEL   15
    1    H    GLN 709           H        GLN 709  60.820  -2.440  -5.635
    2    HA   GLN 709           HA       GLN 709  60.711   0.411  -5.139
    3    HB2  GLN 709           HB2      GLN 709  60.382   0.296  -2.790
    4    HB3  GLN 709           HB3      GLN 709  59.130  -0.740  -3.455
    5    HG2  GLN 709           HG2      GLN 709  60.408  -2.705  -2.907
    6    HG3  GLN 709           HG3      GLN 709  61.739  -1.711  -2.310
    7   HE21  GLN 709          HE21      GLN 709  61.607  -2.563  -0.209
    8   HE22  GLN 709          HE22      GLN 709  60.284  -2.187   0.831

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ASN 710           H        ASN 710  62.658   1.116  -4.261
    2    HA   ASN 710           HA       ASN 710  64.899   1.101  -3.799
    3    HB2  ASN 710           HB2      ASN 710  64.007  -0.550  -2.041
    4    HB3  ASN 710           HB3      ASN 710  64.541  -1.835  -3.101
    5   HD21  ASN 710          HD21      ASN 710  65.452   0.651  -0.972
    6   HD22  ASN 710          HD22      ASN 710  67.110   0.217  -0.761

  No H/Q in entry =           6
  In of MODEL   15
    1    H    SER 711           H        SER 711  63.716   0.275  -6.381
    2    HA   SER 711           HA       SER 711  64.311  -0.240  -8.475
    3    HB2  SER 711           HB2      SER 711  66.439   0.924  -8.012
    4    HB3  SER 711           HB3      SER 711  67.125  -0.561  -7.361
    5    HG   SER 711           HG       SER 711  66.567  -1.430  -9.539

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ARG 712           H        ARG 712  63.720  -2.375  -6.293
    2    HA   ARG 712           HA       ARG 712  64.382  -4.640  -8.014
    3    HB2  ARG 712           HB2      ARG 712  64.767  -6.035  -6.010
    4    HB3  ARG 712           HB3      ARG 712  65.966  -4.768  -6.230
    5    HG2  ARG 712           HG2      ARG 712  64.917  -3.438  -4.457
    6    HG3  ARG 712           HG3      ARG 712  63.634  -4.621  -4.354
    7    HD2  ARG 712           HD2      ARG 712  65.413  -4.828  -2.584
    8    HD3  ARG 712           HD3      ARG 712  65.069  -6.297  -3.497
    9    HE   ARG 712           HE       ARG 712  67.156  -5.078  -4.799
   10   HH11  ARG 712          HH11      ARG 712  66.647  -6.278  -1.510
   11   HH12  ARG 712          HH12      ARG 712  68.255  -6.807  -1.303
   12   HH21  ARG 712          HH21      ARG 712  69.362  -5.855  -4.536
   13   HH22  ARG 712          HH22      ARG 712  69.818  -6.587  -3.062

  No H/Q in entry =          13
  In of MODEL   15
    1    H    CYS 713           H        CYS 713  63.053  -6.577  -7.460
    2    HA   CYS 713           HA       CYS 713  60.329  -5.717  -6.915
    3    HB2  CYS 713           HB2      CYS 713  61.399  -8.286  -8.095
    4    HB3  CYS 713           HB3      CYS 713  59.699  -7.864  -7.937

  No H/Q in entry =           4
  In of MODEL   15
    1    H    VAL 714           H        VAL 714  59.662  -5.992  -4.945
    2    HA   VAL 714           HA       VAL 714  60.616  -8.304  -3.403
    3    HB   VAL 714           HB       VAL 714  60.211  -6.993  -1.335
    4   HG12  VAL 714          HG11      VAL 714  62.124  -5.473  -1.484
    5   HG11  VAL 714          HG12      VAL 714  62.105  -5.650  -3.241
    6   HG13  VAL 714          HG13      VAL 714  62.456  -7.044  -2.218
    7   HG21  VAL 714          HG21      VAL 714  59.716  -4.673  -3.207
    8   HG23  VAL 714          HG22      VAL 714  59.873  -4.550  -1.457
    9   HG22  VAL 714          HG23      VAL 714  58.522  -5.440  -2.162

  No H/Q in entry =           9
  In of MODEL   15
    1    H    CYS 715           H        CYS 715  58.931  -9.048  -1.845
    2    HA   CYS 715           HA       CYS 715  56.458  -8.875  -3.270
    3    HB2  CYS 715           HB2      CYS 715  57.392 -10.818  -1.159
    4    HB3  CYS 715           HB3      CYS 715  55.761 -10.834  -1.840

  No H/Q in entry =           4
  In of MODEL   15
    1    H    LYS 716           H        LYS 716  54.520  -8.485  -2.394
    2    HA   LYS 716           HA       LYS 716  54.489  -6.095  -0.851
    3    HB2  LYS 716           HB2      LYS 716  52.283  -7.839  -1.949
    4    HB3  LYS 716           HB3      LYS 716  52.035  -6.252  -1.238
    5    HG2  LYS 716           HG2      LYS 716  53.202  -5.176  -2.993
    6    HG3  LYS 716           HG3      LYS 716  53.848  -6.701  -3.592
    7    HD2  LYS 716           HD2      LYS 716  52.032  -5.849  -5.018
    8    HD3  LYS 716           HD3      LYS 716  51.618  -7.394  -4.293
    9    HE2  LYS 716           HE2      LYS 716  50.235  -6.283  -2.641
   10    HE3  LYS 716           HE3      LYS 716  50.716  -4.703  -3.258
   11    HZ2  LYS 716           HZ1      LYS 716  48.527  -5.402  -4.078
   12    HZ1  LYS 716           HZ2      LYS 716  49.214  -6.742  -4.842
   13    HZ3  LYS 716           HZ3      LYS 716  49.633  -5.184  -5.318

  No H/Q in entry =          13
  In of MODEL   15
    1    H    MET 717           H        MET 717  52.221  -6.167   0.591
    2    HA   MET 717           HA       MET 717  52.759  -7.990   2.818
    3    HB2  MET 717           HB2      MET 717  50.854  -5.606   2.701
    4    HB3  MET 717           HB3      MET 717  51.305  -6.521   4.101
    5    HG2  MET 717           HG2      MET 717  53.411  -5.035   2.610
    6    HG3  MET 717           HG3      MET 717  52.316  -4.161   3.666
    7    HE3  MET 717           HE1      MET 717  54.128  -7.773   4.144
    8    HE2  MET 717           HE2      MET 717  55.544  -7.208   5.027
    9    HE1  MET 717           HE3      MET 717  55.265  -6.676   3.367

  No H/Q in entry =           9
  In of MODEL   15
    1    HA   PRO 718           HA       PRO 718  49.282 -10.407   1.404
    2    HB2  PRO 718           HB2      PRO 718  48.461 -10.891   4.198
    3    HB3  PRO 718           HB3      PRO 718  49.003 -12.048   2.981
    4    HG2  PRO 718           HG2      PRO 718  50.534 -11.392   5.056
    5    HG3  PRO 718           HG3      PRO 718  51.238 -11.693   3.456
    6    HD2  PRO 718           HD2      PRO 718  50.671  -9.083   4.821
    7    HD3  PRO 718           HD3      PRO 718  52.095  -9.580   3.882

  No H/Q in entry =           7
  In of MODEL   15
    1    H    TYR 719           H        TYR 719  48.850  -7.772   3.455
    2    HA   TYR 719           HA       TYR 719  45.953  -7.696   3.044
    3    HB2  TYR 719           HB2      TYR 719  45.946  -5.939   4.801
    4    HB3  TYR 719           HB3      TYR 719  46.629  -7.452   5.372
    5    HD1  TYR 719           HD1      TYR 719  47.303  -3.942   4.599
    6    HD2  TYR 719           HD2      TYR 719  49.062  -7.610   5.876
    7    HE1  TYR 719           HE1      TYR 719  49.298  -2.725   5.359
    8    HE2  TYR 719           HE2      TYR 719  51.039  -6.386   6.650
    9    HH   TYR 719           HH       TYR 719  52.186  -4.322   6.223

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLU 720           H        GLU 720  48.491  -6.845   1.325
    2    HA   GLU 720           HA       GLU 720  47.748  -4.057   0.769
    3    HB2  GLU 720           HB2      GLU 720  50.177  -5.142   1.032
    4    HB3  GLU 720           HB3      GLU 720  49.922  -5.496  -0.665
    5    HG2  GLU 720           HG2      GLU 720  51.124  -3.461  -0.500
    6    HG3  GLU 720           HG3      GLU 720  49.479  -3.085  -1.026

  No H/Q in entry =           6
  In of MODEL   15
    1    H    CYS 721           H        CYS 721  46.319  -6.611   0.064
    2    HA   CYS 721           HA       CYS 721  46.623  -6.659  -2.797
    3    HB2  CYS 721           HB2      CYS 721  45.203  -8.557  -0.950
    4    HB3  CYS 721           HB3      CYS 721  45.395  -8.779  -2.689

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLY 722           H        GLY 722  43.662  -7.136  -0.828
    2    HA3  GLY 722           HA2      GLY 722  41.741  -5.834  -0.908
    3    HA2  GLY 722           HA3      GLY 722  42.428  -4.912  -2.236

  No H/Q in entry =           3
  In of MODEL   15
    1    HA   PRO 723           HA       PRO 723  39.771  -7.447  -4.774
    2    HB2  PRO 723           HB2      PRO 723  41.095  -6.596  -7.182
    3    HB3  PRO 723           HB3      PRO 723  39.541  -6.057  -6.552
    4    HG2  PRO 723           HG2      PRO 723  41.813  -4.503  -6.713
    5    HG3  PRO 723           HG3      PRO 723  40.431  -4.188  -5.656
    6    HD2  PRO 723           HD2      PRO 723  43.082  -5.374  -5.009
    7    HD3  PRO 723           HD3      PRO 723  42.014  -4.347  -4.029

  No H/Q in entry =           7
  In of MODEL   15
    1    H    SER 724           H        SER 724  40.326  -9.639  -4.478
    2    HA   SER 724           HA       SER 724  41.927 -10.834  -6.437
    3    HB2  SER 724           HB2      SER 724  42.639 -11.009  -3.487
    4    HB3  SER 724           HB3      SER 724  43.314 -12.039  -4.750
    5    HG   SER 724           HG       SER 724  43.728  -9.736  -5.641

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU 725           H        LEU 725  41.587 -13.153  -6.275
    2    HA   LEU 725           HA       LEU 725  38.859 -13.856  -5.526
    3    HB2  LEU 725           HB2      LEU 725  41.122 -15.233  -6.877
    4    HB3  LEU 725           HB3      LEU 725  39.746 -16.174  -6.320
    5    HG   LEU 725           HG       LEU 725  39.458 -13.860  -8.237
    6   HD11  LEU 725          HD11      LEU 725  41.034 -15.529  -9.170
    7   HD13  LEU 725          HD12      LEU 725  39.492 -15.489 -10.020
    8   HD12  LEU 725          HD13      LEU 725  39.834 -16.792  -8.877
    9   HD21  LEU 725          HD21      LEU 725  37.451 -14.658  -7.099
   10   HD23  LEU 725          HD22      LEU 725  37.791 -16.299  -7.661
   11   HD22  LEU 725          HD23      LEU 725  37.432 -15.019  -8.824

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ASP 726           H        ASP 726  38.229 -14.782  -3.744
    2    HA   ASP 726           HA       ASP 726  40.246 -15.503  -1.849
    3    HB2  ASP 726           HB2      ASP 726  37.233 -15.451  -1.591
    4    HB3  ASP 726           HB3      ASP 726  38.309 -15.986  -0.303

  No H/Q in entry =           4
  In of MODEL   15
    1    H    VAL 727           H        VAL 727  40.722 -17.430  -1.133
    2    HA   VAL 727           HA       VAL 727  39.540 -19.742  -2.499
    3    HB   VAL 727           HB       VAL 727  41.838 -20.683  -2.897
    4   HG13  VAL 727          HG11      VAL 727  40.644 -19.693  -4.771
    5   HG12  VAL 727          HG12      VAL 727  42.364 -19.331  -4.904
    6   HG11  VAL 727          HG13      VAL 727  41.245 -18.094  -4.337
    7   HG22  VAL 727          HG21      VAL 727  43.100 -19.337  -1.306
    8   HG21  VAL 727          HG22      VAL 727  42.736 -17.882  -2.234
    9   HG23  VAL 727          HG23      VAL 727  43.761 -19.135  -2.932

  No H/Q in entry =           9
  In of MODEL   15
    1    H    CYS 728           H        CYS 728  40.130 -21.794  -1.462
    2    HA   CYS 728           HA       CYS 728  40.530 -21.431   1.411
    3    HB2  CYS 728           HB2      CYS 728  39.682 -23.891  -0.136
    4    HB3  CYS 728           HB3      CYS 728  39.779 -23.760   1.612

  No H/Q in entry =           4
  In of MODEL   15
    1    H    ALA 729           H        ALA 729  42.342 -22.038   2.343
    2    HA   ALA 729           HA       ALA 729  44.186 -23.757   0.864
    3    HB3  ALA 729           HB1      ALA 729  44.910 -21.456   0.504
    4    HB2  ALA 729           HB2      ALA 729  46.051 -22.301   1.548
    5    HB1  ALA 729           HB3      ALA 729  44.893 -21.169   2.241

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLN 730           H        GLN 730  45.770 -24.667   2.303
    2    HA   GLN 730           HA       GLN 730  44.646 -25.016   4.968
    3    HB2  GLN 730           HB2      GLN 730  44.997 -27.102   3.648
    4    HB3  GLN 730           HB3      GLN 730  46.720 -26.732   3.618
    5    HG2  GLN 730           HG2      GLN 730  46.858 -26.845   5.993
    6    HG3  GLN 730           HG3      GLN 730  45.134 -27.100   6.149
    7   HE21  GLN 730          HE21      GLN 730  45.250 -29.086   7.118
    8   HE22  GLN 730          HE22      GLN 730  45.924 -30.471   6.339

  No H/Q in entry =           8
  In of MODEL   15
    1    H    ASP 731           H        ASP 731  45.548 -24.176   6.525
    2    HA   ASP 731           HA       ASP 731  47.929 -22.619   6.329
    3    HB2  ASP 731           HB2      ASP 731  46.046 -21.821   7.643
    4    HB3  ASP 731           HB3      ASP 731  46.045 -23.309   8.546

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLU 732           H        GLU 732  49.893 -23.559   6.490
    2    HA   GLU 732           HA       GLU 732  50.168 -26.175   7.572
    3    HB2  GLU 732           HB2      GLU 732  52.220 -24.211   6.570
    4    HB3  GLU 732           HB3      GLU 732  52.632 -25.795   7.198
    5    HG2  GLU 732           HG2      GLU 732  50.841 -25.256   4.843
    6    HG3  GLU 732           HG3      GLU 732  52.515 -25.815   4.773

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ARG 733           H        ARG 733  50.004 -23.244   9.060
    2    HA   ARG 733           HA       ARG 733  51.878 -23.718  11.146
    3    HB2  ARG 733           HB2      ARG 733  51.045 -21.462  10.436
    4    HB3  ARG 733           HB3      ARG 733  49.485 -21.874  11.120
    5    HG2  ARG 733           HG2      ARG 733  50.550 -20.525  12.723
    6    HG3  ARG 733           HG3      ARG 733  50.671 -22.175  13.322
    7    HD2  ARG 733           HD2      ARG 733  52.866 -20.796  11.790
    8    HD3  ARG 733           HD3      ARG 733  52.781 -20.799  13.550
    9    HE   ARG 733           HE       ARG 733  52.774 -23.346  13.174
   10   HH11  ARG 733          HH11      ARG 733  54.691 -20.986  11.327
   11   HH12  ARG 733          HH12      ARG 733  55.954 -22.086  10.986
   12   HH21  ARG 733          HH21      ARG 733  54.526 -24.841  12.665
   13   HH22  ARG 733          HH22      ARG 733  55.858 -24.299  11.748

  No H/Q in entry =          13
  In of MODEL   15
    1    H    SER 734           H        SER 734  48.296 -23.889  10.929
    2    HA   SER 734           HA       SER 734  48.373 -25.631  13.312
    3    HB2  SER 734           HB2      SER 734  46.094 -23.901  12.354
    4    HB3  SER 734           HB3      SER 734  46.157 -24.811  13.865
    5    HG   SER 734           HG       SER 734  48.243 -23.093  13.309

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LYS 735           H        LYS 735  47.937 -25.948   9.980
    2    HA   LYS 735           HA       LYS 735  47.132 -27.407   8.625
    3    HB2  LYS 735           HB2      LYS 735  47.000 -29.072  11.114
    4    HB3  LYS 735           HB3      LYS 735  46.372 -29.699   9.596
    5    HG2  LYS 735           HG2      LYS 735  49.200 -28.798  10.139
    6    HG3  LYS 735           HG3      LYS 735  48.644 -30.459   9.882
    7    HD2  LYS 735           HD2      LYS 735  47.699 -29.447   7.640
    8    HD3  LYS 735           HD3      LYS 735  48.881 -28.210   7.947
    9    HE2  LYS 735           HE2      LYS 735  50.704 -29.713   7.890
   10    HE3  LYS 735           HE3      LYS 735  49.639 -31.117   7.870
   11    HZ2  LYS 735           HZ1      LYS 735  49.915 -29.087   5.700
   12    HZ1  LYS 735           HZ2      LYS 735  48.829 -30.382   5.677
   13    HZ3  LYS 735           HZ3      LYS 735  50.479 -30.676   5.666

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ARG 736           H        ARG 736  45.458 -25.451   9.579
    2    HA   ARG 736           HA       ARG 736  42.738 -26.576   9.555
    3    HB2  ARG 736           HB2      ARG 736  42.117 -24.202  10.131
    4    HB3  ARG 736           HB3      ARG 736  43.157 -24.978  11.327
    5    HG2  ARG 736           HG2      ARG 736  45.104 -23.857  10.399
    6    HG3  ARG 736           HG3      ARG 736  44.098 -23.129   9.154
    7    HD2  ARG 736           HD2      ARG 736  43.041 -21.714  10.730
    8    HD3  ARG 736           HD3      ARG 736  43.732 -22.605  12.104
    9    HE   ARG 736           HE       ARG 736  45.929 -21.853  10.829
   10   HH11  ARG 736          HH11      ARG 736  43.092 -19.800  11.573
   11   HH12  ARG 736          HH12      ARG 736  44.049 -18.415  11.797
   12   HH21  ARG 736          HH21      ARG 736  47.147 -19.896  11.048
   13   HH22  ARG 736          HH22      ARG 736  46.340 -18.449  11.475

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ILE 737           H        ILE 737  41.244 -25.945   7.911
    2    HA   ILE 737           HA       ILE 737  42.475 -24.852   5.541
    3    HB   ILE 737           HB       ILE 737  39.554 -25.559   5.984
    4   HG12  ILE 737          HG12      ILE 737  41.001 -27.553   6.347
    5   HG13  ILE 737          HG13      ILE 737  40.000 -27.714   4.909
    6   HG22  ILE 737          HG21      ILE 737  41.140 -25.362   3.423
    7   HG21  ILE 737          HG22      ILE 737  40.249 -24.034   4.123
    8   HG23  ILE 737          HG23      ILE 737  39.378 -25.485   3.595
    9   HD12  ILE 737          HD11      ILE 737  42.905 -26.983   5.007
   10   HD11  ILE 737          HD12      ILE 737  41.898 -27.078   3.551
   11   HD13  ILE 737          HD13      ILE 737  42.225 -28.539   4.500

  No H/Q in entry =          11
  In of MODEL   15
    1    H    LEU 738           H        LEU 738  42.517 -22.752   5.274
    2    HA   LEU 738           HA       LEU 738  40.512 -21.201   6.664
    3    HB2  LEU 738           HB2      LEU 738  42.118 -19.276   6.666
    4    HB3  LEU 738           HB3      LEU 738  42.456 -20.583   7.766
    5    HG   LEU 738           HG       LEU 738  44.458 -21.208   6.452
    6   HD12  LEU 738          HD11      LEU 738  45.058 -20.107   4.451
    7   HD11  LEU 738          HD12      LEU 738  43.305 -19.683   4.298
    8   HD13  LEU 738          HD13      LEU 738  43.816 -21.339   4.417
    9   HD23  LEU 738          HD21      LEU 738  45.693 -19.120   6.449
   10   HD22  LEU 738          HD22      LEU 738  44.714 -19.289   7.904
   11   HD21  LEU 738          HD23      LEU 738  44.178 -18.229   6.604

  No H/Q in entry =          11
  In of MODEL   15
    1    HA   PRO 739           HA       PRO 739  39.849 -19.312   2.685
    2    HB2  PRO 739           HB2      PRO 739  38.489 -17.122   3.408
    3    HB3  PRO 739           HB3      PRO 739  37.745 -18.727   3.355
    4    HG2  PRO 739           HG2      PRO 739  38.452 -17.088   5.696
    5    HG3  PRO 739           HG3      PRO 739  37.344 -18.464   5.582
    6    HD2  PRO 739           HD2      PRO 739  40.033 -18.430   6.578
    7    HD3  PRO 739           HD3      PRO 739  38.930 -19.813   6.446

  No H/Q in entry =           7
  In of MODEL   15
    1    H    LEU 740           H        LEU 740  41.607 -18.577   1.876
    2    HA   LEU 740           HA       LEU 740  42.763 -16.042   2.810
    3    HB2  LEU 740           HB2      LEU 740  44.032 -18.444   1.523
    4    HB3  LEU 740           HB3      LEU 740  44.751 -16.870   1.314
    5    HG   LEU 740           HG       LEU 740  44.440 -18.306   3.998
    6   HD12  LEU 740          HD11      LEU 740  46.787 -18.499   3.895
    7   HD11  LEU 740          HD12      LEU 740  46.795 -17.859   2.217
    8   HD13  LEU 740          HD13      LEU 740  45.966 -19.372   2.618
    9   HD23  LEU 740          HD21      LEU 740  45.819 -16.504   4.845
   10   HD22  LEU 740          HD22      LEU 740  44.316 -15.844   4.209
   11   HD21  LEU 740          HD23      LEU 740  45.806 -15.710   3.272

  No H/Q in entry =          11
  In of MODEL   15
    1    H    THR 741           H        THR 741  44.130 -15.357   0.575
    2    HA   THR 741           HA       THR 741  42.098 -15.339  -1.503
    3    HB   THR 741           HB       THR 741  43.632 -12.846  -0.776
    4    HG1  THR 741           HG1      THR 741  41.064 -13.527   0.301
    5   HG23  THR 741          HG21      THR 741  41.663 -11.766  -1.731
    6   HG22  THR 741          HG22      THR 741  40.893 -13.343  -1.894
    7   HG21  THR 741          HG23      THR 741  42.323 -12.968  -2.846

  No H/Q in entry =           7
  In of MODEL   15
    1    H    VAL 742           H        VAL 742  43.041 -15.020  -3.608
    2    HA   VAL 742           HA       VAL 742  45.312 -16.376  -4.286
    3    HB   VAL 742           HB       VAL 742  44.182 -13.970  -5.716
    4   HG12  VAL 742          HG11      VAL 742  45.183 -14.887  -7.746
    5   HG11  VAL 742          HG12      VAL 742  46.053 -16.082  -6.766
    6   HG13  VAL 742          HG13      VAL 742  46.369 -14.358  -6.562
    7   HG21  VAL 742          HG21      VAL 742  43.646 -16.898  -6.014
    8   HG23  VAL 742          HG22      VAL 742  43.112 -15.616  -7.119
    9   HG22  VAL 742          HG23      VAL 742  42.552 -15.614  -5.443

  No H/Q in entry =           9
  In of MODEL   15
    1    H    CYS 743           H        CYS 743  45.253 -12.825  -4.289
    2    HA   CYS 743           HA       CYS 743  47.988 -12.501  -4.510
    3    HB2  CYS 743           HB2      CYS 743  46.548 -10.655  -4.959
    4    HB3  CYS 743           HB3      CYS 743  45.897 -10.695  -3.324

  No H/Q in entry =           4
  In of MODEL   15
    1    H    LYS 744           H        LYS 744  45.986 -12.611  -1.624
    2    HA   LYS 744           HA       LYS 744  47.812 -11.899   0.313
    3    HB2  LYS 744           HB2      LYS 744  45.329 -12.306   0.390
    4    HB3  LYS 744           HB3      LYS 744  45.693 -13.989   0.583
    5    HG2  LYS 744           HG2      LYS 744  46.847 -13.621   2.662
    6    HG3  LYS 744           HG3      LYS 744  46.653 -11.876   2.499
    7    HD2  LYS 744           HD2      LYS 744  44.378 -13.844   2.701
    8    HD3  LYS 744           HD3      LYS 744  45.017 -12.924   4.067
    9    HE2  LYS 744           HE2      LYS 744  43.746 -11.754   1.568
   10    HE3  LYS 744           HE3      LYS 744  42.972 -11.919   3.136
   11    HZ1  LYS 744           HZ1      LYS 744  44.604 -10.433   4.071
   12    HZ3  LYS 744           HZ2      LYS 744  43.783  -9.692   2.813
   13    HZ2  LYS 744           HZ3      LYS 744  45.361 -10.225   2.574

  No H/Q in entry =          13
  In of MODEL   15
    1    H    MET 745           H        MET 745  46.878 -15.130  -0.768
    2    HA   MET 745           HA       MET 745  48.772 -16.670   0.635
    3    HB2  MET 745           HB2      MET 745  47.141 -17.994  -0.199
    4    HB3  MET 745           HB3      MET 745  46.917 -17.058  -1.654
    5    HG2  MET 745           HG2      MET 745  47.774 -19.060  -2.455
    6    HG3  MET 745           HG3      MET 745  49.176 -18.037  -2.372
    7    HE3  MET 745           HE1      MET 745  47.279 -20.138   0.477
    8    HE2  MET 745           HE2      MET 745  48.206 -21.642   0.250
    9    HE1  MET 745           HE3      MET 745  47.275 -20.971  -1.069

  No H/Q in entry =           9
  In of MODEL   15
    1    H    HIS 746           H        HIS 746  48.839 -15.409  -2.719
    2    HA   HIS 746           HA       HIS 746  51.356 -16.514  -3.408
    3    HB2  HIS 746           HB2      HIS 746  49.762 -14.270  -4.447
    4    HB3  HIS 746           HB3      HIS 746  51.460 -14.299  -4.939
    5    HD1  HIS 746           HD1      HIS 746  52.088 -16.702  -6.213
    6    HD2  HIS 746           HD2      HIS 746  48.088 -15.626  -5.994
    7    HE1  HIS 746           HE1      HIS 746  50.971 -17.920  -8.078
    8    HE2  HIS 746           HE2      HIS 746  48.617 -17.060  -8.081

  No H/Q in entry =           8
  In of MODEL   15
    1    H    VAL 747           H        VAL 747  50.565 -13.473  -1.913
    2    HA   VAL 747           HA       VAL 747  53.150 -12.442  -1.826
    3    HB   VAL 747           HB       VAL 747  50.619 -11.821  -0.315
    4   HG11  VAL 747          HG11      VAL 747  52.529 -11.363   1.180
    5   HG13  VAL 747          HG12      VAL 747  51.750  -9.883   0.639
    6   HG12  VAL 747          HG13      VAL 747  53.272 -10.392  -0.092
    7   HG22  VAL 747          HG21      VAL 747  50.753  -9.758  -1.626
    8   HG21  VAL 747          HG22      VAL 747  50.759 -11.194  -2.662
    9   HG23  VAL 747          HG23      VAL 747  52.266 -10.343  -2.325

  No H/Q in entry =           9
  In of MODEL   15
    1    H    LEU 748           H        LEU 748  51.239 -14.049   0.746
    2    HA   LEU 748           HA       LEU 748  53.426 -14.027   2.520
    3    HB2  LEU 748           HB2      LEU 748  52.094 -15.615   3.941
    4    HB3  LEU 748           HB3      LEU 748  51.246 -14.156   3.485
    5    HG   LEU 748           HG       LEU 748  50.045 -15.520   1.757
    6   HD11  LEU 748          HD11      LEU 748  51.228 -17.827   3.278
    7   HD13  LEU 748          HD12      LEU 748  51.537 -17.424   1.595
    8   HD12  LEU 748          HD13      LEU 748  49.928 -17.944   2.095
    9   HD22  LEU 748          HD21      LEU 748  49.002 -14.849   3.827
   10   HD21  LEU 748          HD22      LEU 748  49.690 -16.245   4.657
   11   HD23  LEU 748          HD23      LEU 748  48.486 -16.475   3.388

  No H/Q in entry =          11
  In of MODEL   15
    1    H    HIS 749           H        HIS 749  52.507 -16.194   0.065
    2    HA   HIS 749           HA       HIS 749  54.057 -18.459   0.696
    3    HB2  HIS 749           HB2      HIS 749  52.225 -17.998  -1.135
    4    HB3  HIS 749           HB3      HIS 749  53.590 -17.490  -2.108
    5    HD1  HIS 749           HD1      HIS 749  54.766 -19.326  -3.359
    6    HD2  HIS 749           HD2      HIS 749  52.369 -20.729  -0.281
    7    HE1  HIS 749           HE1      HIS 749  54.693 -21.823  -3.633
    8    HE2  HIS 749           HE2      HIS 749  53.081 -22.606  -1.880

  No H/Q in entry =           8
  In of MODEL   15
    1    H    CYS 750           H        CYS 750  54.664 -15.484  -1.097
    2    HA   CYS 750           HA       CYS 750  57.349 -16.100  -1.777
    3    HB2  CYS 750           HB2      CYS 750  56.088 -14.547  -3.139
    4    HB3  CYS 750           HB3      CYS 750  55.839 -13.479  -1.764

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLN 751           H        GLN 751  55.764 -14.431   0.884
    2    HA   GLN 751           HA       GLN 751  58.099 -13.310   2.009
    3    HB2  GLN 751           HB2      GLN 751  55.557 -14.112   3.403
    4    HB3  GLN 751           HB3      GLN 751  56.805 -13.076   4.073
    5    HG2  GLN 751           HG2      GLN 751  56.394 -11.462   2.252
    6    HG3  GLN 751           HG3      GLN 751  55.089 -12.496   1.678
    7   HE21  GLN 751          HE21      GLN 751  54.931  -9.776   2.619
    8   HE22  GLN 751          HE22      GLN 751  53.901  -9.807   4.010

  No H/Q in entry =           8
  In of MODEL   15
    1    H    GLY 752           H        GLY 752  56.795 -16.499   2.151
    2    HA3  GLY 752           HA2      GLY 752  58.507 -18.220   2.618
    3    HA2  GLY 752           HA3      GLY 752  59.004 -17.219   3.976

  No H/Q in entry =           3
  In of MODEL   15
    1    H    ARG 753           H        ARG 753  55.621 -17.478   3.370
    2    HA   ARG 753           HA       ARG 753  55.350 -19.144   5.749
    3    HB2  ARG 753           HB2      ARG 753  53.256 -17.646   4.149
    4    HB3  ARG 753           HB3      ARG 753  52.985 -18.486   5.668
    5    HG2  ARG 753           HG2      ARG 753  54.715 -16.048   5.274
    6    HG3  ARG 753           HG3      ARG 753  53.092 -16.053   5.955
    7    HD2  ARG 753           HD2      ARG 753  53.925 -17.548   7.780
    8    HD3  ARG 753           HD3      ARG 753  55.551 -17.372   7.123
    9    HE   ARG 753           HE       ARG 753  54.317 -14.865   7.647
   10   HH11  ARG 753          HH11      ARG 753  56.081 -17.516   9.247
   11   HH12  ARG 753          HH12      ARG 753  56.638 -16.541  10.518
   12   HH21  ARG 753          HH21      ARG 753  55.114 -13.540   9.468
   13   HH22  ARG 753          HH22      ARG 753  56.091 -14.284  10.634

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ASN 754           H        ASN 754  54.331 -21.157   5.611
    2    HA   ASN 754           HA       ASN 754  54.172 -22.160   2.879
    3    HB2  ASN 754           HB2      ASN 754  54.387 -23.716   5.473
    4    HB3  ASN 754           HB3      ASN 754  54.277 -24.432   3.875
    5   HD21  ASN 754          HD21      ASN 754  56.278 -22.814   6.136
    6   HD22  ASN 754          HD22      ASN 754  57.769 -23.021   5.299

  No H/Q in entry =           6
  In of MODEL   15
    1    H    TYR 755           H        TYR 755  52.358 -22.639   2.016
    2    HA   TYR 755           HA       TYR 755  50.098 -23.418   3.622
    3    HB2  TYR 755           HB2      TYR 755  50.082 -21.028   1.801
    4    HB3  TYR 755           HB3      TYR 755  48.654 -22.004   2.115
    5    HD1  TYR 755           HD1      TYR 755  51.177 -19.841   3.734
    6    HD2  TYR 755           HD2      TYR 755  47.437 -21.778   4.064
    7    HE1  TYR 755           HE1      TYR 755  50.721 -18.581   5.777
    8    HE2  TYR 755           HE2      TYR 755  46.966 -20.551   6.099
    9    HH   TYR 755           HH       TYR 755  48.298 -19.556   7.845

  No H/Q in entry =           9
  In of MODEL   15
    1    H    THR 756           H        THR 756  48.954 -24.867   2.708
    2    HA   THR 756           HA       THR 756  49.747 -25.815   0.068
    3    HB   THR 756           HB       THR 756  48.169 -27.122   2.302
    4    HG1  THR 756           HG1      THR 756  50.044 -27.400   3.212
    5   HG22  THR 756          HG21      THR 756  49.496 -28.294  -0.129
    6   HG21  THR 756          HG22      THR 756  47.764 -28.023   0.095
    7   HG23  THR 756          HG23      THR 756  48.609 -29.197   1.120

  No H/Q in entry =           7
  In of MODEL   15
    1    H    LEU 757           H        LEU 757  48.047 -25.965  -1.574
    2    HA   LEU 757           HA       LEU 757  45.638 -24.655  -0.679
    3    HB2  LEU 757           HB2      LEU 757  46.591 -25.140  -3.472
    4    HB3  LEU 757           HB3      LEU 757  44.966 -24.594  -3.108
    5    HG   LEU 757           HG       LEU 757  46.285 -22.776  -1.733
    6   HD13  LEU 757          HD11      LEU 757  48.274 -22.007  -2.888
    7   HD12  LEU 757          HD12      LEU 757  48.218 -23.433  -3.917
    8   HD11  LEU 757          HD13      LEU 757  48.479 -23.611  -2.181
    9   HD21  LEU 757          HD21      LEU 757  44.647 -22.373  -3.387
   10   HD23  LEU 757          HD22      LEU 757  45.805 -22.679  -4.695
   11   HD22  LEU 757          HD23      LEU 757  46.014 -21.284  -3.614

  No H/Q in entry =          11
  In of MODEL   15
    1    H    THR 758           H        THR 758  43.605 -25.330  -1.000
    2    HA   THR 758           HA       THR 758  43.358 -28.214  -1.298
    3    HB   THR 758           HB       THR 758  41.661 -28.009   0.608
    4    HG1  THR 758           HG1      THR 758  42.735 -26.011   1.893
    5   HG23  THR 758          HG21      THR 758  43.385 -28.150   2.340
    6   HG22  THR 758          HG22      THR 758  44.551 -27.405   1.250
    7   HG21  THR 758          HG23      THR 758  43.907 -29.006   0.887

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLY 759           H        GLY 759  40.626 -28.387  -0.947
    2    HA3  GLY 759           HA2      GLY 759  39.674 -27.297  -3.418
    3    HA2  GLY 759           HA3      GLY 759  38.766 -28.308  -2.301

  No H/Q in entry =           3
  In of MODEL   15
    1    H    ARG 760           H        ARG 760  37.779 -26.011  -3.620
    2    HA   ARG 760           HA       ARG 760  37.858 -23.804  -1.771
    3    HB2  ARG 760           HB2      ARG 760  36.460 -22.606  -3.376
    4    HB3  ARG 760           HB3      ARG 760  37.773 -23.410  -4.209
    5    HG2  ARG 760           HG2      ARG 760  36.011 -23.824  -5.634
    6    HG3  ARG 760           HG3      ARG 760  35.991 -25.271  -4.624
    7    HD2  ARG 760           HD2      ARG 760  34.241 -24.246  -3.222
    8    HD3  ARG 760           HD3      ARG 760  34.245 -22.837  -4.277
    9    HE   ARG 760           HE       ARG 760  33.618 -25.500  -5.320
   10   HH11  ARG 760          HH11      ARG 760  32.650 -22.104  -4.834
   11   HH12  ARG 760          HH12      ARG 760  31.197 -22.258  -5.683
   12   HH21  ARG 760          HH21      ARG 760  31.585 -25.686  -6.466
   13   HH22  ARG 760          HH22      ARG 760  30.556 -24.347  -6.629

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ASP 761           H        ASP 761  36.175 -26.624  -1.945
    2    HA   ASP 761           HA       ASP 761  33.835 -25.600  -0.567
    3    HB2  ASP 761           HB2      ASP 761  32.891 -27.841  -0.656
    4    HB3  ASP 761           HB3      ASP 761  33.530 -27.442  -2.237

  No H/Q in entry =           4
  In of MODEL   15
    1    H    SER 762           H        SER 762  36.918 -26.270   0.333
    2    HA   SER 762           HA       SER 762  36.378 -27.798   2.693
    3    HB2  SER 762           HB2      SER 762  38.903 -26.457   1.775
    4    HB3  SER 762           HB3      SER 762  38.776 -27.644   3.070
    5    HG   SER 762           HG       SER 762  37.600 -28.831   1.186

  No H/Q in entry =           5
  In of MODEL   15
    1    H    CYS 763           H        CYS 763  36.759 -24.366   1.974
    2    HA   CYS 763           HA       CYS 763  36.545 -23.934   4.867
    3    HB2  CYS 763           HB2      CYS 763  37.660 -21.840   4.657
    4    HB3  CYS 763           HB3      CYS 763  38.649 -23.031   3.842

  No H/Q in entry =           4
  In of MODEL   15
    1    H    THR 764           H        THR 764  35.415 -21.912   5.420
    2    HA   THR 764           HA       THR 764  33.132 -21.531   3.686
    3    HB   THR 764           HB       THR 764  33.698 -20.384   6.447
    4    HG1  THR 764           HG1      THR 764  32.328 -22.710   5.558
    5   HG21  THR 764          HG21      THR 764  31.141 -20.587   4.839
    6   HG23  THR 764          HG22      THR 764  32.054 -19.107   5.131
    7   HG22  THR 764          HG23      THR 764  31.275 -19.944   6.474

  No H/Q in entry =           7
  In of MODEL   15
    1    H    LEU 765           H        LEU 765  33.649 -20.234   2.106
    2    HA   LEU 765           HA       LEU 765  35.747 -18.307   2.263
    3    HB2  LEU 765           HB2      LEU 765  34.723 -19.832   0.296
    4    HB3  LEU 765           HB3      LEU 765  33.783 -18.365   0.062
    5    HG   LEU 765           HG       LEU 765  35.820 -17.089  -0.360
    6   HD11  LEU 765          HD11      LEU 765  37.209 -19.727   0.093
    7   HD13  LEU 765          HD12      LEU 765  37.374 -18.275   1.087
    8   HD12  LEU 765          HD13      LEU 765  37.962 -18.285  -0.569
    9   HD22  LEU 765          HD21      LEU 765  36.462 -18.140  -2.453
   10   HD21  LEU 765          HD22      LEU 765  34.710 -18.232  -2.241
   11   HD23  LEU 765          HD23      LEU 765  35.721 -19.650  -1.943

  No H/Q in entry =          11
  In of MODEL   15
    1    HA   PRO 766           HA       PRO 766  33.458 -14.870   3.841
    2    HB2  PRO 766           HB2      PRO 766  34.509 -12.858   2.186
    3    HB3  PRO 766           HB3      PRO 766  35.158 -13.379   3.741
    4    HG2  PRO 766           HG2      PRO 766  36.013 -14.104   0.992
    5    HG3  PRO 766           HG3      PRO 766  36.975 -13.949   2.470
    6    HD2  PRO 766           HD2      PRO 766  36.329 -16.333   1.404
    7    HD3  PRO 766           HD3      PRO 766  36.484 -16.127   3.148

  No H/Q in entry =           7
  In of MODEL   15
    1    H    ALA 767           H        ALA 767  33.713 -14.776   0.297
    2    HA   ALA 767           HA       ALA 767  30.839 -14.275   0.222
    3    HB3  ALA 767           HB1      ALA 767  32.883 -12.891  -1.530
    4    HB1  ALA 767           HB2      ALA 767  31.974 -12.127  -0.226
    5    HB2  ALA 767           HB3      ALA 767  31.132 -12.734  -1.653

  No H/Q in entry =           5
  In of MODEL   15
    1    H    SER 768           H        SER 768  30.181 -16.139  -0.378
    2    HA   SER 768           HA       SER 768  31.332 -17.238  -2.816
    3    HB2  SER 768           HB2      SER 768  30.741 -19.473  -1.735
    4    HB3  SER 768           HB3      SER 768  32.186 -18.642  -1.150
    5    HG   SER 768           HG       SER 768  31.116 -19.194   0.629

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA 769           H        ALA 769  28.595 -17.940  -0.691
    2    HA   ALA 769           HA       ALA 769  26.950 -18.458  -3.007
    3    HB3  ALA 769           HB1      ALA 769  26.260 -18.568  -0.079
    4    HB2  ALA 769           HB2      ALA 769  26.824 -19.928  -1.053
    5    HB1  ALA 769           HB3      ALA 769  25.264 -19.172  -1.402

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLU 770           H        GLU 770  25.370 -17.261  -3.768
    2    HA   GLU 770           HA       GLU 770  24.446 -15.344  -4.422
    3    HB2  GLU 770           HB2      GLU 770  22.402 -14.882  -3.022
    4    HB3  GLU 770           HB3      GLU 770  22.625 -16.516  -3.609
    5    HG2  GLU 770           HG2      GLU 770  23.571 -17.080  -1.358
    6    HG3  GLU 770           HG3      GLU 770  23.068 -15.476  -0.828

  No H/Q in entry =           6
  In of MODEL   15
    1    H    LYS 771           H        LYS 771  25.211 -13.459  -4.739
    2    HA   LYS 771           HA       LYS 771  26.414 -11.983  -2.578
    3    HB2  LYS 771           HB2      LYS 771  25.927 -11.011  -5.405
    4    HB3  LYS 771           HB3      LYS 771  26.947 -10.264  -4.205
    5    HG2  LYS 771           HG2      LYS 771  27.420 -12.867  -5.632
    6    HG3  LYS 771           HG3      LYS 771  28.294 -11.362  -5.850
    7    HD2  LYS 771           HD2      LYS 771  29.789 -12.345  -4.465
    8    HD3  LYS 771           HD3      LYS 771  28.695 -11.795  -3.200
    9    HE2  LYS 771           HE2      LYS 771  29.284 -14.163  -2.902
   10    HE3  LYS 771           HE3      LYS 771  27.564 -13.970  -3.215
   11    HZ2  LYS 771           HZ1      LYS 771  28.585 -15.810  -4.502
   12    HZ1  LYS 771           HZ2      LYS 771  29.566 -14.739  -5.300
   13    HZ3  LYS 771           HZ3      LYS 771  27.910 -14.657  -5.503

  No H/Q in entry =          13
  In of MODEL   15
    1    H    ALA 772           H        ALA 772  25.533 -10.388  -1.433
    2    HA   ALA 772           HA       ALA 772  22.995  -9.230  -2.304
    3    HB3  ALA 772           HB1      ALA 772  23.830 -10.009   0.507
    4    HB2  ALA 772           HB2      ALA 772  22.573 -10.793  -0.447
    5    HB1  ALA 772           HB3      ALA 772  22.362  -9.123   0.091

  No H/Q in entry =           5
  In of MODEL   15
    1    H    CYS 773           H        CYS 773  22.849  -7.001  -1.772
    2    HA   CYS 773           HA       CYS 773  25.328  -5.664  -1.994
    3    HB2  CYS 773           HB2      CYS 773  23.130  -4.785  -2.807
    4    HB3  CYS 773           HB3      CYS 773  22.699  -4.470  -1.135

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLY 774           H        GLY 774  26.755  -5.333  -0.530
    2    HA3  GLY 774           HA2      GLY 774  27.139  -4.367   1.725
    3    HA2  GLY 774           HA3      GLY 774  26.001  -5.598   2.293

  No H/Q in entry =           3
  In of MODEL   15
    1    H    ALA 775           H        ALA 775  26.976  -7.465   0.193
    2    HA   ALA 775           HA       ALA 775  29.759  -7.857   0.955
    3    HB2  ALA 775           HB1      ALA 775  27.677 -10.047   0.815
    4    HB3  ALA 775           HB2      ALA 775  28.386  -9.428   2.301
    5    HB1  ALA 775           HB3      ALA 775  29.398 -10.276   1.126

  No H/Q in entry =           5
  In of MODEL   15
    1    H    CYS 776           H        CYS 776  30.568  -7.296  -0.940
    2    HA   CYS 776           HA       CYS 776  30.022  -8.869  -3.278
    3    HB2  CYS 776           HB2      CYS 776  29.573  -5.855  -3.340
    4    HB3  CYS 776           HB3      CYS 776  29.508  -6.935  -4.718

  No H/Q in entry =           4
  In of MODEL   15
    1    HA   PRO 777           HA       PRO 777  34.356  -7.417  -3.281
    2    HB2  PRO 777           HB2      PRO 777  34.821  -9.443  -5.321
    3    HB3  PRO 777           HB3      PRO 777  35.444  -9.400  -3.669
    4    HG2  PRO 777           HG2      PRO 777  33.630 -11.226  -4.523
    5    HG3  PRO 777           HG3      PRO 777  33.697 -10.648  -2.847
    6    HD2  PRO 777           HD2      PRO 777  31.866  -9.819  -5.074
    7    HD3  PRO 777           HD3      PRO 777  31.498 -10.159  -3.363

  No H/Q in entry =           7
  In of MODEL   15
    1    H    LEU 778           H        LEU 778  35.824  -7.393  -5.546
    2    HA   LEU 778           HA       LEU 778  35.012  -5.250  -7.033
    3    HB2  LEU 778           HB2      LEU 778  36.677  -5.947  -8.782
    4    HB3  LEU 778           HB3      LEU 778  37.289  -5.837  -7.148
    5    HG   LEU 778           HG       LEU 778  36.534  -8.496  -8.381
    6   HD12  LEU 778          HD11      LEU 778  38.893  -8.827  -8.911
    7   HD11  LEU 778          HD12      LEU 778  39.243  -7.159  -8.453
    8   HD13  LEU 778          HD13      LEU 778  38.205  -7.499  -9.841
    9   HD22  LEU 778          HD21      LEU 778  36.806  -8.634  -6.002
   10   HD21  LEU 778          HD22      LEU 778  38.269  -7.669  -6.065
   11   HD23  LEU 778          HD23      LEU 778  38.267  -9.299  -6.738

  No H/Q in entry =          11
  In of MODEL   15
    1    H    TRP 779           H        TRP 779  34.450  -8.637  -7.974
    2    HA   TRP 779           HA       TRP 779  33.162  -7.925 -10.431
    3    HB2  TRP 779           HB2      TRP 779  32.494 -10.418 -10.354
    4    HB3  TRP 779           HB3      TRP 779  34.188  -9.996 -10.574
    5    HD1  TRP 779           HD1      TRP 779  31.795 -11.289  -7.810
    6    HE1  TRP 779           HE1      TRP 779  33.271 -12.513  -6.035
    7    HE3  TRP 779           HE3      TRP 779  36.367 -10.306  -9.734
    8    HZ2  TRP 779           HZ2      TRP 779  36.003 -12.947  -5.557
    9    HZ3  TRP 779           HZ3      TRP 779  38.364 -11.147  -8.586
   10    HH2  TRP 779           HH2      TRP 779  38.185 -12.431  -6.555

  No H/Q in entry =          10
  In of MODEL   15
    1    H    GLY 780           H        GLY 780  32.072  -7.646  -7.349
    2    HA3  GLY 780           HA2      GLY 780  29.307  -8.191  -8.170
    3    HA2  GLY 780           HA3      GLY 780  29.885  -8.350  -6.511

  No H/Q in entry =           3
  In of MODEL   15
    1    H    LYS 781           H        LYS 781  28.149  -6.419  -8.395
    2    HA   LYS 781           HA       LYS 781  28.866  -4.145  -6.737
    3    HB2  LYS 781           HB2      LYS 781  29.942  -3.972  -8.931
    4    HB3  LYS 781           HB3      LYS 781  28.352  -3.945  -9.683
    5    HG2  LYS 781           HG2      LYS 781  27.802  -1.874  -8.548
    6    HG3  LYS 781           HG3      LYS 781  29.337  -1.908  -7.685
    7    HD2  LYS 781           HD2      LYS 781  29.026  -1.708 -10.684
    8    HD3  LYS 781           HD3      LYS 781  29.387  -0.366  -9.601
    9    HE2  LYS 781           HE2      LYS 781  31.101  -2.824  -9.870
   10    HE3  LYS 781           HE3      LYS 781  31.418  -1.327 -10.744
   11    HZ3  LYS 781           HZ1      LYS 781  32.770  -1.444  -8.777
   12    HZ2  LYS 781           HZ2      LYS 781  31.448  -1.736  -7.794
   13    HZ1  LYS 781           HZ3      LYS 781  31.629  -0.239  -8.539

  No H/Q in entry =          13
  In of MODEL   15
    1    H    CYS 782           H        CYS 782  27.077  -3.487  -5.750
    2    HA   CYS 782           HA       CYS 782  24.557  -4.285  -6.902
    3    HB2  CYS 782           HB2      CYS 782  23.578  -3.360  -4.724
    4    HB3  CYS 782           HB3      CYS 782  24.511  -4.837  -4.661

  No H/Q in entry =           4
  In of MODEL   15
    1    H    ASP 783           H        ASP 783  22.686  -2.747  -6.788
    2    HA   ASP 783           HA       ASP 783  23.450  -0.621  -8.487
    3    HB2  ASP 783           HB2      ASP 783  20.969  -0.162  -8.629
    4    HB3  ASP 783           HB3      ASP 783  21.462  -1.776  -9.110

  No H/Q in entry =           4
  In of MODEL   15
    1    H    ALA 784           H        ALA 784  20.995   0.020  -6.133
    2    HA   ALA 784           HA       ALA 784  22.670   2.031  -4.853
    3    HB3  ALA 784           HB1      ALA 784  20.848   3.676  -4.999
    4    HB1  ALA 784           HB2      ALA 784  19.898   2.541  -5.958
    5    HB2  ALA 784           HB3      ALA 784  21.399   3.201  -6.606

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLU 785           H        GLU 785  19.870  -0.099  -4.896
    2    HA   GLU 785           HA       GLU 785  19.303   0.430  -2.126
    3    HB2  GLU 785           HB2      GLU 785  17.482  -0.141  -3.735
    4    HB3  GLU 785           HB3      GLU 785  18.228  -1.705  -3.987
    5    HG2  GLU 785           HG2      GLU 785  16.297  -1.821  -2.479
    6    HG3  GLU 785           HG3      GLU 785  17.790  -2.343  -1.704

  No H/Q in entry =           6
  In of MODEL   15
    1    H    SER 786           H        SER 786  19.549  -1.150  -0.517
    2    HA   SER 786           HA       SER 786  22.085  -2.489  -0.786
    3    HB2  SER 786           HB2      SER 786  20.307  -2.058   1.605
    4    HB3  SER 786           HB3      SER 786  21.987  -2.599   1.635
    5    HG   SER 786           HG       SER 786  21.275  -0.161   1.800

  No H/Q in entry =           5
  In of MODEL   15
    1    H    SER 787           H        SER 787  19.585  -3.654  -2.018
    2    HA   SER 787           HA       SER 787  19.206  -6.020  -0.389
    3    HB2  SER 787           HB2      SER 787  17.200  -4.869  -1.180
    4    HB3  SER 787           HB3      SER 787  17.710  -5.097  -2.849
    5    HG   SER 787           HG       SER 787  16.566  -6.843  -1.064

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LYS 788           H        LYS 788  19.487  -5.632  -3.960
    2    HA   LYS 788           HA       LYS 788  20.665  -8.307  -3.961
    3    HB2  LYS 788           HB2      LYS 788  20.175  -8.441  -6.285
    4    HB3  LYS 788           HB3      LYS 788  18.744  -7.809  -5.495
    5    HG2  LYS 788           HG2      LYS 788  19.255  -5.573  -6.281
    6    HG3  LYS 788           HG3      LYS 788  20.779  -6.137  -6.981
    7    HD2  LYS 788           HD2      LYS 788  19.385  -7.725  -8.361
    8    HD3  LYS 788           HD3      LYS 788  17.974  -6.842  -7.788
    9    HE2  LYS 788           HE2      LYS 788  20.283  -5.649  -9.317
   10    HE3  LYS 788           HE3      LYS 788  18.735  -6.104 -10.011
   11    HZ1  LYS 788           HZ1      LYS 788  17.708  -4.442  -8.475
   12    HZ3  LYS 788           HZ2      LYS 788  18.714  -3.816  -9.639
   13    HZ2  LYS 788           HZ3      LYS 788  19.270  -3.919  -8.058

  No H/Q in entry =          13
  In of MODEL   15
    1    H    CYS 789           H        CYS 789  22.384  -8.656  -5.684
    2    HA   CYS 789           HA       CYS 789  24.104  -6.342  -6.063
    3    HB2  CYS 789           HB2      CYS 789  24.814  -7.677  -4.015
    4    HB3  CYS 789           HB3      CYS 789  25.103  -9.034  -5.092

  No H/Q in entry =           4
  In of MODEL   15
    1    H    VAL 790           H        VAL 790  25.136  -6.416  -8.081
    2    HA   VAL 790           HA       VAL 790  24.233  -8.598  -9.805
    3    HB   VAL 790           HB       VAL 790  25.103  -5.767 -10.493
    4   HG13  VAL 790          HG11      VAL 790  25.711  -7.309 -12.292
    5   HG12  VAL 790          HG12      VAL 790  24.377  -6.267 -12.784
    6   HG11  VAL 790          HG13      VAL 790  24.064  -7.939 -12.321
    7   HG22  VAL 790          HG21      VAL 790  22.758  -5.456 -11.144
    8   HG21  VAL 790          HG22      VAL 790  22.917  -5.877  -9.430
    9   HG23  VAL 790          HG23      VAL 790  22.429  -7.103 -10.605

  No H/Q in entry =           9
  In of MODEL   15
    1    H    CYS 791           H        CYS 791  25.684  -9.703 -10.971
    2    HA   CYS 791           HA       CYS 791  28.481  -9.277 -10.232
    3    HB2  CYS 791           HB2      CYS 791  27.275 -11.702 -11.588
    4    HB3  CYS 791           HB3      CYS 791  28.908 -11.513 -10.985

  No H/Q in entry =           4
  In of MODEL   15
    1    H    ARG 792           H        ARG 792  29.930  -8.836 -11.637
    2    HA   ARG 792           HA       ARG 792  29.141  -7.741 -14.169
    3    HB2  ARG 792           HB2      ARG 792  31.753  -7.951 -12.698
    4    HB3  ARG 792           HB3      ARG 792  31.567  -7.105 -14.229
    5    HG2  ARG 792           HG2      ARG 792  30.125  -5.505 -13.290
    6    HG3  ARG 792           HG3      ARG 792  29.897  -6.458 -11.826
    7    HD2  ARG 792           HD2      ARG 792  31.386  -4.531 -11.501
    8    HD3  ARG 792           HD3      ARG 792  32.173  -6.074 -11.174
    9    HE   ARG 792           HE       ARG 792  32.586  -5.188 -13.847
   10   HH11  ARG 792          HH11      ARG 792  33.757  -4.864 -10.501
   11   HH12  ARG 792          HH12      ARG 792  35.274  -4.287 -11.014
   12   HH21  ARG 792          HH21      ARG 792  34.715  -4.476 -14.436
   13   HH22  ARG 792          HH22      ARG 792  35.845  -4.152 -13.182

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLU 793           H        GLU 793  30.895  -8.191 -16.010
    2    HA   GLU 793           HA       GLU 793  31.300 -11.070 -16.102
    3    HB2  GLU 793           HB2      GLU 793  30.385  -9.362 -18.431
    4    HB3  GLU 793           HB3      GLU 793  30.803 -11.070 -18.539
    5    HG2  GLU 793           HG2      GLU 793  29.003 -11.527 -16.858
    6    HG3  GLU 793           HG3      GLU 793  28.520  -9.842 -17.014

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ALA 794           H        ALA 794  32.913 -11.655 -17.947
    2    HA   ALA 794           HA       ALA 794  35.353 -10.786 -16.842
    3    HB1  ALA 794           HB1      ALA 794  34.883 -12.541 -19.239
    4    HB2  ALA 794           HB2      ALA 794  34.895 -13.058 -17.550
    5    HB3  ALA 794           HB3      ALA 794  36.361 -12.449 -18.274

  No H/Q in entry =           5
  In of MODEL   15
    1    H    SER 795           H        SER 795  33.606  -9.532 -19.427
    2    HA   SER 795           HA       SER 795  35.996  -8.670 -20.769
    3    HB2  SER 795           HB2      SER 795  33.116  -8.416 -21.640
    4    HB3  SER 795           HB3      SER 795  34.534  -8.043 -22.621
    5    HG   SER 795           HG       SER 795  35.094 -10.123 -22.676

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLU 796           H        GLU 796  34.174  -7.639 -18.294
    2    HA   GLU 796           HA       GLU 796  34.799  -4.879 -18.900
    3    HB2  GLU 796           HB2      GLU 796  32.366  -5.193 -19.191
    4    HB3  GLU 796           HB3      GLU 796  32.264  -5.858 -17.571
    5    HG2  GLU 796           HG2      GLU 796  31.473  -3.554 -17.645
    6    HG3  GLU 796           HG3      GLU 796  32.899  -3.707 -16.624

  No H/Q in entry =           6
  In of MODEL   15
    1    H    CYS 797           H        CYS 797  36.640  -6.023 -17.772
    2    HA   CYS 797           HA       CYS 797  36.418  -5.239 -14.956
    3    HB2  CYS 797           HB2      CYS 797  37.871  -7.641 -16.035
    4    HB3  CYS 797           HB3      CYS 797  38.196  -6.970 -14.442

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLU 798           H        GLU 798  37.403  -3.469 -14.692
    2    HA   GLU 798           HA       GLU 798  39.744  -2.655 -16.217
    3    HB2  GLU 798           HB2      GLU 798  37.790  -1.302 -14.427
    4    HB3  GLU 798           HB3      GLU 798  39.335  -0.541 -14.775
    5    HG2  GLU 798           HG2      GLU 798  37.446  -1.485 -16.893
    6    HG3  GLU 798           HG3      GLU 798  37.431   0.151 -16.233

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU 799           H        GLU 799  38.904  -3.661 -13.016
    2    HA   GLU 799           HA       GLU 799  41.212  -2.571 -11.832
    3    HB2  GLU 799           HB2      GLU 799  40.612  -4.093  -9.849
    4    HB3  GLU 799           HB3      GLU 799  39.527  -2.778 -10.265
    5    HG2  GLU 799           HG2      GLU 799  39.139  -5.533 -11.269
    6    HG3  GLU 799           HG3      GLU 799  38.544  -5.056  -9.673

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLU 800           H        GLU 800  42.764  -3.828 -10.606
    2    HA   GLU 800           HA       GLU 800  43.989  -5.535 -12.610
    3    HB2  GLU 800           HB2      GLU 800  45.243  -3.737 -10.552
    4    HB3  GLU 800           HB3      GLU 800  46.112  -4.700 -11.736
    5    HG2  GLU 800           HG2      GLU 800  45.318  -3.394 -13.524
    6    HG3  GLU 800           HG3      GLU 800  44.110  -2.602 -12.512

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLY 801           H        GLY 801  42.793  -7.217 -11.565
    2    HA3  GLY 801           HA2      GLY 801  43.964  -8.224  -9.113
    3    HA2  GLY 801           HA3      GLY 801  42.764  -9.054 -10.108

  No H/Q in entry =           3
  In of MODEL   15
    1    H    PHE 802           H        PHE 802  44.431 -10.746  -9.473
    2    HA   PHE 802           HA       PHE 802  46.859 -10.825 -11.043
    3    HB2  PHE 802           HB2      PHE 802  45.492 -12.796  -9.239
    4    HB3  PHE 802           HB3      PHE 802  46.904 -13.239 -10.179
    5    HD1  PHE 802           HD1      PHE 802  47.957 -13.845  -8.039
    6    HD2  PHE 802           HD2      PHE 802  46.816  -9.821  -8.883
    7    HE1  PHE 802           HE1      PHE 802  49.345 -13.099  -6.282
    8    HE2  PHE 802           HE2      PHE 802  48.214  -9.061  -7.086
    9    HZ   PHE 802           HZ       PHE 802  49.514 -10.678  -5.749

  No H/Q in entry =           9
  In of MODEL   15
    1    H    SER 803           H        SER 803  47.159 -13.188 -11.989
    2    HA   SER 803           HA       SER 803  44.945 -13.741 -13.803
    3    HB2  SER 803           HB2      SER 803  47.883 -14.225 -14.362
    4    HB3  SER 803           HB3      SER 803  46.524 -14.293 -15.481
    5    HG   SER 803           HG       SER 803  46.367 -12.133 -15.495

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ILE 804           H        ILE 804  44.249 -15.811 -13.587
    2    HA   ILE 804           HA       ILE 804  45.937 -17.697 -12.102
    3    HB   ILE 804           HB       ILE 804  44.106 -18.523 -10.778
    4   HG12  ILE 804          HG12      ILE 804  42.248 -18.229 -12.421
    5   HG13  ILE 804          HG13      ILE 804  41.820 -17.689 -10.809
    6   HG23  ILE 804          HG21      ILE 804  45.237 -16.644  -9.807
    7   HG22  ILE 804          HG22      ILE 804  43.524 -16.583  -9.375
    8   HG21  ILE 804          HG23      ILE 804  44.154 -15.529 -10.641
    9   HD11  ILE 804          HD11      ILE 804  42.206 -15.360 -11.547
   10   HD13  ILE 804          HD12      ILE 804  40.923 -16.181 -12.429
   11   HD12  ILE 804          HD13      ILE 804  42.497 -15.957 -13.185

  No H/Q in entry =          11
  In of MODEL   15
    1    H    CYS 805           H        CYS 805  44.744 -19.978 -12.241
    2    HA   CYS 805           HA       CYS 805  44.154 -20.345 -15.096
    3    HB2  CYS 805           HB2      CYS 805  46.318 -21.287 -14.292
    4    HB3  CYS 805           HB3      CYS 805  45.410 -22.273 -13.150

  No H/Q in entry =           4
  In of MODEL   15
    1    H    VAL 806           H        VAL 806  42.195 -21.054 -15.523
    2    HA   VAL 806           HA       VAL 806  40.705 -22.376 -13.374
    3    HB   VAL 806           HB       VAL 806  39.532 -20.619 -15.491
    4   HG12  VAL 806          HG11      VAL 806  37.578 -20.543 -13.981
    5   HG11  VAL 806          HG12      VAL 806  38.391 -21.732 -12.944
    6   HG13  VAL 806          HG13      VAL 806  37.967 -22.151 -14.587
    7   HG23  VAL 806          HG21      VAL 806  39.249 -18.856 -13.777
    8   HG22  VAL 806          HG22      VAL 806  40.920 -19.159 -14.218
    9   HG21  VAL 806          HG23      VAL 806  40.289 -19.789 -12.690

  No H/Q in entry =           9
  In of MODEL   15
    1    H    GLU 807           H        GLU 807  39.779 -24.222 -13.953
    2    HA   GLU 807           HA       GLU 807  40.078 -25.228 -16.616
    3    HB2  GLU 807           HB2      GLU 807  40.407 -26.708 -14.698
    4    HB3  GLU 807           HB3      GLU 807  38.783 -26.375 -14.134
    5    HG2  GLU 807           HG2      GLU 807  37.887 -27.452 -16.156
    6    HG3  GLU 807           HG3      GLU 807  39.546 -27.794 -16.660

  No H/Q in entry =           6
  In of MODEL   15
    1    H    VAL 808           H        VAL 808  38.692 -24.877 -18.082
    2    HA   VAL 808           HA       VAL 808  35.851 -24.571 -17.574
    3    HB   VAL 808           HB       VAL 808  36.735 -22.279 -17.463
    4   HG12  VAL 808          HG11      VAL 808  37.757 -21.177 -19.404
    5   HG11  VAL 808          HG12      VAL 808  37.864 -22.748 -20.201
    6   HG13  VAL 808          HG13      VAL 808  38.756 -22.453 -18.709
    7   HG21  VAL 808          HG21      VAL 808  35.188 -22.807 -19.990
    8   HG23  VAL 808          HG22      VAL 808  35.386 -21.222 -19.248
    9   HG22  VAL 808          HG23      VAL 808  34.522 -22.494 -18.383

  No H/Q in entry =           9
  In of MODEL   15
    1    H    ASN 809           H        ASN 809  34.746 -25.586 -19.171
    2    HA   ASN 809           HA       ASN 809  34.268 -26.635 -21.165
    3    HB2  ASN 809           HB2      ASN 809  36.479 -24.818 -22.007
    4    HB3  ASN 809           HB3      ASN 809  35.842 -25.981 -23.159
    5   HD21  ASN 809          HD21      ASN 809  33.855 -24.298 -20.749
    6   HD22  ASN 809          HD22      ASN 809  32.991 -23.347 -21.895

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLY 810           H        GLY 810  36.349 -27.603 -19.221
    2    HA3  GLY 810           HA2      GLY 810  37.490 -29.611 -19.052
    3    HA2  GLY 810           HA3      GLY 810  37.276 -29.848 -20.782

  No H/Q in entry =           3
  In of MODEL   15
    1    H    LYS 811           H        LYS 811  38.470 -26.791 -20.396
    2    HA   LYS 811           HA       LYS 811  41.248 -27.655 -20.897
    3    HB2  LYS 811           HB2      LYS 811  40.053 -24.931 -21.362
    4    HB3  LYS 811           HB3      LYS 811  41.562 -25.551 -21.984
    5    HG2  LYS 811           HG2      LYS 811  38.803 -26.370 -22.798
    6    HG3  LYS 811           HG3      LYS 811  39.919 -25.323 -23.688
    7    HD2  LYS 811           HD2      LYS 811  40.314 -28.232 -23.047
    8    HD3  LYS 811           HD3      LYS 811  39.838 -27.571 -24.611
    9    HE2  LYS 811           HE2      LYS 811  41.996 -26.297 -24.675
   10    HE3  LYS 811           HE3      LYS 811  42.470 -27.101 -23.182
   11    HZ1  LYS 811           HZ1      LYS 811  42.268 -29.225 -24.357
   12    HZ3  LYS 811           HZ2      LYS 811  43.441 -28.259 -25.046
   13    HZ2  LYS 811           HZ3      LYS 811  41.919 -28.409 -25.775

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLU 812           H        GLU 812  42.739 -25.877 -20.153
    2    HA   GLU 812           HA       GLU 812  41.790 -24.624 -17.690
    3    HB2  GLU 812           HB2      GLU 812  44.539 -25.787 -18.202
    4    HB3  GLU 812           HB3      GLU 812  44.233 -24.635 -16.914
    5    HG2  GLU 812           HG2      GLU 812  42.559 -26.216 -15.980
    6    HG3  GLU 812           HG3      GLU 812  43.046 -27.380 -17.213

  No H/Q in entry =           6
  In of MODEL   15
    1    H    GLN 813           H        GLN 813  41.506 -22.597 -18.124
    2    HA   GLN 813           HA       GLN 813  43.330 -21.286 -20.004
    3    HB2  GLN 813           HB2      GLN 813  41.147 -21.392 -20.963
    4    HB3  GLN 813           HB3      GLN 813  40.396 -20.800 -19.483
    5    HG2  GLN 813           HG2      GLN 813  41.433 -18.644 -19.802
    6    HG3  GLN 813           HG3      GLN 813  42.258 -19.211 -21.257
    7   HE21  GLN 813          HE21      GLN 813  38.958 -20.053 -20.448
    8   HE22  GLN 813          HE22      GLN 813  38.233 -19.140 -21.712

  No H/Q in entry =           8
  In of MODEL   15
    1    H    THR 814           H        THR 814  44.303 -19.493 -19.406
    2    HA   THR 814           HA       THR 814  44.269 -18.661 -16.681
    3    HB   THR 814           HB       THR 814  45.548 -17.385 -19.101
    4    HG1  THR 814           HG1      THR 814  47.310 -18.722 -18.623
    5   HG23  THR 814          HG21      THR 814  47.182 -16.544 -17.459
    6   HG22  THR 814          HG22      THR 814  46.279 -17.324 -16.161
    7   HG21  THR 814          HG23      THR 814  45.552 -15.995 -17.064

  No H/Q in entry =           7
  In of MODEL   15
    1    H    MET 815           H        MET 815  42.977 -17.059 -15.907
    2    HA   MET 815           HA       MET 815  41.898 -15.114 -17.844
    3    HB2  MET 815           HB2      MET 815  40.317 -15.900 -15.400
    4    HB3  MET 815           HB3      MET 815  39.774 -15.030 -16.816
    5    HG2  MET 815           HG2      MET 815  40.140 -17.263 -18.078
    6    HG3  MET 815           HG3      MET 815  40.302 -17.933 -16.467
    7    HE3  MET 815           HE1      MET 815  36.839 -19.232 -17.548
    8    HE2  MET 815           HE2      MET 815  38.459 -19.637 -16.956
    9    HE1  MET 815           HE3      MET 815  38.263 -18.963 -18.565

  No H/Q in entry =           9
  In of MODEL   15
    1    H    SER 816           H        SER 816  41.226 -13.153 -16.676
    2    HA   SER 816           HA       SER 816  43.146 -12.398 -14.708
    3    HB2  SER 816           HB2      SER 816  40.594 -11.122 -15.567
    4    HB3  SER 816           HB3      SER 816  41.964 -10.290 -14.782
    5    HG   SER 816           HG       SER 816  41.630 -11.274 -17.389

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLU 817           H        GLU 817  42.585 -11.823 -12.623
    2    HA   GLU 817           HA       GLU 817  41.111 -13.624 -11.166
    3    HB2  GLU 817           HB2      GLU 817  43.015 -12.118 -10.519
    4    HB3  GLU 817           HB3      GLU 817  41.794 -10.853 -10.438
    5    HG2  GLU 817           HG2      GLU 817  40.830 -11.626  -8.618
    6    HG3  GLU 817           HG3      GLU 817  41.374 -13.297  -8.868

  No H/Q in entry =           6
  In of MODEL   15
    1    H    CYS 818           H        CYS 818  40.088 -10.632 -12.666
    2    HA   CYS 818           HA       CYS 818  37.757 -10.436 -10.995
    3    HB2  CYS 818           HB2      CYS 818  38.747  -8.336 -11.810
    4    HB3  CYS 818           HB3      CYS 818  38.531  -8.907 -13.469

  No H/Q in entry =           4
  In of MODEL   15
    1    H    GLU 819           H        GLU 819  38.748 -11.362 -14.149
    2    HA   GLU 819           HA       GLU 819  36.365 -11.853 -15.426
    3    HB2  GLU 819           HB2      GLU 819  39.097 -12.946 -15.573
    4    HB3  GLU 819           HB3      GLU 819  37.921 -13.613 -16.621
    5    HG2  GLU 819           HG2      GLU 819  37.509 -11.246 -17.359
    6    HG3  GLU 819           HG3      GLU 819  38.990 -10.844 -16.485

  No H/Q in entry =           6
  In of MODEL   15
    1    H    ALA 820           H        ALA 820  38.484 -14.232 -13.913
    2    HA   ALA 820           HA       ALA 820  36.775 -16.399 -14.053
    3    HB3  ALA 820           HB1      ALA 820  38.864 -15.830 -11.975
    4    HB1  ALA 820           HB2      ALA 820  39.126 -16.605 -13.540
    5    HB2  ALA 820           HB3      ALA 820  38.158 -17.412 -12.302

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLY 821           H        GLY 821  37.154 -13.948 -11.519
    2    HA3  GLY 821           HA2      GLY 821  35.411 -15.111  -9.623
    3    HA2  GLY 821           HA3      GLY 821  35.947 -13.436  -9.657

  No H/Q in entry =           3
  In of MODEL   15
    1    H    ALA 822           H        ALA 822  34.894 -12.792 -12.213
    2    HA   ALA 822           HA       ALA 822  32.273 -12.107 -11.495
    3    HB1  ALA 822           HB1      ALA 822  33.502 -12.032 -14.249
    4    HB2  ALA 822           HB2      ALA 822  33.706 -10.795 -13.011
    5    HB3  ALA 822           HB3      ALA 822  32.096 -11.125 -13.665

  No H/Q in entry =           5
  In of MODEL   15
    1    H    LEU 823           H        LEU 823  33.520 -14.519 -13.750
    2    HA   LEU 823           HA       LEU 823  30.983 -15.537 -14.487
    3    HB2  LEU 823           HB2      LEU 823  33.744 -16.735 -14.562
    4    HB3  LEU 823           HB3      LEU 823  32.367 -17.722 -14.960
    5    HG   LEU 823           HG       LEU 823  33.365 -17.005 -16.988
    6   HD11  LEU 823          HD11      LEU 823  30.958 -17.061 -17.036
    7   HD13  LEU 823          HD12      LEU 823  31.596 -15.828 -18.119
    8   HD12  LEU 823          HD13      LEU 823  30.894 -15.356 -16.575
    9   HD22  LEU 823          HD21      LEU 823  33.656 -14.667 -17.627
   10   HD21  LEU 823          HD22      LEU 823  34.627 -15.054 -16.211
   11   HD23  LEU 823          HD23      LEU 823  33.128 -14.150 -16.031

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ARG 824           H        ARG 824  33.151 -16.264 -11.872
    2    HA   ARG 824           HA       ARG 824  31.829 -18.503 -10.749
    3    HB2  ARG 824           HB2      ARG 824  34.175 -17.748 -10.296
    4    HB3  ARG 824           HB3      ARG 824  33.521 -16.399  -9.400
    5    HG2  ARG 824           HG2      ARG 824  34.259 -18.018  -7.831
    6    HG3  ARG 824           HG3      ARG 824  32.497 -18.049  -7.817
    7    HD2  ARG 824           HD2      ARG 824  34.122 -19.928  -9.490
    8    HD3  ARG 824           HD3      ARG 824  33.754 -20.321  -7.836
    9    HE   ARG 824           HE       ARG 824  31.366 -19.691  -9.167
   10   HH11  ARG 824          HH11      ARG 824  33.869 -22.209  -9.117
   11   HH12  ARG 824          HH12      ARG 824  32.869 -23.428  -9.730
   12   HH21  ARG 824          HH21      ARG 824  29.986 -21.394 -10.024
   13   HH22  ARG 824          HH22      ARG 824  30.625 -22.972 -10.224

  No H/Q in entry =          13
  In of MODEL   15
    1    H    CYS 825           H        CYS 825  31.192 -15.122 -10.668
    2    HA   CYS 825           HA       CYS 825  29.606 -15.147  -8.236
    3    HB2  CYS 825           HB2      CYS 825  31.102 -13.234  -8.997
    4    HB3  CYS 825           HB3      CYS 825  29.972 -12.976 -10.303

  No H/Q in entry =           4
  In of MODEL   15
    1    H    ARG 826           H        ARG 826  29.246 -14.691 -11.700
    2    HA   ARG 826           HA       ARG 826  26.566 -14.274 -11.989
    3    HB2  ARG 826           HB2      ARG 826  27.888 -13.867 -13.833
    4    HB3  ARG 826           HB3      ARG 826  28.796 -15.348 -13.631
    5    HG2  ARG 826           HG2      ARG 826  26.995 -16.625 -14.386
    6    HG3  ARG 826           HG3      ARG 826  25.967 -15.189 -14.589
    7    HD2  ARG 826           HD2      ARG 826  27.413 -14.355 -16.327
    8    HD3  ARG 826           HD3      ARG 826  28.609 -15.610 -15.994
    9    HE   ARG 826           HE       ARG 826  26.460 -17.046 -16.637
   10   HH11  ARG 826          HH11      ARG 826  27.869 -14.225 -18.345
   11   HH12  ARG 826          HH12      ARG 826  27.496 -14.845 -19.855
   12   HH21  ARG 826          HH21      ARG 826  25.955 -17.816 -18.776
   13   HH22  ARG 826          HH22      ARG 826  26.401 -16.863 -20.125

  No H/Q in entry =          13
  In of MODEL   15
    1    H    GLY 827           H        GLY 827  28.344 -17.337 -11.926
    2    HA3  GLY 827           HA2      GLY 827  27.113 -19.251 -10.920
    3    HA2  GLY 827           HA3      GLY 827  25.738 -18.730 -11.887

  No H/Q in entry =           3
  In of MODEL   15
    1    H    GLN 828           H        GLN 828  28.891 -18.489 -13.214
    2    HA   GLN 828           HA       GLN 828  28.269 -20.404 -15.264
    3    HB2  GLN 828           HB2      GLN 828  29.473 -18.310 -15.795
    4    HB3  GLN 828           HB3      GLN 828  30.729 -18.760 -14.655
    5    HG2  GLN 828           HG2      GLN 828  31.708 -19.275 -16.686
    6    HG3  GLN 828           HG3      GLN 828  31.051 -20.821 -16.183
    7   HE21  GLN 828          HE21      GLN 828  28.249 -19.924 -16.992
    8   HE22  GLN 828          HE22      GLN 828  28.281 -20.037 -18.690

  No H/Q in entry =           8
  In of MODEL   15
    1    H    SER 829           H        SER 829  29.447 -22.369 -15.481
    2    HA   SER 829           HA       SER 829  30.558 -23.238 -12.960
    3    HB2  SER 829           HB2      SER 829  29.846 -24.859 -15.399
    4    HB3  SER 829           HB3      SER 829  30.194 -25.470 -13.773
    5    HG   SER 829           HG       SER 829  28.339 -23.519 -13.815

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ILE 830           H        ILE 830  32.546 -22.891 -12.682
    2    HA   ILE 830           HA       ILE 830  34.509 -23.647 -14.679
    3    HB   ILE 830           HB       ILE 830  35.913 -21.732 -14.200
    4   HG12  ILE 830          HG12      ILE 830  35.013 -21.313 -11.843
    5   HG13  ILE 830          HG13      ILE 830  35.378 -19.863 -12.715
    6   HG22  ILE 830          HG21      ILE 830  34.662 -19.907 -15.288
    7   HG21  ILE 830          HG22      ILE 830  33.189 -20.861 -15.069
    8   HG23  ILE 830          HG23      ILE 830  34.487 -21.473 -16.092
    9   HD13  ILE 830          HD11      ILE 830  33.345 -19.612 -11.518
   10   HD12  ILE 830          HD12      ILE 830  32.660 -21.052 -12.270
   11   HD11  ILE 830          HD13      ILE 830  32.980 -19.614 -13.242

  No H/Q in entry =          11
  In of MODEL   15
    1    H    SER 831           H        SER 831  36.616 -23.986 -13.597
    2    HA   SER 831           HA       SER 831  36.321 -24.401 -10.741
    3    HB2  SER 831           HB2      SER 831  37.418 -26.246 -12.817
    4    HB3  SER 831           HB3      SER 831  37.601 -26.457 -11.075
    5    HG   SER 831           HG       SER 831  35.048 -25.969 -11.623

  No H/Q in entry =           5
  In of MODEL   15
    1    H    VAL 832           H        VAL 832  37.735 -22.850  -9.999
    2    HA   VAL 832           HA       VAL 832  40.097 -22.146 -11.428
    3    HB   VAL 832           HB       VAL 832  39.424 -21.649  -8.511
    4   HG12  VAL 832          HG11      VAL 832  41.456 -20.298 -10.297
    5   HG11  VAL 832          HG12      VAL 832  41.812 -21.405  -8.977
    6   HG13  VAL 832          HG13      VAL 832  41.088 -19.832  -8.633
    7   HG21  VAL 832          HG21      VAL 832  37.741 -20.669  -9.974
    8   HG23  VAL 832          HG22      VAL 832  38.997 -19.865 -10.914
    9   HG22  VAL 832          HG23      VAL 832  38.720 -19.402  -9.237

  No H/Q in entry =           9
  In of MODEL   15
    1    H    THR 833           H        THR 833  41.596 -23.664 -11.751
    2    HA   THR 833           HA       THR 833  41.920 -25.770  -9.856
    3    HB   THR 833           HB       THR 833  43.663 -26.510 -11.581
    4    HG1  THR 833           HG1      THR 833  43.609 -25.473 -13.554
    5   HG21  THR 833          HG21      THR 833  40.778 -26.155 -12.399
    6   HG23  THR 833          HG22      THR 833  41.427 -27.482 -11.433
    7   HG22  THR 833          HG23      THR 833  41.908 -27.299 -13.122

  No H/Q in entry =           7
  In of MODEL   15
    1    H    SER 834           H        SER 834  43.728 -22.996 -10.958
    2    HA   SER 834           HA       SER 834  45.490 -23.364  -8.681
    3    HB2  SER 834           HB2      SER 834  46.480 -22.999 -11.513
    4    HB3  SER 834           HB3      SER 834  47.493 -22.989 -10.077
    5    HG   SER 834           HG       SER 834  45.973 -25.203 -10.064

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ILE 835           H        ILE 835  46.357 -21.470  -7.904
    2    HA   ILE 835           HA       ILE 835  45.038 -19.035  -8.750
    3    HB   ILE 835           HB       ILE 835  46.196 -17.990  -6.841
    4   HG12  ILE 835          HG12      ILE 835  47.434 -20.735  -6.396
    5   HG13  ILE 835          HG13      ILE 835  48.281 -19.283  -6.939
    6   HG23  ILE 835          HG21      ILE 835  44.053 -19.059  -6.489
    7   HG22  ILE 835          HG22      ILE 835  45.074 -19.267  -5.061
    8   HG21  ILE 835          HG23      ILE 835  44.850 -20.602  -6.194
    9   HD12  ILE 835          HD11      ILE 835  48.633 -19.795  -4.611
   10   HD11  ILE 835          HD12      ILE 835  46.894 -19.572  -4.325
   11   HD13  ILE 835          HD13      ILE 835  47.883 -18.221  -4.881

  No H/Q in entry =          11
  In of MODEL   15
    1    H    ARG 836           H        ARG 836  47.590 -20.736  -9.603
    2    HA   ARG 836           HA       ARG 836  49.446 -18.664 -10.349
    3    HB2  ARG 836           HB2      ARG 836  49.363 -21.617 -10.877
    4    HB3  ARG 836           HB3      ARG 836  50.691 -20.547 -11.308
    5    HG2  ARG 836           HG2      ARG 836  51.135 -20.059  -9.028
    6    HG3  ARG 836           HG3      ARG 836  49.681 -20.921  -8.516
    7    HD2  ARG 836           HD2      ARG 836  52.052 -22.116  -9.899
    8    HD3  ARG 836           HD3      ARG 836  51.654 -22.173  -8.169
    9    HE   ARG 836           HE       ARG 836  49.507 -23.275  -9.006
   10   HH11  ARG 836          HH11      ARG 836  52.713 -23.850 -10.410
   11   HH12  ARG 836          HH12      ARG 836  52.282 -25.335 -11.133
   12   HH21  ARG 836          HH21      ARG 836  48.923 -25.378 -10.017
   13   HH22  ARG 836          HH22      ARG 836  50.121 -26.207 -10.871

  No H/Q in entry =          13
  In of MODEL   15
    1    HA   PRO 837           HA       PRO 837  47.332 -18.463 -14.344
    2    HB2  PRO 837           HB2      PRO 837  49.233 -17.191 -15.809
    3    HB3  PRO 837           HB3      PRO 837  48.223 -16.358 -14.624
    4    HG2  PRO 837           HG2      PRO 837  51.046 -17.283 -14.388
    5    HG3  PRO 837           HG3      PRO 837  50.287 -15.815 -13.747
    6    HD2  PRO 837           HD2      PRO 837  50.818 -18.079 -12.267
    7    HD3  PRO 837           HD3      PRO 837  49.571 -16.883 -11.855

  No H/Q in entry =           7
  In of MODEL   15
    1    H    CYS 838           H        CYS 838  47.252 -19.722 -16.186
    2    HA   CYS 838           HA       CYS 838  49.343 -21.698 -16.445
    3    HB2  CYS 838           HB2      CYS 838  46.487 -21.569 -17.348
    4    HB3  CYS 838           HB3      CYS 838  47.607 -22.638 -18.180

  No H/Q in entry =           4
  In of MODEL   15
    1    H    ALA 839           H        ALA 839  49.375 -22.402 -18.992
    2    HA   ALA 839           HA       ALA 839  50.562 -20.138 -20.278
    3    HB1  ALA 839           HB1      ALA 839  51.623 -22.347 -20.381
    4    HB3  ALA 839           HB2      ALA 839  51.237 -21.726 -21.989
    5    HB2  ALA 839           HB3      ALA 839  50.217 -22.959 -21.252

  No H/Q in entry =           5
  In of MODEL   15
    1    H    ALA 840           H        ALA 840  47.834 -22.260 -20.841
    2    HA   ALA 840           HA       ALA 840  46.075 -22.262 -22.281
    3    HB1  ALA 840           HB1      ALA 840  45.581 -20.322 -20.903
    4    HB3  ALA 840           HB2      ALA 840  44.923 -20.136 -22.550
    5    HB2  ALA 840           HB3      ALA 840  46.408 -19.284 -22.070

  No H/Q in entry =           5
  In of MODEL   15
    1    H    GLU 841           H        GLU 841  48.752 -22.160 -23.291
    2    HA   GLU 841           HA       GLU 841  49.263 -20.601 -25.503
    3    HB2  GLU 841           HB2      GLU 841  50.923 -22.400 -26.050
    4    HB3  GLU 841           HB3      GLU 841  51.010 -21.749 -24.412
    5    HG2  GLU 841           HG2      GLU 841  49.842 -23.649 -23.525
    6    HG3  GLU 841           HG3      GLU 841  49.547 -24.269 -25.143

  No H/Q in entry =           6
  In of MODEL   15
    1    H    THR 842           H        THR 842  47.348 -23.364 -25.286
    2    HA   THR 842           HA       THR 842  47.497 -23.992 -28.108
    3    HB   THR 842           HB       THR 842  45.814 -25.354 -25.980
    4    HG1  THR 842           HG1      THR 842  48.504 -25.680 -26.819
    5   HG21  THR 842          HG21      THR 842  46.995 -26.368 -28.592
    6   HG23  THR 842          HG22      THR 842  45.293 -25.985 -28.332
    7   HG22  THR 842          HG23      THR 842  46.038 -27.320 -27.457

  No H/Q in entry =           7
  In of MODEL   15
    1    H    GLN 843           H        GLN 843  45.862 -21.777 -26.397
    2    HA   GLN 843           HA       GLN 843  43.503 -21.904 -28.135
    3    HB2  GLN 843           HB2      GLN 843  43.750 -20.436 -25.491
    4    HB3  GLN 843           HB3      GLN 843  42.300 -20.585 -26.469
    5    HG2  GLN 843           HG2      GLN 843  43.708 -22.812 -25.008
    6    HG3  GLN 843           HG3      GLN 843  42.201 -22.044 -24.538
    7   HE21  GLN 843          HE21      GLN 843  41.145 -21.994 -27.323
    8   HE22  GLN 843          HE22      GLN 843  40.735 -23.623 -27.660

  No H/Q in entry =           8
  In of MODEL   16
    1    H1   GLY 689           H2       GLY 689  80.460  14.264 -11.378
    2    H2   GLY 689           H1       GLY 689  79.915  14.124  -9.803
    3    H3   GLY 689           H3       GLY 689  81.588  14.147 -10.102
    4    HA2  GLY 689           HA2      GLY 689  80.791  11.912  -9.651
    5    HA3  GLY 689           HA3      GLY 689  81.402  12.083 -11.296

  No H/Q in entry =           5
  In of MODEL   16
    1    H    SER 690           H        SER 690  79.990  10.133 -11.541
    2    HA   SER 690           HA       SER 690  78.215   9.141 -12.481
    3    HB2  SER 690           HB2      SER 690  76.603  11.229 -10.977
    4    HB3  SER 690           HB3      SER 690  75.951   9.746 -11.679
    5    HG   SER 690           HG       SER 690  77.689   8.734 -10.295

  No H/Q in entry =           5
  In of MODEL   16
    1    H    HIS 691           H        HIS 691  76.044   9.738 -13.779
    2    HA   HIS 691           HA       HIS 691  76.880  11.781 -15.696
    3    HB2  HIS 691           HB2      HIS 691  75.151   9.319 -16.103
    4    HB3  HIS 691           HB3      HIS 691  75.398  10.549 -17.330
    5    HD1  HIS 691           HD1      HIS 691  77.856  10.697 -18.366
    6    HD2  HIS 691           HD2      HIS 691  77.217   7.493 -15.804
    7    HE1  HIS 691           HE1      HIS 691  79.741   9.102 -18.774
    8    HE2  HIS 691           HE2      HIS 691  79.188   7.098 -17.385

  No H/Q in entry =           8
  In of MODEL   16
    1    H    MET 692           H        MET 692  75.009  12.930 -16.722
    2    HA   MET 692           HA       MET 692  73.498  14.104 -14.634
    3    HB2  MET 692           HB2      MET 692  73.199  14.395 -17.629
    4    HB3  MET 692           HB3      MET 692  72.357  15.382 -16.445
    5    HG2  MET 692           HG2      MET 692  75.341  15.243 -16.835
    6    HG3  MET 692           HG3      MET 692  74.279  16.541 -17.371
    7    HE3  MET 692           HE1      MET 692  76.901  17.033 -15.634
    8    HE2  MET 692           HE2      MET 692  76.307  18.221 -14.475
    9    HE1  MET 692           HE3      MET 692  75.823  18.322 -16.169

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ASN 693           H        ASN 693  72.492  12.149 -17.410
    2    HA   ASN 693           HA       ASN 693  70.165  11.362 -15.855
    3    HB2  ASN 693           HB2      ASN 693  68.810  11.339 -17.930
    4    HB3  ASN 693           HB3      ASN 693  69.411  12.937 -17.532
    5   HD21  ASN 693          HD21      ASN 693  68.453  11.888 -20.078
    6   HD22  ASN 693          HD22      ASN 693  69.748  12.074 -21.196

  No H/Q in entry =           6
  In of MODEL   16
    1    HA   PRO 694           HA       PRO 694  71.833   7.357 -17.002
    2    HB2  PRO 694           HB2      PRO 694  69.584   6.187 -15.565
    3    HB3  PRO 694           HB3      PRO 694  71.296   6.138 -15.145
    4    HG2  PRO 694           HG2      PRO 694  69.424   7.535 -13.726
    5    HG3  PRO 694           HG3      PRO 694  71.139   7.961 -13.782
    6    HD2  PRO 694           HD2      PRO 694  68.834   9.185 -15.231
    7    HD3  PRO 694           HD3      PRO 694  70.290   9.940 -14.542

  No H/Q in entry =           7
  In of MODEL   16
    1    H    LEU 695           H        LEU 695  71.403   6.943 -19.070
    2    HA   LEU 695           HA       LEU 695  68.679   6.904 -20.061
    3    HB2  LEU 695           HB2      LEU 695  71.344   6.668 -21.461
    4    HB3  LEU 695           HB3      LEU 695  69.795   6.615 -22.269
    5    HG   LEU 695           HG       LEU 695  70.775   8.996 -20.696
    6   HD11  LEU 695          HD11      LEU 695  70.835   8.470 -23.668
    7   HD13  LEU 695          HD12      LEU 695  72.239   8.567 -22.605
    8   HD12  LEU 695          HD13      LEU 695  71.243   9.994 -22.879
    9   HD22  LEU 695          HD21      LEU 695  68.344   8.838 -20.934
   10   HD21  LEU 695          HD22      LEU 695  68.523   8.632 -22.674
   11   HD23  LEU 695          HD23      LEU 695  68.993  10.153 -21.913

  No H/Q in entry =          11
  In of MODEL   16
    1    H    THR 696           H        THR 696  67.586   5.126 -20.237
    2    HA   THR 696           HA       THR 696  66.934   3.038 -20.342
    3    HB   THR 696           HB       THR 696  69.637   2.438 -21.567
    4    HG1  THR 696           HG1      THR 696  67.281   3.650 -22.428
    5   HG23  THR 696          HG21      THR 696  68.430   0.569 -22.646
    6   HG22  THR 696          HG22      THR 696  66.957   1.023 -21.791
    7   HG21  THR 696          HG23      THR 696  68.346   0.423 -20.889

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLN 697           H        GLN 697  66.656   2.638 -18.275
    2    HA   GLN 697           HA       GLN 697  68.778   1.136 -16.910
    3    HB2  GLN 697           HB2      GLN 697  66.475   2.728 -15.764
    4    HB3  GLN 697           HB3      GLN 697  67.562   1.729 -14.815
    5    HG2  GLN 697           HG2      GLN 697  68.422   4.112 -16.443
    6    HG3  GLN 697           HG3      GLN 697  68.076   4.151 -14.715
    7   HE21  GLN 697          HE21      GLN 697  69.496   3.145 -13.296
    8   HE22  GLN 697          HE22      GLN 697  71.096   2.714 -13.740

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ALA 698           H        ALA 698  68.285  -0.926 -16.412
    2    HA   ALA 698           HA       ALA 698  65.823  -2.022 -17.342
    3    HB1  ALA 698           HB1      ALA 698  67.905  -3.309 -17.494
    4    HB3  ALA 698           HB2      ALA 698  66.710  -4.161 -16.518
    5    HB2  ALA 698           HB3      ALA 698  68.041  -3.306 -15.736

  No H/Q in entry =           5
  In of MODEL   16
    1    H    VAL 699           H        VAL 699  64.098  -1.459 -16.254
    2    HA   VAL 699           HA       VAL 699  64.139  -1.371 -13.353
    3    HB   VAL 699           HB       VAL 699  61.831  -0.799 -15.239
    4   HG13  VAL 699          HG11      VAL 699  60.869   0.422 -13.338
    5   HG12  VAL 699          HG12      VAL 699  62.249  -0.046 -12.348
    6   HG11  VAL 699          HG13      VAL 699  61.144  -1.279 -12.954
    7   HG21  VAL 699          HG21      VAL 699  63.654   0.742 -15.734
    8   HG23  VAL 699          HG22      VAL 699  63.780   1.162 -14.027
    9   HG22  VAL 699          HG23      VAL 699  62.330   1.593 -14.936

  No H/Q in entry =           9
  In of MODEL   16
    1    HA   PRO 700           HA       PRO 700  62.749  -5.615 -13.615
    2    HB2  PRO 700           HB2      PRO 700  62.320  -5.993 -10.951
    3    HB3  PRO 700           HB3      PRO 700  63.928  -6.059 -11.682
    4    HG2  PRO 700           HG2      PRO 700  62.623  -3.837 -10.172
    5    HG3  PRO 700           HG3      PRO 700  64.306  -4.391 -10.119
    6    HD2  PRO 700           HD2      PRO 700  63.510  -2.192 -11.497
    7    HD3  PRO 700           HD3      PRO 700  64.885  -3.199 -12.000

  No H/Q in entry =           7
  In of MODEL   16
    1    H    LYS 701           H        LYS 701  60.928  -6.522 -13.894
    2    HA   LYS 701           HA       LYS 701  58.578  -4.948 -13.377
    3    HB2  LYS 701           HB2      LYS 701  59.002  -7.447 -15.030
    4    HB3  LYS 701           HB3      LYS 701  57.424  -6.721 -14.769
    5    HG2  LYS 701           HG2      LYS 701  58.128  -5.959 -16.891
    6    HG3  LYS 701           HG3      LYS 701  58.393  -4.620 -15.766
    7    HD2  LYS 701           HD2      LYS 701  60.748  -5.170 -15.642
    8    HD3  LYS 701           HD3      LYS 701  60.509  -6.511 -16.759
    9    HE2  LYS 701           HE2      LYS 701  59.987  -3.598 -17.356
   10    HE3  LYS 701           HE3      LYS 701  61.395  -4.515 -17.877
   11    HZ3  LYS 701           HZ1      LYS 701  59.769  -4.354 -19.642
   12    HZ2  LYS 701           HZ2      LYS 701  58.573  -5.022 -18.683
   13    HZ1  LYS 701           HZ3      LYS 701  59.892  -5.966 -19.156

  No H/Q in entry =          13
  In of MODEL   16
    1    H    CYS 702           H        CYS 702  56.917  -5.621 -12.137
    2    HA   CYS 702           HA       CYS 702  57.641  -7.833 -10.390
    3    HB2  CYS 702           HB2      CYS 702  56.044  -5.364  -9.574
    4    HB3  CYS 702           HB3      CYS 702  56.402  -6.744  -8.620

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLN 703           H        GLN 703  56.234  -9.273  -9.826
    2    HA   GLN 703           HA       GLN 703  53.819  -9.648 -11.347
    3    HB2  GLN 703           HB2      GLN 703  55.006 -10.962  -8.894
    4    HB3  GLN 703           HB3      GLN 703  53.550 -11.516  -9.712
    5    HG2  GLN 703           HG2      GLN 703  54.743 -12.049 -11.683
    6    HG3  GLN 703           HG3      GLN 703  56.196 -11.238 -11.074
    7   HE21  GLN 703          HE21      GLN 703  55.614 -13.890 -12.054
    8   HE22  GLN 703          HE22      GLN 703  56.202 -14.990 -10.852

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ARG 704           H        ARG 704  51.864  -9.962 -10.247
    2    HA   ARG 704           HA       ARG 704  51.059  -7.442  -9.223
    3    HB2  ARG 704           HB2      ARG 704  49.659 -10.011  -9.692
    4    HB3  ARG 704           HB3      ARG 704  48.837  -8.674  -8.884
    5    HG2  ARG 704           HG2      ARG 704  48.951  -7.309 -10.710
    6    HG3  ARG 704           HG3      ARG 704  50.302  -8.196 -11.431
    7    HD2  ARG 704           HD2      ARG 704  47.562  -9.312 -11.082
    8    HD3  ARG 704           HD3      ARG 704  48.071  -8.466 -12.546
    9    HE   ARG 704           HE       ARG 704  49.863 -10.531 -11.871
   10   HH11  ARG 704          HH11      ARG 704  46.674  -9.915 -13.310
   11   HH12  ARG 704          HH12      ARG 704  46.783 -11.271 -14.349
   12   HH21  ARG 704          HH21      ARG 704  49.970 -12.357 -13.369
   13   HH22  ARG 704          HH22      ARG 704  48.667 -12.576 -14.448

  No H/Q in entry =          13
  In of MODEL   16
    1    H    TRP 705           H        TRP 705  52.122 -10.181  -7.633
    2    HA   TRP 705           HA       TRP 705  51.176  -9.188  -5.065
    3    HB2  TRP 705           HB2      TRP 705  52.122 -11.376  -4.228
    4    HB3  TRP 705           HB3      TRP 705  50.746 -11.491  -5.312
    5    HD1  TRP 705           HD1      TRP 705  54.445 -12.277  -5.086
    6    HE1  TRP 705           HE1      TRP 705  55.083 -13.796  -7.038
    7    HE3  TRP 705           HE3      TRP 705  50.110 -12.048  -7.757
    8    HZ2  TRP 705           HZ2      TRP 705  53.873 -14.839  -9.380
    9    HZ3  TRP 705           HZ3      TRP 705  49.932 -13.301  -9.832
   10    HH2  TRP 705           HH2      TRP 705  51.774 -14.688 -10.636

  No H/Q in entry =          10
  In of MODEL   16
    1    H    GLU 706           H        GLU 706  53.569  -8.395  -6.996
    2    HA   GLU 706           HA       GLU 706  55.549  -8.102  -4.866
    3    HB2  GLU 706           HB2      GLU 706  56.067  -8.387  -7.858
    4    HB3  GLU 706           HB3      GLU 706  57.256  -7.995  -6.628
    5    HG2  GLU 706           HG2      GLU 706  56.928 -10.173  -5.658
    6    HG3  GLU 706           HG3      GLU 706  55.690 -10.532  -6.866

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LYS 707           H        LYS 707  56.969  -6.204  -5.274
    2    HA   LYS 707           HA       LYS 707  55.560  -3.989  -6.491
    3    HB2  LYS 707           HB2      LYS 707  55.645  -2.602  -4.493
    4    HB3  LYS 707           HB3      LYS 707  54.633  -4.013  -4.219
    5    HG2  LYS 707           HG2      LYS 707  56.460  -5.068  -2.965
    6    HG3  LYS 707           HG3      LYS 707  57.475  -3.660  -3.265
    7    HD2  LYS 707           HD2      LYS 707  54.872  -3.667  -1.731
    8    HD3  LYS 707           HD3      LYS 707  56.483  -3.604  -1.013
    9    HE2  LYS 707           HE2      LYS 707  56.882  -1.460  -2.179
   10    HE3  LYS 707           HE3      LYS 707  55.249  -1.532  -2.835
   11    HZ2  LYS 707           HZ1      LYS 707  55.960  -1.326   0.043
   12    HZ1  LYS 707           HZ2      LYS 707  54.397  -1.459  -0.555
   13    HZ3  LYS 707           HZ3      LYS 707  55.306  -0.117  -0.925

  No H/Q in entry =          13
  In of MODEL   16
    1    H    LEU 708           H        LEU 708  56.866  -2.121  -6.677
    2    HA   LEU 708           HA       LEU 708  59.703  -2.771  -6.923
    3    HB2  LEU 708           HB2      LEU 708  58.507  -2.034  -8.929
    4    HB3  LEU 708           HB3      LEU 708  58.000  -0.572  -8.112
    5    HG   LEU 708           HG       LEU 708  60.427   0.090  -7.991
    6   HD12  LEU 708          HD11      LEU 708  61.991  -1.010  -9.501
    7   HD11  LEU 708          HD12      LEU 708  60.779  -2.239  -9.860
    8   HD13  LEU 708          HD13      LEU 708  61.437  -2.097  -8.229
    9   HD22  LEU 708          HD21      LEU 708  58.929   1.015  -9.668
   10   HD21  LEU 708          HD22      LEU 708  59.250  -0.358 -10.730
   11   HD23  LEU 708          HD23      LEU 708  60.542   0.775 -10.338

  No H/Q in entry =          11
  In of MODEL   16
    1    H    GLN 709           H        GLN 709  60.895  -2.125  -5.212
    2    HA   GLN 709           HA       GLN 709  60.624   0.623  -4.254
    3    HB2  GLN 709           HB2      GLN 709  60.438   0.088  -1.952
    4    HB3  GLN 709           HB3      GLN 709  59.356  -1.086  -2.684
    5    HG2  GLN 709           HG2      GLN 709  61.089  -2.782  -2.479
    6    HG3  GLN 709           HG3      GLN 709  62.196  -1.569  -1.830
    7   HE21  GLN 709          HE21      GLN 709  61.401  -3.903  -0.597
    8   HE22  GLN 709          HE22      GLN 709  60.544  -3.533   0.859

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ASN 710           H        ASN 710  62.608   1.396  -3.464
    2    HA   ASN 710           HA       ASN 710  64.906   1.514  -3.263
    3    HB2  ASN 710           HB2      ASN 710  64.368  -0.370  -1.668
    4    HB3  ASN 710           HB3      ASN 710  64.710  -1.508  -2.941
    5   HD21  ASN 710          HD21      ASN 710  66.029   0.604  -0.602
    6   HD22  ASN 710          HD22      ASN 710  67.685   0.152  -0.792

  No H/Q in entry =           6
  In of MODEL   16
    1    H    SER 711           H        SER 711  63.501   0.920  -5.834
    2    HA   SER 711           HA       SER 711  63.856   0.647  -8.017
    3    HB2  SER 711           HB2      SER 711  65.878   2.106  -7.486
    4    HB3  SER 711           HB3      SER 711  66.836   0.636  -7.398
    5    HG   SER 711           HG       SER 711  65.694   1.919  -9.599

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ARG 712           H        ARG 712  63.869  -1.695  -6.042
    2    HA   ARG 712           HA       ARG 712  64.792  -3.733  -7.943
    3    HB2  ARG 712           HB2      ARG 712  65.445  -5.158  -6.107
    4    HB3  ARG 712           HB3      ARG 712  66.228  -3.605  -5.863
    5    HG2  ARG 712           HG2      ARG 712  64.553  -3.004  -4.210
    6    HG3  ARG 712           HG3      ARG 712  63.713  -4.524  -4.478
    7    HD2  ARG 712           HD2      ARG 712  65.030  -4.783  -2.501
    8    HD3  ARG 712           HD3      ARG 712  65.804  -5.699  -3.791
    9    HE   ARG 712           HE       ARG 712  66.772  -3.001  -3.332
   10   HH11  ARG 712          HH11      ARG 712  67.313  -6.482  -2.840
   11   HH12  ARG 712          HH12      ARG 712  68.941  -6.270  -2.366
   12   HH21  ARG 712          HH21      ARG 712  68.946  -2.740  -2.638
   13   HH22  ARG 712          HH22      ARG 712  69.893  -4.108  -2.255

  No H/Q in entry =          13
  In of MODEL   16
    1    H    CYS 713           H        CYS 713  63.534  -5.888  -7.340
    2    HA   CYS 713           HA       CYS 713  60.793  -5.051  -6.775
    3    HB2  CYS 713           HB2      CYS 713  61.123  -5.889  -9.101
    4    HB3  CYS 713           HB3      CYS 713  61.644  -7.443  -8.422

  No H/Q in entry =           4
  In of MODEL   16
    1    H    VAL 714           H        VAL 714  59.770  -5.994  -5.178
    2    HA   VAL 714           HA       VAL 714  60.905  -8.360  -3.878
    3    HB   VAL 714           HB       VAL 714  60.410  -7.333  -1.647
    4   HG12  VAL 714          HG11      VAL 714  62.369  -5.735  -3.286
    5   HG11  VAL 714          HG12      VAL 714  62.702  -7.281  -2.501
    6   HG13  VAL 714          HG13      VAL 714  62.343  -5.855  -1.526
    7   HG22  VAL 714          HG21      VAL 714  60.063  -4.910  -1.467
    8   HG21  VAL 714          HG22      VAL 714  58.763  -5.681  -2.376
    9   HG23  VAL 714          HG23      VAL 714  60.024  -4.788  -3.226

  No H/Q in entry =           9
  In of MODEL   16
    1    H    CYS 715           H        CYS 715  59.122  -9.009  -2.128
    2    HA   CYS 715           HA       CYS 715  56.643  -9.151  -3.650
    3    HB2  CYS 715           HB2      CYS 715  57.064 -10.265  -0.863
    4    HB3  CYS 715           HB3      CYS 715  55.992 -10.864  -2.123

  No H/Q in entry =           4
  In of MODEL   16
    1    H    LYS 716           H        LYS 716  54.633  -8.264  -2.724
    2    HA   LYS 716           HA       LYS 716  55.201  -5.888  -1.207
    3    HB2  LYS 716           HB2      LYS 716  52.774  -5.340  -1.510
    4    HB3  LYS 716           HB3      LYS 716  53.632  -5.638  -3.011
    5    HG2  LYS 716           HG2      LYS 716  52.654  -7.842  -3.144
    6    HG3  LYS 716           HG3      LYS 716  51.847  -7.593  -1.598
    7    HD2  LYS 716           HD2      LYS 716  50.323  -7.251  -3.511
    8    HD3  LYS 716           HD3      LYS 716  50.526  -5.786  -2.547
    9    HE2  LYS 716           HE2      LYS 716  51.990  -4.832  -4.188
   10    HE3  LYS 716           HE3      LYS 716  52.075  -6.352  -5.076
   11    HZ2  LYS 716           HZ1      LYS 716  50.567  -4.664  -6.064
   12    HZ1  LYS 716           HZ2      LYS 716  49.539  -4.818  -4.728
   13    HZ3  LYS 716           HZ3      LYS 716  49.859  -6.142  -5.735

  No H/Q in entry =          13
  In of MODEL   16
    1    H    MET 717           H        MET 717  53.041  -5.464   0.363
    2    HA   MET 717           HA       MET 717  53.538  -7.313   2.573
    3    HB2  MET 717           HB2      MET 717  52.039  -4.705   2.423
    4    HB3  MET 717           HB3      MET 717  52.297  -5.623   3.888
    5    HG2  MET 717           HG2      MET 717  54.526  -4.429   2.247
    6    HG3  MET 717           HG3      MET 717  53.721  -3.572   3.550
    7    HE1  MET 717           HE1      MET 717  56.453  -6.033   2.518
    8    HE3  MET 717           HE2      MET 717  55.343  -7.295   3.071
    9    HE2  MET 717           HE3      MET 717  56.815  -6.954   3.971

  No H/Q in entry =           9
  In of MODEL   16
    1    HA   PRO 718           HA       PRO 718  49.769  -9.441   1.656
    2    HB2  PRO 718           HB2      PRO 718  49.398 -10.761   4.006
    3    HB3  PRO 718           HB3      PRO 718  50.622 -11.228   2.823
    4    HG2  PRO 718           HG2      PRO 718  50.924  -9.642   5.333
    5    HG3  PRO 718           HG3      PRO 718  51.978 -10.909   4.681
    6    HD2  PRO 718           HD2      PRO 718  52.528  -8.255   4.444
    7    HD3  PRO 718           HD3      PRO 718  53.034  -9.455   3.239

  No H/Q in entry =           7
  In of MODEL   16
    1    H    TYR 719           H        TYR 719  50.049  -7.262   4.291
    2    HA   TYR 719           HA       TYR 719  47.207  -7.273   4.827
    3    HB2  TYR 719           HB2      TYR 719  47.739  -5.532   6.547
    4    HB3  TYR 719           HB3      TYR 719  48.593  -7.044   6.784
    5    HD1  TYR 719           HD1      TYR 719  48.908  -3.487   6.183
    6    HD2  TYR 719           HD2      TYR 719  51.042  -7.162   6.286
    7    HE1  TYR 719           HE1      TYR 719  51.022  -2.248   6.343
    8    HE2  TYR 719           HE2      TYR 719  53.159  -5.937   6.458
    9    HH   TYR 719           HH       TYR 719  54.055  -3.752   5.911

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLU 720           H        GLU 720  49.230  -5.900   2.651
    2    HA   GLU 720           HA       GLU 720  47.636  -3.481   2.277
    3    HB2  GLU 720           HB2      GLU 720  50.306  -4.396   1.248
    4    HB3  GLU 720           HB3      GLU 720  49.530  -2.915   0.683
    5    HG2  GLU 720           HG2      GLU 720  50.318  -3.492   3.539
    6    HG3  GLU 720           HG3      GLU 720  51.272  -2.536   2.407

  No H/Q in entry =           6
  In of MODEL   16
    1    H    CYS 721           H        CYS 721  46.950  -6.270   1.711
    2    HA   CYS 721           HA       CYS 721  46.636  -6.339  -1.206
    3    HB2  CYS 721           HB2      CYS 721  47.673  -8.329  -0.365
    4    HB3  CYS 721           HB3      CYS 721  46.481  -8.488   0.937

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLY 722           H        GLY 722  44.491  -7.038  -1.945
    2    HA3  GLY 722           HA2      GLY 722  42.281  -6.818  -0.158
    3    HA2  GLY 722           HA3      GLY 722  42.474  -5.392  -1.165

  No H/Q in entry =           3
  In of MODEL   16
    1    HA   PRO 723           HA       PRO 723  40.323  -7.366  -4.410
    2    HB2  PRO 723           HB2      PRO 723  42.158  -6.657  -6.533
    3    HB3  PRO 723           HB3      PRO 723  40.605  -5.922  -6.126
    4    HG2  PRO 723           HG2      PRO 723  42.989  -4.649  -5.796
    5    HG3  PRO 723           HG3      PRO 723  41.567  -4.319  -4.798
    6    HD2  PRO 723           HD2      PRO 723  43.958  -6.008  -4.196
    7    HD3  PRO 723           HD3      PRO 723  43.086  -4.873  -3.144

  No H/Q in entry =           7
  In of MODEL   16
    1    H    SER 724           H        SER 724  40.325  -9.541  -4.316
    2    HA   SER 724           HA       SER 724  41.638 -11.065  -6.283
    3    HB2  SER 724           HB2      SER 724  42.792 -12.528  -4.511
    4    HB3  SER 724           HB3      SER 724  43.615 -11.086  -5.120
    5    HG   SER 724           HG       SER 724  42.428 -10.109  -3.216

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU 725           H        LEU 725  41.000 -13.168  -6.419
    2    HA   LEU 725           HA       LEU 725  38.456 -13.880  -5.374
    3    HB2  LEU 725           HB2      LEU 725  40.578 -15.236  -6.944
    4    HB3  LEU 725           HB3      LEU 725  39.499 -16.282  -6.067
    5    HG   LEU 725           HG       LEU 725  37.587 -15.302  -7.312
    6   HD12  LEU 725          HD11      LEU 725  39.712 -13.887  -8.848
    7   HD11  LEU 725          HD12      LEU 725  38.599 -13.139  -7.709
    8   HD13  LEU 725          HD13      LEU 725  37.982 -13.888  -9.185
    9   HD21  LEU 725          HD21      LEU 725  38.679 -17.329  -8.122
   10   HD23  LEU 725          HD22      LEU 725  39.812 -16.337  -9.048
   11   HD22  LEU 725          HD23      LEU 725  38.097 -16.324  -9.453

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ASP 726           H        ASP 726  37.954 -14.911  -3.522
    2    HA   ASP 726           HA       ASP 726  40.155 -15.330  -1.667
    3    HB2  ASP 726           HB2      ASP 726  37.848 -14.105  -1.267
    4    HB3  ASP 726           HB3      ASP 726  37.301 -15.739  -0.947

  No H/Q in entry =           4
  In of MODEL   16
    1    H    VAL 727           H        VAL 727  40.805 -17.312  -1.057
    2    HA   VAL 727           HA       VAL 727  39.141 -19.464  -1.993
    3    HB   VAL 727           HB       VAL 727  41.157 -20.739  -2.739
    4   HG13  VAL 727          HG11      VAL 727  39.754 -19.721  -4.431
    5   HG12  VAL 727          HG12      VAL 727  41.448 -19.562  -4.915
    6   HG11  VAL 727          HG13      VAL 727  40.595 -18.183  -4.234
    7   HG23  VAL 727          HG21      VAL 727  42.574 -18.089  -2.617
    8   HG22  VAL 727          HG22      VAL 727  43.227 -19.599  -3.265
    9   HG21  VAL 727          HG23      VAL 727  42.861 -19.458  -1.549

  No H/Q in entry =           9
  In of MODEL   16
    1    H    CYS 728           H        CYS 728  39.968 -21.636  -1.080
    2    HA   CYS 728           HA       CYS 728  40.634 -21.201   1.732
    3    HB2  CYS 728           HB2      CYS 728  39.508 -23.628   0.328
    4    HB3  CYS 728           HB3      CYS 728  39.860 -23.529   2.047

  No H/Q in entry =           4
  In of MODEL   16
    1    H    ALA 729           H        ALA 729  42.594 -21.466   2.306
    2    HA   ALA 729           HA       ALA 729  44.225 -23.335   0.780
    3    HB1  ALA 729           HB1      ALA 729  45.001 -20.763   2.117
    4    HB3  ALA 729           HB2      ALA 729  44.966 -21.074   0.374
    5    HB2  ALA 729           HB3      ALA 729  46.146 -21.898   1.402

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLN 730           H        GLN 730  45.672 -24.491   1.966
    2    HA   GLN 730           HA       GLN 730  44.876 -24.864   4.754
    3    HB2  GLN 730           HB2      GLN 730  44.668 -26.866   3.382
    4    HB3  GLN 730           HB3      GLN 730  46.348 -26.726   2.888
    5    HG2  GLN 730           HG2      GLN 730  47.057 -27.042   5.188
    6    HG3  GLN 730           HG3      GLN 730  45.388 -27.208   5.702
    7   HE21  GLN 730          HE21      GLN 730  45.672 -29.289   6.452
    8   HE22  GLN 730          HE22      GLN 730  46.014 -30.633   5.430

  No H/Q in entry =           8
  In of MODEL   16
    1    H    ASP 731           H        ASP 731  46.173 -24.378   6.256
    2    HA   ASP 731           HA       ASP 731  48.683 -23.111   5.783
    3    HB2  ASP 731           HB2      ASP 731  47.180 -22.497   7.669
    4    HB3  ASP 731           HB3      ASP 731  47.449 -24.085   8.371

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLU 732           H        GLU 732  50.646 -24.113   5.640
    2    HA   GLU 732           HA       GLU 732  50.673 -26.948   5.809
    3    HB2  GLU 732           HB2      GLU 732  52.689 -24.923   5.002
    4    HB3  GLU 732           HB3      GLU 732  53.195 -26.577   5.326
    5    HG2  GLU 732           HG2      GLU 732  51.089 -25.736   3.358
    6    HG3  GLU 732           HG3      GLU 732  52.741 -26.239   2.972

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ARG 733           H        ARG 733  51.104 -24.687   8.204
    2    HA   ARG 733           HA       ARG 733  53.047 -26.356   9.578
    3    HB2  ARG 733           HB2      ARG 733  53.257 -23.829   9.417
    4    HB3  ARG 733           HB3      ARG 733  51.861 -23.733  10.471
    5    HG2  ARG 733           HG2      ARG 733  53.878 -23.440  11.744
    6    HG3  ARG 733           HG3      ARG 733  53.102 -24.964  12.197
    7    HD2  ARG 733           HD2      ARG 733  54.651 -26.210  10.840
    8    HD3  ARG 733           HD3      ARG 733  55.360 -24.725  10.210
    9    HE   ARG 733           HE       ARG 733  55.468 -24.837  13.021
   10   HH11  ARG 733          HH11      ARG 733  57.044 -26.158  10.121
   11   HH12  ARG 733          HH12      ARG 733  58.551 -26.381  10.856
   12   HH21  ARG 733          HH21      ARG 733  57.575 -25.137  14.031
   13   HH22  ARG 733          HH22      ARG 733  58.860 -25.792  13.137

  No H/Q in entry =          13
  In of MODEL   16
    1    H    SER 734           H        SER 734  49.852 -24.969   9.905
    2    HA   SER 734           HA       SER 734  49.286 -26.522  12.316
    3    HB2  SER 734           HB2      SER 734  47.574 -24.466  10.935
    4    HB3  SER 734           HB3      SER 734  47.449 -25.028  12.603
    5    HG   SER 734           HG       SER 734  49.465 -23.471  11.403

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LYS 735           H        LYS 735  48.661 -26.704   8.886
    2    HA   LYS 735           HA       LYS 735  47.495 -27.953   7.590
    3    HB2  LYS 735           HB2      LYS 735  47.298 -29.734   9.999
    4    HB3  LYS 735           HB3      LYS 735  46.726 -30.200   8.403
    5    HG2  LYS 735           HG2      LYS 735  49.557 -29.503   9.162
    6    HG3  LYS 735           HG3      LYS 735  48.925 -31.110   8.802
    7    HD2  LYS 735           HD2      LYS 735  48.306 -30.177   6.498
    8    HD3  LYS 735           HD3      LYS 735  49.247 -28.777   6.935
    9    HE2  LYS 735           HE2      LYS 735  51.240 -30.024   7.214
   10    HE3  LYS 735           HE3      LYS 735  50.408 -31.558   6.978
   11    HZ1  LYS 735           HZ1      LYS 735  50.707 -29.450   4.863
   12    HZ3  LYS 735           HZ2      LYS 735  50.059 -30.988   4.666
   13    HZ2  LYS 735           HZ3      LYS 735  51.673 -30.802   5.028

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ARG 736           H        ARG 736  45.994 -25.969   9.342
    2    HA   ARG 736           HA       ARG 736  43.314 -27.080   9.058
    3    HB2  ARG 736           HB2      ARG 736  42.497 -25.113  10.179
    4    HB3  ARG 736           HB3      ARG 736  43.799 -25.826  11.116
    5    HG2  ARG 736           HG2      ARG 736  45.314 -24.144  10.424
    6    HG3  ARG 736           HG3      ARG 736  44.156 -23.514   9.253
    7    HD2  ARG 736           HD2      ARG 736  43.810 -23.548  12.239
    8    HD3  ARG 736           HD3      ARG 736  44.264 -22.179  11.211
    9    HE   ARG 736           HE       ARG 736  41.664 -23.548  10.897
   10   HH11  ARG 736          HH11      ARG 736  43.498 -20.520  11.211
   11   HH12  ARG 736          HH12      ARG 736  42.112 -19.542  11.148
   12   HH21  ARG 736          HH21      ARG 736  39.795 -22.179  10.813
   13   HH22  ARG 736          HH22      ARG 736  39.965 -20.489  10.898

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ILE 737           H        ILE 737  41.676 -25.904   7.878
    2    HA   ILE 737           HA       ILE 737  42.752 -24.700   5.464
    3    HB   ILE 737           HB       ILE 737  39.834 -25.139   6.083
    4   HG12  ILE 737          HG12      ILE 737  41.053 -27.314   6.463
    5   HG13  ILE 737          HG13      ILE 737  39.916 -27.372   5.127
    6   HG23  ILE 737          HG21      ILE 737  39.591 -25.103   3.729
    7   HG22  ILE 737          HG22      ILE 737  41.315 -25.333   3.489
    8   HG21  ILE 737          HG23      ILE 737  40.733 -23.795   4.108
    9   HD12  ILE 737          HD11      ILE 737  41.968 -28.547   4.609
   10   HD11  ILE 737          HD12      ILE 737  42.902 -27.070   4.900
   11   HD13  ILE 737          HD13      ILE 737  41.738 -27.142   3.567

  No H/Q in entry =          11
  In of MODEL   16
    1    H    LEU 738           H        LEU 738  42.746 -22.518   5.242
    2    HA   LEU 738           HA       LEU 738  40.816 -20.962   6.754
    3    HB2  LEU 738           HB2      LEU 738  42.494 -19.226   7.330
    4    HB3  LEU 738           HB3      LEU 738  42.875 -20.762   8.061
    5    HG   LEU 738           HG       LEU 738  44.238 -19.781   5.553
    6   HD11  LEU 738          HD11      LEU 738  45.068 -19.451   8.439
    7   HD13  LEU 738          HD12      LEU 738  44.601 -18.150   7.339
    8   HD12  LEU 738          HD13      LEU 738  46.066 -19.081   7.034
    9   HD21  LEU 738          HD21      LEU 738  44.285 -22.134   6.103
   10   HD23  LEU 738          HD22      LEU 738  45.000 -21.742   7.672
   11   HD22  LEU 738          HD23      LEU 738  45.890 -21.397   6.165

  No H/Q in entry =          11
  In of MODEL   16
    1    HA   PRO 739           HA       PRO 739  40.239 -18.829   2.924
    2    HB2  PRO 739           HB2      PRO 739  39.436 -16.415   3.809
    3    HB3  PRO 739           HB3      PRO 739  38.403 -17.844   3.935
    4    HG2  PRO 739           HG2      PRO 739  40.114 -16.560   6.030
    5    HG3  PRO 739           HG3      PRO 739  38.465 -17.200   6.177
    6    HD2  PRO 739           HD2      PRO 739  40.685 -18.640   6.968
    7    HD3  PRO 739           HD3      PRO 739  39.192 -19.382   6.341

  No H/Q in entry =           7
  In of MODEL   16
    1    H    LEU 740           H        LEU 740  41.958 -18.325   1.806
    2    HA   LEU 740           HA       LEU 740  43.519 -15.940   2.491
    3    HB2  LEU 740           HB2      LEU 740  44.569 -18.589   1.523
    4    HB3  LEU 740           HB3      LEU 740  45.446 -17.081   1.356
    5    HG   LEU 740           HG       LEU 740  44.622 -18.305   3.988
    6   HD12  LEU 740          HD11      LEU 740  46.997 -18.739   4.251
    7   HD11  LEU 740          HD12      LEU 740  47.293 -18.128   2.619
    8   HD13  LEU 740          HD13      LEU 740  46.327 -19.584   2.862
    9   HD21  LEU 740          HD21      LEU 740  46.294 -15.877   3.324
   10   HD23  LEU 740          HD22      LEU 740  46.125 -16.583   4.931
   11   HD22  LEU 740          HD23      LEU 740  44.725 -15.878   4.130

  No H/Q in entry =          11
  In of MODEL   16
    1    H    THR 741           H        THR 741  43.489 -14.596   0.900
    2    HA   THR 741           HA       THR 741  41.962 -15.314  -1.412
    3    HB   THR 741           HB       THR 741  43.226 -12.625  -0.962
    4    HG1  THR 741           HG1      THR 741  41.267 -13.897   0.654
    5   HG22  THR 741          HG21      THR 741  40.338 -13.427  -1.318
    6   HG21  THR 741          HG22      THR 741  41.422 -13.098  -2.664
    7   HG23  THR 741          HG23      THR 741  41.035 -11.819  -1.509

  No H/Q in entry =           7
  In of MODEL   16
    1    H    VAL 742           H        VAL 742  42.774 -14.995  -3.618
    2    HA   VAL 742           HA       VAL 742  45.240 -16.124  -4.073
    3    HB   VAL 742           HB       VAL 742  43.780 -16.254  -5.994
    4   HG11  VAL 742          HG11      VAL 742  42.439 -14.353  -5.552
    5   HG13  VAL 742          HG12      VAL 742  42.956 -14.530  -7.228
    6   HG12  VAL 742          HG13      VAL 742  43.723 -13.302  -6.199
    7   HG21  VAL 742          HG21      VAL 742  46.158 -15.989  -6.610
    8   HG23  VAL 742          HG22      VAL 742  45.861 -14.262  -6.797
    9   HG22  VAL 742          HG23      VAL 742  45.031 -15.414  -7.838

  No H/Q in entry =           9
  In of MODEL   16
    1    H    CYS 743           H        CYS 743  44.667 -12.654  -4.107
    2    HA   CYS 743           HA       CYS 743  47.297 -11.915  -4.693
    3    HB2  CYS 743           HB2      CYS 743  45.849 -10.079  -4.857
    4    HB3  CYS 743           HB3      CYS 743  44.941 -10.581  -3.433

  No H/Q in entry =           4
  In of MODEL   16
    1    H    LYS 744           H        LYS 744  45.635 -12.449  -1.644
    2    HA   LYS 744           HA       LYS 744  47.681 -11.573   0.022
    3    HB2  LYS 744           HB2      LYS 744  45.233 -11.872   0.554
    4    HB3  LYS 744           HB3      LYS 744  45.551 -13.592   0.692
    5    HG2  LYS 744           HG2      LYS 744  47.048 -13.208   2.541
    6    HG3  LYS 744           HG3      LYS 744  46.869 -11.458   2.355
    7    HD2  LYS 744           HD2      LYS 744  44.389 -11.815   2.690
    8    HD3  LYS 744           HD3      LYS 744  44.782 -13.458   3.169
    9    HE2  LYS 744           HE2      LYS 744  46.136 -12.677   4.997
   10    HE3  LYS 744           HE3      LYS 744  45.930 -11.003   4.480
   11    HZ1  LYS 744           HZ1      LYS 744  43.754 -12.787   5.434
   12    HZ3  LYS 744           HZ2      LYS 744  43.565 -11.182   4.958
   13    HZ2  LYS 744           HZ3      LYS 744  44.468 -11.550   6.320

  No H/Q in entry =          13
  In of MODEL   16
    1    H    MET 745           H        MET 745  46.649 -14.889  -0.761
    2    HA   MET 745           HA       MET 745  48.762 -16.225   0.632
    3    HB2  MET 745           HB2      MET 745  47.705 -18.080   0.047
    4    HB3  MET 745           HB3      MET 745  46.402 -17.000  -0.395
    5    HG2  MET 745           HG2      MET 745  46.415 -18.221  -2.323
    6    HG3  MET 745           HG3      MET 745  47.652 -17.052  -2.740
    7    HE2  MET 745           HE1      MET 745  48.568 -21.358  -1.298
    8    HE1  MET 745           HE2      MET 745  46.941 -20.737  -1.523
    9    HE3  MET 745           HE3      MET 745  47.945 -20.125  -0.210

  No H/Q in entry =           9
  In of MODEL   16
    1    H    HIS 746           H        HIS 746  48.615 -14.756  -2.583
    2    HA   HIS 746           HA       HIS 746  50.975 -16.116  -3.562
    3    HB2  HIS 746           HB2      HIS 746  49.236 -13.994  -4.527
    4    HB3  HIS 746           HB3      HIS 746  50.924 -13.748  -4.968
    5    HD1  HIS 746           HD1      HIS 746  51.897 -16.257  -6.132
    6    HD2  HIS 746           HD2      HIS 746  47.914 -15.132  -6.409
    7    HE1  HIS 746           HE1      HIS 746  51.010 -17.434  -8.135
    8    HE2  HIS 746           HE2      HIS 746  48.519 -16.895  -8.136

  No H/Q in entry =           8
  In of MODEL   16
    1    H    VAL 747           H        VAL 747  50.335 -12.930  -2.168
    2    HA   VAL 747           HA       VAL 747  52.960 -11.903  -2.203
    3    HB   VAL 747           HB       VAL 747  50.682 -11.476  -0.234
    4   HG13  VAL 747          HG11      VAL 747  51.844  -9.445   0.461
    5   HG12  VAL 747          HG12      VAL 747  53.192  -9.842  -0.596
    6   HG11  VAL 747          HG13      VAL 747  52.825 -10.869   0.788
    7   HG22  VAL 747          HG21      VAL 747  50.341  -9.404  -1.467
    8   HG21  VAL 747          HG22      VAL 747  50.195 -10.839  -2.502
    9   HG23  VAL 747          HG23      VAL 747  51.666  -9.867  -2.541

  No H/Q in entry =           9
  In of MODEL   16
    1    H    LEU 748           H        LEU 748  51.122 -13.450   0.199
    2    HA   LEU 748           HA       LEU 748  52.856 -13.972   2.237
    3    HB2  LEU 748           HB2      LEU 748  50.575 -14.104   2.544
    4    HB3  LEU 748           HB3      LEU 748  50.304 -14.870   1.033
    5    HG   LEU 748           HG       LEU 748  49.425 -16.131   2.702
    6   HD12  LEU 748          HD11      LEU 748  51.865 -17.574   1.842
    7   HD11  LEU 748          HD12      LEU 748  50.307 -17.431   1.020
    8   HD13  LEU 748          HD13      LEU 748  50.399 -18.261   2.563
    9   HD21  LEU 748          HD21      LEU 748  52.020 -16.093   4.162
   10   HD23  LEU 748          HD22      LEU 748  50.574 -17.072   4.542
   11   HD22  LEU 748          HD23      LEU 748  50.477 -15.313   4.596

  No H/Q in entry =          11
  In of MODEL   16
    1    H    HIS 749           H        HIS 749  52.218 -15.852  -0.707
    2    HA   HIS 749           HA       HIS 749  53.891 -18.084  -0.144
    3    HB2  HIS 749           HB2      HIS 749  51.985 -17.770  -1.915
    4    HB3  HIS 749           HB3      HIS 749  53.273 -17.133  -2.929
    5    HD1  HIS 749           HD1      HIS 749  53.993 -18.945  -4.523
    6    HD2  HIS 749           HD2      HIS 749  52.944 -20.348  -0.782
    7    HE1  HIS 749           HE1      HIS 749  54.350 -21.418  -4.625
    8    HE2  HIS 749           HE2      HIS 749  54.078 -22.162  -2.259

  No H/Q in entry =           8
  In of MODEL   16
    1    H    CYS 750           H        CYS 750  54.302 -15.094  -1.948
    2    HA   CYS 750           HA       CYS 750  56.899 -15.605  -2.937
    3    HB2  CYS 750           HB2      CYS 750  55.405 -13.999  -3.977
    4    HB3  CYS 750           HB3      CYS 750  55.389 -12.943  -2.609

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLN 751           H        GLN 751  55.681 -14.042   0.006
    2    HA   GLN 751           HA       GLN 751  58.149 -13.099   0.949
    3    HB2  GLN 751           HB2      GLN 751  55.793 -13.999   2.610
    4    HB3  GLN 751           HB3      GLN 751  57.121 -13.001   3.176
    5    HG2  GLN 751           HG2      GLN 751  56.369 -11.399   1.253
    6    HG3  GLN 751           HG3      GLN 751  54.899 -12.332   1.327
    7   HE21  GLN 751          HE21      GLN 751  55.447  -9.529   2.004
    8   HE22  GLN 751          HE22      GLN 751  54.915  -9.357   3.637

  No H/Q in entry =           8
  In of MODEL   16
    1    H    GLY 752           H        GLY 752  56.765 -16.255   1.010
    2    HA3  GLY 752           HA2      GLY 752  58.475 -18.042   1.083
    3    HA2  GLY 752           HA3      GLY 752  59.152 -17.193   2.461

  No H/Q in entry =           3
  In of MODEL   16
    1    H    ARG 753           H        ARG 753  55.687 -17.580   2.040
    2    HA   ARG 753           HA       ARG 753  55.708 -19.339   4.387
    3    HB2  ARG 753           HB2      ARG 753  53.457 -17.652   3.260
    4    HB3  ARG 753           HB3      ARG 753  53.408 -18.584   4.749
    5    HG2  ARG 753           HG2      ARG 753  55.249 -16.246   4.255
    6    HG3  ARG 753           HG3      ARG 753  53.719 -16.133   5.111
    7    HD2  ARG 753           HD2      ARG 753  56.026 -17.879   5.924
    8    HD3  ARG 753           HD3      ARG 753  55.655 -16.302   6.626
    9    HE   ARG 753           HE       ARG 753  53.350 -17.673   6.942
   10   HH11  ARG 753          HH11      ARG 753  56.679 -18.491   7.791
   11   HH12  ARG 753          HH12      ARG 753  56.261 -19.340   9.203
   12   HH21  ARG 753          HH21      ARG 753  52.770 -18.877   8.838
   13   HH22  ARG 753          HH22      ARG 753  53.995 -19.591   9.785

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ASN 754           H        ASN 754  54.826 -21.361   4.206
    2    HA   ASN 754           HA       ASN 754  54.238 -22.194   1.477
    3    HB2  ASN 754           HB2      ASN 754  54.791 -23.860   3.939
    4    HB3  ASN 754           HB3      ASN 754  54.527 -24.492   2.321
    5   HD21  ASN 754          HD21      ASN 754  56.775 -24.792   4.059
    6   HD22  ASN 754          HD22      ASN 754  58.158 -24.202   3.222

  No H/Q in entry =           6
  In of MODEL   16
    1    H    TYR 755           H        TYR 755  52.266 -22.477   0.841
    2    HA   TYR 755           HA       TYR 755  50.286 -23.428   2.713
    3    HB2  TYR 755           HB2      TYR 755  50.129 -20.873   1.200
    4    HB3  TYR 755           HB3      TYR 755  48.645 -21.762   1.512
    5    HD1  TYR 755           HD1      TYR 755  51.425 -19.909   2.996
    6    HD2  TYR 755           HD2      TYR 755  47.793 -21.927   3.767
    7    HE1  TYR 755           HE1      TYR 755  51.366 -18.912   5.198
    8    HE2  TYR 755           HE2      TYR 755  47.729 -20.940   6.013
    9    HH   TYR 755           HH       TYR 755  49.377 -20.141   7.603

  No H/Q in entry =           9
  In of MODEL   16
    1    H    THR 756           H        THR 756  48.766 -24.638   1.896
    2    HA   THR 756           HA       THR 756  49.193 -25.603  -0.826
    3    HB   THR 756           HB       THR 756  47.899 -26.804   1.628
    4    HG1  THR 756           HG1      THR 756  49.830 -27.431   2.131
    5   HG22  THR 756          HG21      THR 756  48.657 -28.052  -0.991
    6   HG21  THR 756          HG22      THR 756  47.018 -27.636  -0.475
    7   HG23  THR 756          HG23      THR 756  47.921 -28.895   0.389

  No H/Q in entry =           7
  In of MODEL   16
    1    H    LEU 757           H        LEU 757  47.170 -25.889  -2.106
    2    HA   LEU 757           HA       LEU 757  45.075 -24.247  -0.982
    3    HB2  LEU 757           HB2      LEU 757  45.585 -25.007  -3.825
    4    HB3  LEU 757           HB3      LEU 757  44.086 -24.270  -3.295
    5    HG   LEU 757           HG       LEU 757  45.893 -22.588  -2.238
    6   HD11  LEU 757          HD11      LEU 757  47.789 -23.655  -3.241
    7   HD13  LEU 757          HD12      LEU 757  47.553 -22.046  -3.916
    8   HD12  LEU 757          HD13      LEU 757  47.084 -23.470  -4.850
    9   HD23  LEU 757          HD21      LEU 757  44.630 -22.452  -4.958
   10   HD22  LEU 757          HD22      LEU 757  45.260 -21.087  -4.006
   11   HD21  LEU 757          HD23      LEU 757  43.903 -22.026  -3.404

  No H/Q in entry =          11
  In of MODEL   16
    1    H    THR 758           H        THR 758  42.898 -24.906  -1.098
    2    HA   THR 758           HA       THR 758  42.569 -27.769  -1.398
    3    HB   THR 758           HB       THR 758  41.161 -27.728   0.713
    4    HG1  THR 758           HG1      THR 758  42.103 -25.116   0.649
    5   HG23  THR 758          HG21      THR 758  43.093 -27.930   2.228
    6   HG22  THR 758          HG22      THR 758  44.107 -27.084   1.063
    7   HG21  THR 758          HG23      THR 758  43.458 -28.674   0.672

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLY 759           H        GLY 759  40.067 -28.190  -1.051
    2    HA3  GLY 759           HA2      GLY 759  38.782 -27.022  -3.252
    3    HA2  GLY 759           HA3      GLY 759  38.001 -27.997  -2.018

  No H/Q in entry =           3
  In of MODEL   16
    1    H    ARG 760           H        ARG 760  36.970 -25.721  -3.418
    2    HA   ARG 760           HA       ARG 760  37.058 -23.281  -2.212
    3    HB2  ARG 760           HB2      ARG 760  36.046 -23.215  -4.233
    4    HB3  ARG 760           HB3      ARG 760  35.162 -24.704  -3.970
    5    HG2  ARG 760           HG2      ARG 760  34.375 -22.355  -2.400
    6    HG3  ARG 760           HG3      ARG 760  33.962 -22.328  -4.138
    7    HD2  ARG 760           HD2      ARG 760  32.840 -24.530  -3.799
    8    HD3  ARG 760           HD3      ARG 760  33.216 -24.427  -2.083
    9    HE   ARG 760           HE       ARG 760  31.862 -22.142  -2.605
   10   HH11  ARG 760          HH11      ARG 760  31.165 -25.619  -2.756
   11   HH12  ARG 760          HH12      ARG 760  29.490 -25.455  -2.843
   12   HH21  ARG 760          HH21      ARG 760  29.477 -21.856  -2.636
   13   HH22  ARG 760          HH22      ARG 760  28.507 -23.232  -2.743

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ASP 761           H        ASP 761  35.113 -25.969  -1.168
    2    HA   ASP 761           HA       ASP 761  33.990 -24.170   0.811
    3    HB2  ASP 761           HB2      ASP 761  32.232 -25.993   1.224
    4    HB3  ASP 761           HB3      ASP 761  32.123 -25.066  -0.256

  No H/Q in entry =           4
  In of MODEL   16
    1    H    SER 762           H        SER 762  36.605 -25.519   0.972
    2    HA   SER 762           HA       SER 762  36.317 -27.335   3.181
    3    HB2  SER 762           HB2      SER 762  38.812 -25.972   2.168
    4    HB3  SER 762           HB3      SER 762  38.748 -27.413   3.179
    5    HG   SER 762           HG       SER 762  38.272 -27.038   0.486

  No H/Q in entry =           5
  In of MODEL   16
    1    H    CYS 763           H        CYS 763  36.769 -23.868   2.807
    2    HA   CYS 763           HA       CYS 763  37.144 -23.639   5.723
    3    HB2  CYS 763           HB2      CYS 763  38.387 -21.615   5.376
    4    HB3  CYS 763           HB3      CYS 763  39.106 -22.852   4.358

  No H/Q in entry =           4
  In of MODEL   16
    1    H    THR 764           H        THR 764  36.396 -21.317   6.407
    2    HA   THR 764           HA       THR 764  33.745 -20.950   5.309
    3    HB   THR 764           HB       THR 764  35.090 -19.483   7.601
    4    HG1  THR 764           HG1      THR 764  33.979 -22.012   7.379
    5   HG21  THR 764          HG21      THR 764  33.092 -18.382   6.657
    6   HG23  THR 764          HG22      THR 764  32.787 -18.989   8.287
    7   HG22  THR 764          HG23      THR 764  32.173 -19.872   6.886

  No H/Q in entry =           7
  In of MODEL   16
    1    H    LEU 765           H        LEU 765  33.834 -19.954   3.435
    2    HA   LEU 765           HA       LEU 765  35.654 -17.712   3.053
    3    HB2  LEU 765           HB2      LEU 765  35.204 -19.867   1.542
    4    HB3  LEU 765           HB3      LEU 765  33.898 -18.836   0.972
    5    HG   LEU 765           HG       LEU 765  35.621 -17.127   0.370
    6   HD12  LEU 765          HD11      LEU 765  37.941 -17.877   0.239
    7   HD11  LEU 765          HD12      LEU 765  37.481 -19.368   1.077
    8   HD13  LEU 765          HD13      LEU 765  37.347 -17.822   1.901
    9   HD21  LEU 765          HD21      LEU 765  35.905 -19.856  -0.888
   10   HD23  LEU 765          HD22      LEU 765  36.378 -18.326  -1.619
   11   HD22  LEU 765          HD23      LEU 765  34.676 -18.658  -1.293

  No H/Q in entry =          11
  In of MODEL   16
    1    HA   PRO 766           HA       PRO 766  32.112 -14.981   3.534
    2    HB2  PRO 766           HB2      PRO 766  33.039 -12.908   1.945
    3    HB3  PRO 766           HB3      PRO 766  33.425 -13.117   3.647
    4    HG2  PRO 766           HG2      PRO 766  35.038 -13.750   1.242
    5    HG3  PRO 766           HG3      PRO 766  35.572 -13.231   2.849
    6    HD2  PRO 766           HD2      PRO 766  35.773 -15.791   1.938
    7    HD3  PRO 766           HD3      PRO 766  35.612 -15.400   3.652

  No H/Q in entry =           7
  In of MODEL   16
    1    H    ALA 767           H        ALA 767  33.489 -15.473   0.346
    2    HA   ALA 767           HA       ALA 767  30.871 -14.944  -0.830
    3    HB1  ALA 767           HB1      ALA 767  33.511 -15.274  -2.204
    4    HB2  ALA 767           HB2      ALA 767  32.772 -13.724  -1.764
    5    HB3  ALA 767           HB3      ALA 767  31.974 -14.799  -2.943

  No H/Q in entry =           5
  In of MODEL   16
    1    H    SER 768           H        SER 768  29.929 -16.690  -0.193
    2    HA   SER 768           HA       SER 768  30.919 -19.221  -1.199
    3    HB2  SER 768           HB2      SER 768  29.083 -20.072   0.346
    4    HB3  SER 768           HB3      SER 768  30.485 -19.310   1.110
    5    HG   SER 768           HG       SER 768  28.041 -18.694   1.530

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA 769           H        ALA 769  28.579 -16.808  -1.788
    2    HA   ALA 769           HA       ALA 769  27.326 -18.200  -3.927
    3    HB2  ALA 769           HB1      ALA 769  25.698 -17.506  -1.464
    4    HB3  ALA 769           HB2      ALA 769  26.056 -19.136  -2.029
    5    HB1  ALA 769           HB3      ALA 769  25.036 -18.072  -3.000

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLU 770           H        GLU 770  25.105 -16.570  -4.167
    2    HA   GLU 770           HA       GLU 770  26.133 -14.169  -5.216
    3    HB2  GLU 770           HB2      GLU 770  23.787 -13.624  -5.658
    4    HB3  GLU 770           HB3      GLU 770  24.115 -15.307  -6.061
    5    HG2  GLU 770           HG2      GLU 770  23.223 -15.857  -3.742
    6    HG3  GLU 770           HG3      GLU 770  22.609 -14.212  -3.710

  No H/Q in entry =           6
  In of MODEL   16
    1    H    LYS 771           H        LYS 771  25.366 -11.945  -4.618
    2    HA   LYS 771           HA       LYS 771  25.328 -11.689  -1.713
    3    HB2  LYS 771           HB2      LYS 771  27.078 -10.184  -3.644
    4    HB3  LYS 771           HB3      LYS 771  26.848  -9.685  -1.983
    5    HG2  LYS 771           HG2      LYS 771  27.910 -12.408  -2.707
    6    HG3  LYS 771           HG3      LYS 771  28.963 -11.010  -2.571
    7    HD2  LYS 771           HD2      LYS 771  29.035 -12.297  -0.529
    8    HD3  LYS 771           HD3      LYS 771  28.245 -10.759  -0.189
    9    HE2  LYS 771           HE2      LYS 771  26.138 -11.827  -0.076
   10    HE3  LYS 771           HE3      LYS 771  26.786 -13.365  -0.698
   11    HZ1  LYS 771           HZ1      LYS 771  28.108 -13.393   1.446
   12    HZ3  LYS 771           HZ2      LYS 771  26.439 -13.462   1.647
   13    HZ2  LYS 771           HZ3      LYS 771  27.246 -12.033   1.923

  No H/Q in entry =          13
  In of MODEL   16
    1    H    ALA 772           H        ALA 772  24.568  -9.617  -0.931
    2    HA   ALA 772           HA       ALA 772  22.512  -8.418  -2.630
    3    HB3  ALA 772           HB1      ALA 772  21.821  -9.190  -0.393
    4    HB1  ALA 772           HB2      ALA 772  21.687  -7.437  -0.521
    5    HB2  ALA 772           HB3      ALA 772  23.045  -8.156   0.343

  No H/Q in entry =           5
  In of MODEL   16
    1    H    CYS 773           H        CYS 773  22.331  -5.888  -1.939
    2    HA   CYS 773           HA       CYS 773  24.808  -4.819  -2.978
    3    HB2  CYS 773           HB2      CYS 773  22.312  -4.153  -3.489
    4    HB3  CYS 773           HB3      CYS 773  22.519  -3.128  -2.082

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLY 774           H        GLY 774  26.149  -3.393  -1.918
    2    HA3  GLY 774           HA2      GLY 774  26.580  -1.889  -0.060
    3    HA2  GLY 774           HA3      GLY 774  25.660  -2.989   0.966

  No H/Q in entry =           3
  In of MODEL   16
    1    H    ALA 775           H        ALA 775  26.892  -5.283  -0.425
    2    HA   ALA 775           HA       ALA 775  29.690  -5.055   0.249
    3    HB2  ALA 775           HB1      ALA 775  28.699  -5.898   2.311
    4    HB1  ALA 775           HB2      ALA 775  29.594  -7.199   1.514
    5    HB3  ALA 775           HB3      ALA 775  27.838  -7.145   1.417

  No H/Q in entry =           5
  In of MODEL   16
    1    H    CYS 776           H        CYS 776  30.370  -5.399  -1.733
    2    HA   CYS 776           HA       CYS 776  29.374  -7.756  -3.106
    3    HB2  CYS 776           HB2      CYS 776  30.008  -5.032  -4.262
    4    HB3  CYS 776           HB3      CYS 776  29.710  -6.472  -5.226

  No H/Q in entry =           4
  In of MODEL   16
    1    HA   PRO 777           HA       PRO 777  33.794  -8.391  -3.458
    2    HB2  PRO 777           HB2      PRO 777  33.292 -10.149  -5.737
    3    HB3  PRO 777           HB3      PRO 777  33.885 -10.582  -4.133
    4    HG2  PRO 777           HG2      PRO 777  31.427 -11.305  -5.026
    5    HG3  PRO 777           HG3      PRO 777  31.778 -10.995  -3.318
    6    HD2  PRO 777           HD2      PRO 777  30.460  -9.219  -5.331
    7    HD3  PRO 777           HD3      PRO 777  30.052  -9.506  -3.622

  No H/Q in entry =           7
  In of MODEL   16
    1    H    LEU 778           H        LEU 778  35.371  -8.322  -5.396
    2    HA   LEU 778           HA       LEU 778  34.974  -5.879  -6.707
    3    HB2  LEU 778           HB2      LEU 778  37.100  -6.414  -7.847
    4    HB3  LEU 778           HB3      LEU 778  37.153  -6.556  -6.100
    5    HG   LEU 778           HG       LEU 778  36.535  -9.080  -6.800
    6   HD12  LEU 778          HD11      LEU 778  37.981  -9.775  -8.578
    7   HD11  LEU 778          HD12      LEU 778  38.284  -8.069  -8.989
    8   HD13  LEU 778          HD13      LEU 778  36.649  -8.748  -9.109
    9   HD23  LEU 778          HD21      LEU 778  38.847  -9.631  -6.391
   10   HD22  LEU 778          HD22      LEU 778  38.221  -8.461  -5.238
   11   HD21  LEU 778          HD23      LEU 778  39.291  -7.930  -6.548

  No H/Q in entry =          11
  In of MODEL   16
    1    H    TRP 779           H        TRP 779  34.023  -9.019  -7.711
    2    HA   TRP 779           HA       TRP 779  33.628  -8.172 -10.476
    3    HB2  TRP 779           HB2      TRP 779  32.790 -10.584 -10.779
    4    HB3  TRP 779           HB3      TRP 779  34.496 -10.385 -10.417
    5    HD1  TRP 779           HD1      TRP 779  31.256 -11.773  -8.889
    6    HE1  TRP 779           HE1      TRP 779  31.889 -13.181  -6.818
    7    HE3  TRP 779           HE3      TRP 779  36.175 -10.667  -8.646
    8    HZ2  TRP 779           HZ2      TRP 779  34.255 -13.703  -5.276
    9    HZ3  TRP 779           HZ3      TRP 779  37.555 -11.627  -6.867
   10    HH2  TRP 779           HH2      TRP 779  36.612 -13.118  -5.226

  No H/Q in entry =          10
  In of MODEL   16
    1    H    GLY 780           H        GLY 780  32.075  -7.668  -7.736
    2    HA3  GLY 780           HA2      GLY 780  29.404  -8.034  -8.883
    3    HA2  GLY 780           HA3      GLY 780  29.761  -8.107  -7.158

  No H/Q in entry =           3
  In of MODEL   16
    1    H    LYS 781           H        LYS 781  28.093  -6.296  -8.879
    2    HA   LYS 781           HA       LYS 781  28.763  -3.828  -7.547
    3    HB2  LYS 781           HB2      LYS 781  30.290  -3.850  -9.530
    4    HB3  LYS 781           HB3      LYS 781  28.878  -4.011 -10.560
    5    HG2  LYS 781           HG2      LYS 781  29.634  -1.738 -10.524
    6    HG3  LYS 781           HG3      LYS 781  28.051  -1.866  -9.747
    7    HD2  LYS 781           HD2      LYS 781  29.197  -1.917  -7.557
    8    HD3  LYS 781           HD3      LYS 781  30.730  -1.653  -8.390
    9    HE2  LYS 781           HE2      LYS 781  29.863   0.366  -7.504
   10    HE3  LYS 781           HE3      LYS 781  29.871   0.435  -9.279
   11    HZ2  LYS 781           HZ1      LYS 781  27.538  -0.001  -7.486
   12    HZ1  LYS 781           HZ2      LYS 781  27.425  -0.146  -9.142
   13    HZ3  LYS 781           HZ3      LYS 781  27.786   1.341  -8.458

  No H/Q in entry =          13
  In of MODEL   16
    1    H    CYS 782           H        CYS 782  26.872  -2.742  -7.259
    2    HA   CYS 782           HA       CYS 782  24.486  -3.767  -8.478
    3    HB2  CYS 782           HB2      CYS 782  24.926  -1.354  -6.677
    4    HB3  CYS 782           HB3      CYS 782  23.365  -2.070  -7.070

  No H/Q in entry =           4
  In of MODEL   16
    1    H    ASP 783           H        ASP 783  23.385  -2.786 -10.176
    2    HA   ASP 783           HA       ASP 783  24.904  -1.226 -11.962
    3    HB2  ASP 783           HB2      ASP 783  21.943  -1.861 -11.972
    4    HB3  ASP 783           HB3      ASP 783  22.700  -0.883 -13.216

  No H/Q in entry =           4
  In of MODEL   16
    1    H    ALA 784           H        ALA 784  21.914  -0.264 -10.393
    2    HA   ALA 784           HA       ALA 784  23.065   2.412 -10.109
    3    HB3  ALA 784           HB1      ALA 784  21.661   2.442 -12.124
    4    HB2  ALA 784           HB2      ALA 784  20.972   3.447 -10.851
    5    HB1  ALA 784           HB3      ALA 784  20.294   1.854 -11.182

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLU 785           H        GLU 785  20.218   0.443  -9.386
    2    HA   GLU 785           HA       GLU 785  19.626   1.877  -7.009
    3    HB2  GLU 785           HB2      GLU 785  18.578  -0.733  -8.060
    4    HB3  GLU 785           HB3      GLU 785  17.961   0.099  -6.646
    5    HG2  GLU 785           HG2      GLU 785  17.347   2.002  -8.072
    6    HG3  GLU 785           HG3      GLU 785  17.905   1.089  -9.480

  No H/Q in entry =           6
  In of MODEL   16
    1    H    SER 786           H        SER 786  20.307   1.506  -5.058
    2    HA   SER 786           HA       SER 786  22.117  -0.649  -4.585
    3    HB2  SER 786           HB2      SER 786  21.112   1.535  -2.748
    4    HB3  SER 786           HB3      SER 786  22.494   0.471  -2.466
    5    HG   SER 786           HG       SER 786  23.455   1.341  -4.330

  No H/Q in entry =           5
  In of MODEL   16
    1    H    SER 787           H        SER 787  20.732  -2.399  -4.772
    2    HA   SER 787           HA       SER 787  19.248  -2.996  -2.349
    3    HB2  SER 787           HB2      SER 787  17.553  -2.033  -3.915
    4    HB3  SER 787           HB3      SER 787  17.975  -3.267  -5.101
    5    HG   SER 787           HG       SER 787  16.367  -3.408  -2.902

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LYS 788           H        LYS 788  19.731  -4.394  -5.624
    2    HA   LYS 788           HA       LYS 788  20.800  -6.780  -4.293
    3    HB2  LYS 788           HB2      LYS 788  18.746  -7.212  -5.557
    4    HB3  LYS 788           HB3      LYS 788  19.481  -6.524  -7.006
    5    HG2  LYS 788           HG2      LYS 788  21.185  -8.332  -6.927
    6    HG3  LYS 788           HG3      LYS 788  20.337  -9.020  -5.550
    7    HD2  LYS 788           HD2      LYS 788  19.729 -10.194  -7.550
    8    HD3  LYS 788           HD3      LYS 788  18.334  -9.296  -6.957
    9    HE2  LYS 788           HE2      LYS 788  18.744  -7.554  -8.640
   10    HE3  LYS 788           HE3      LYS 788  20.166  -8.430  -9.204
   11    HZ2  LYS 788           HZ1      LYS 788  17.363  -9.391  -9.322
   12    HZ1  LYS 788           HZ2      LYS 788  18.699 -10.278  -9.805
   13    HZ3  LYS 788           HZ3      LYS 788  18.292  -8.868 -10.627

  No H/Q in entry =          13
  In of MODEL   16
    1    H    CYS 789           H        CYS 789  22.724  -7.650  -5.101
    2    HA   CYS 789           HA       CYS 789  24.306  -5.778  -6.686
    3    HB2  CYS 789           HB2      CYS 789  25.056  -6.455  -4.381
    4    HB3  CYS 789           HB3      CYS 789  25.160  -8.106  -4.954

  No H/Q in entry =           4
  In of MODEL   16
    1    H    VAL 790           H        VAL 790  25.246  -6.547  -8.616
    2    HA   VAL 790           HA       VAL 790  24.588  -9.303  -9.299
    3    HB   VAL 790           HB       VAL 790  23.039  -7.639 -10.400
    4   HG11  VAL 790          HG11      VAL 790  24.543  -5.794 -10.683
    5   HG13  VAL 790          HG12      VAL 790  23.835  -6.253 -12.227
    6   HG12  VAL 790          HG13      VAL 790  25.495  -6.707 -11.852
    7   HG21  VAL 790          HG21      VAL 790  23.382  -9.816 -11.435
    8   HG23  VAL 790          HG22      VAL 790  24.790  -9.200 -12.302
    9   HG22  VAL 790          HG23      VAL 790  23.185  -8.572 -12.669

  No H/Q in entry =           9
  In of MODEL   16
    1    H    CYS 791           H        CYS 791  26.084 -10.137 -10.972
    2    HA   CYS 791           HA       CYS 791  28.683  -8.922 -10.536
    3    HB2  CYS 791           HB2      CYS 791  27.957 -11.742 -11.300
    4    HB3  CYS 791           HB3      CYS 791  29.604 -11.126 -11.193

  No H/Q in entry =           4
  In of MODEL   16
    1    H    ARG 792           H        ARG 792  30.010  -8.461 -12.031
    2    HA   ARG 792           HA       ARG 792  28.812  -7.749 -14.560
    3    HB2  ARG 792           HB2      ARG 792  31.174  -6.925 -13.003
    4    HB3  ARG 792           HB3      ARG 792  31.330  -6.837 -14.753
    5    HG2  ARG 792           HG2      ARG 792  30.610  -4.701 -13.819
    6    HG3  ARG 792           HG3      ARG 792  29.371  -5.398 -14.857
    7    HD2  ARG 792           HD2      ARG 792  28.123  -6.120 -12.923
    8    HD3  ARG 792           HD3      ARG 792  29.389  -5.504 -11.857
    9    HE   ARG 792           HE       ARG 792  28.894  -3.296 -12.617
   10   HH11  ARG 792          HH11      ARG 792  26.422  -5.698 -13.536
   11   HH12  ARG 792          HH12      ARG 792  25.227  -4.493 -13.750
   12   HH21  ARG 792          HH21      ARG 792  27.159  -1.719 -12.963
   13   HH22  ARG 792          HH22      ARG 792  25.639  -2.333 -13.493

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLU 793           H        GLU 793  30.511  -7.889 -16.428
    2    HA   GLU 793           HA       GLU 793  31.494 -10.635 -16.463
    3    HB2  GLU 793           HB2      GLU 793  30.816  -8.764 -18.735
    4    HB3  GLU 793           HB3      GLU 793  31.451 -10.393 -18.936
    5    HG2  GLU 793           HG2      GLU 793  29.451 -11.298 -17.840
    6    HG3  GLU 793           HG3      GLU 793  28.816  -9.664 -17.666

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ALA 794           H        ALA 794  33.532 -10.775 -17.960
    2    HA   ALA 794           HA       ALA 794  35.584  -9.575 -16.546
    3    HB2  ALA 794           HB1      ALA 794  35.793 -11.673 -17.746
    4    HB3  ALA 794           HB2      ALA 794  37.061 -10.543 -18.217
    5    HB1  ALA 794           HB3      ALA 794  35.682 -10.818 -19.284

  No H/Q in entry =           5
  In of MODEL   16
    1    H    SER 795           H        SER 795  33.942  -8.632 -19.447
    2    HA   SER 795           HA       SER 795  35.850  -6.864 -20.419
    3    HB2  SER 795           HB2      SER 795  32.897  -6.981 -20.993
    4    HB3  SER 795           HB3      SER 795  34.128  -6.219 -22.005
    5    HG   SER 795           HG       SER 795  35.124  -8.262 -22.177

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLU 796           H        GLU 796  33.814  -6.553 -17.739
    2    HA   GLU 796           HA       GLU 796  33.637  -3.618 -17.973
    3    HB2  GLU 796           HB2      GLU 796  31.556  -5.042 -17.590
    4    HB3  GLU 796           HB3      GLU 796  32.234  -5.439 -16.025
    5    HG2  GLU 796           HG2      GLU 796  30.602  -3.711 -15.758
    6    HG3  GLU 796           HG3      GLU 796  32.200  -3.038 -15.442

  No H/Q in entry =           6
  In of MODEL   16
    1    H    CYS 797           H        CYS 797  35.470  -6.050 -16.683
    2    HA   CYS 797           HA       CYS 797  35.773  -5.083 -14.024
    3    HB2  CYS 797           HB2      CYS 797  37.208  -7.242 -15.532
    4    HB3  CYS 797           HB3      CYS 797  37.450  -6.877 -13.828

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLU 798           H        GLU 798  36.947  -3.481 -13.448
    2    HA   GLU 798           HA       GLU 798  39.589  -3.124 -14.548
    3    HB2  GLU 798           HB2      GLU 798  37.471  -0.999 -14.279
    4    HB3  GLU 798           HB3      GLU 798  39.177  -0.595 -14.204
    5    HG2  GLU 798           HG2      GLU 798  37.825  -1.968 -16.517
    6    HG3  GLU 798           HG3      GLU 798  38.218  -0.247 -16.436

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU 799           H        GLU 799  40.192  -4.209 -12.812
    2    HA   GLU 799           HA       GLU 799  40.437  -2.699 -10.330
    3    HB2  GLU 799           HB2      GLU 799  38.479  -4.204 -10.050
    4    HB3  GLU 799           HB3      GLU 799  39.430  -5.567 -10.592
    5    HG2  GLU 799           HG2      GLU 799  39.031  -5.556  -8.166
    6    HG3  GLU 799           HG3      GLU 799  40.740  -5.504  -8.577

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLU 800           H        GLU 800  42.189  -4.128  -8.954
    2    HA   GLU 800           HA       GLU 800  44.571  -4.189 -10.305
    3    HB2  GLU 800           HB2      GLU 800  43.774  -5.816  -7.897
    4    HB3  GLU 800           HB3      GLU 800  45.427  -5.742  -8.497
    5    HG2  GLU 800           HG2      GLU 800  43.789  -3.394  -7.555
    6    HG3  GLU 800           HG3      GLU 800  45.074  -4.195  -6.640

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLY 801           H        GLY 801  42.870  -7.236  -9.492
    2    HA3  GLY 801           HA2      GLY 801  42.375  -8.976 -10.832
    3    HA2  GLY 801           HA3      GLY 801  42.858  -8.002 -12.206

  No H/Q in entry =           3
  In of MODEL   16
    1    H    PHE 802           H        PHE 802  43.838 -10.285  -9.783
    2    HA   PHE 802           HA       PHE 802  46.373 -10.801 -10.999
    3    HB2  PHE 802           HB2      PHE 802  44.703 -12.209  -8.941
    4    HB3  PHE 802           HB3      PHE 802  46.146 -12.958  -9.611
    5    HD1  PHE 802           HD1      PHE 802  45.618  -9.353  -8.727
    6    HD2  PHE 802           HD2      PHE 802  47.588 -13.016  -7.821
    7    HE1  PHE 802           HE1      PHE 802  46.958  -8.219  -7.075
    8    HE2  PHE 802           HE2      PHE 802  48.924 -11.909  -6.198
    9    HZ   PHE 802           HZ       PHE 802  48.644  -9.474  -5.776

  No H/Q in entry =           9
  In of MODEL   16
    1    H    SER 803           H        SER 803  46.769 -13.153 -11.706
    2    HA   SER 803           HA       SER 803  44.528 -14.000 -13.377
    3    HB2  SER 803           HB2      SER 803  47.479 -14.164 -13.997
    4    HB3  SER 803           HB3      SER 803  46.178 -14.890 -14.963
    5    HG   SER 803           HG       SER 803  45.786 -13.033 -15.799

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ILE 804           H        ILE 804  43.962 -16.059 -13.320
    2    HA   ILE 804           HA       ILE 804  45.489 -17.853 -11.608
    3    HB   ILE 804           HB       ILE 804  43.517 -18.675 -10.458
    4   HG12  ILE 804          HG12      ILE 804  41.763 -18.286 -12.214
    5   HG13  ILE 804          HG13      ILE 804  41.286 -17.708 -10.623
    6   HG23  ILE 804          HG21      ILE 804  42.921 -16.751  -9.069
    7   HG22  ILE 804          HG22      ILE 804  43.659 -15.690 -10.272
    8   HG21  ILE 804          HG23      ILE 804  44.655 -16.856  -9.400
    9   HD12  ILE 804          HD11      ILE 804  42.207 -16.010 -12.927
   10   HD11  ILE 804          HD12      ILE 804  41.810 -15.423 -11.316
   11   HD13  ILE 804          HD13      ILE 804  40.565 -16.174 -12.312

  No H/Q in entry =          11
  In of MODEL   16
    1    H    CYS 805           H        CYS 805  44.436 -20.139 -11.810
    2    HA   CYS 805           HA       CYS 805  43.938 -20.570 -14.685
    3    HB2  CYS 805           HB2      CYS 805  46.171 -21.343 -13.904
    4    HB3  CYS 805           HB3      CYS 805  45.364 -22.380 -12.732

  No H/Q in entry =           4
  In of MODEL   16
    1    H    VAL 806           H        VAL 806  42.200 -21.601 -15.175
    2    HA   VAL 806           HA       VAL 806  40.740 -22.922 -13.031
    3    HB   VAL 806           HB       VAL 806  39.947 -20.652 -13.148
    4   HG13  VAL 806          HG11      VAL 806  40.673 -20.051 -15.302
    5   HG12  VAL 806          HG12      VAL 806  38.942 -19.721 -15.155
    6   HG11  VAL 806          HG13      VAL 806  39.508 -21.142 -16.045
    7   HG23  VAL 806          HG21      VAL 806  37.985 -22.481 -14.491
    8   HG22  VAL 806          HG22      VAL 806  37.594 -20.968 -13.656
    9   HG21  VAL 806          HG23      VAL 806  38.248 -22.333 -12.756

  No H/Q in entry =           9
  In of MODEL   16
    1    H    GLU 807           H        GLU 807  39.799 -24.796 -13.587
    2    HA   GLU 807           HA       GLU 807  40.216 -25.832 -16.245
    3    HB2  GLU 807           HB2      GLU 807  40.676 -27.191 -14.211
    4    HB3  GLU 807           HB3      GLU 807  38.970 -27.100 -13.801
    5    HG2  GLU 807           HG2      GLU 807  38.425 -28.250 -15.893
    6    HG3  GLU 807           HG3      GLU 807  40.152 -28.383 -16.242

  No H/Q in entry =           6
  In of MODEL   16
    1    H    VAL 808           H        VAL 808  38.837 -25.414 -17.701
    2    HA   VAL 808           HA       VAL 808  35.954 -25.406 -17.128
    3    HB   VAL 808           HB       VAL 808  37.358 -23.596 -19.031
    4   HG12  VAL 808          HG11      VAL 808  34.549 -23.531 -18.033
    5   HG11  VAL 808          HG12      VAL 808  35.133 -24.012 -19.631
    6   HG13  VAL 808          HG13      VAL 808  35.295 -22.331 -19.105
    7   HG22  VAL 808          HG21      VAL 808  38.139 -22.895 -16.930
    8   HG21  VAL 808          HG22      VAL 808  36.519 -22.979 -16.258
    9   HG23  VAL 808          HG23      VAL 808  36.914 -21.728 -17.452

  No H/Q in entry =           9
  In of MODEL   16
    1    H    ASN 809           H        ASN 809  34.933 -26.697 -18.612
    2    HA   ASN 809           HA       ASN 809  34.542 -27.996 -20.432
    3    HB2  ASN 809           HB2      ASN 809  36.683 -26.258 -21.639
    4    HB3  ASN 809           HB3      ASN 809  35.934 -27.532 -22.555
    5   HD21  ASN 809          HD21      ASN 809  35.732 -24.355 -21.413
    6   HD22  ASN 809          HD22      ASN 809  34.189 -23.918 -22.026

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLY 810           H        GLY 810  36.730 -28.447 -18.404
    2    HA3  GLY 810           HA2      GLY 810  37.884 -30.451 -17.972
    3    HA2  GLY 810           HA3      GLY 810  37.846 -30.793 -19.701

  No H/Q in entry =           3
  In of MODEL   16
    1    H    LYS 811           H        LYS 811  38.766 -27.767 -19.815
    2    HA   LYS 811           HA       LYS 811  41.615 -28.482 -19.656
    3    HB2  LYS 811           HB2      LYS 811  40.222 -26.491 -21.434
    4    HB3  LYS 811           HB3      LYS 811  41.960 -26.757 -21.363
    5    HG2  LYS 811           HG2      LYS 811  41.665 -29.037 -22.159
    6    HG3  LYS 811           HG3      LYS 811  39.917 -28.811 -22.184
    7    HD2  LYS 811           HD2      LYS 811  40.868 -28.566 -24.411
    8    HD3  LYS 811           HD3      LYS 811  40.149 -27.056 -23.847
    9    HE2  LYS 811           HE2      LYS 811  42.364 -26.204 -23.243
   10    HE3  LYS 811           HE3      LYS 811  43.103 -27.721 -23.739
   11    HZ3  LYS 811           HZ1      LYS 811  43.359 -26.056 -25.416
   12    HZ2  LYS 811           HZ2      LYS 811  41.700 -25.780 -25.512
   13    HZ1  LYS 811           HZ3      LYS 811  42.337 -27.250 -26.009

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLU 812           H        GLU 812  43.017 -27.047 -18.730
    2    HA   GLU 812           HA       GLU 812  41.824 -25.046 -16.961
    3    HB2  GLU 812           HB2      GLU 812  44.627 -26.080 -17.200
    4    HB3  GLU 812           HB3      GLU 812  44.084 -24.919 -15.999
    5    HG2  GLU 812           HG2      GLU 812  42.621 -26.612 -15.040
    6    HG3  GLU 812           HG3      GLU 812  43.152 -27.766 -16.266

  No H/Q in entry =           6
  In of MODEL   16
    1    H    GLN 813           H        GLN 813  41.491 -23.176 -17.798
    2    HA   GLN 813           HA       GLN 813  43.477 -22.028 -19.631
    3    HB2  GLN 813           HB2      GLN 813  41.260 -22.162 -20.631
    4    HB3  GLN 813           HB3      GLN 813  40.534 -21.399 -19.223
    5    HG2  GLN 813           HG2      GLN 813  41.679 -19.342 -19.717
    6    HG3  GLN 813           HG3      GLN 813  42.477 -20.067 -21.112
    7   HE21  GLN 813          HE21      GLN 813  39.128 -20.687 -20.284
    8   HE22  GLN 813          HE22      GLN 813  38.446 -19.801 -21.590

  No H/Q in entry =           8
  In of MODEL   16
    1    H    THR 814           H        THR 814  44.228 -19.922 -19.185
    2    HA   THR 814           HA       THR 814  44.176 -19.141 -16.405
    3    HB   THR 814           HB       THR 814  45.432 -17.738 -18.767
    4    HG1  THR 814           HG1      THR 814  47.140 -18.888 -18.529
    5   HG22  THR 814          HG21      THR 814  46.084 -17.674 -15.818
    6   HG21  THR 814          HG22      THR 814  45.258 -16.405 -16.720
    7   HG23  THR 814          HG23      THR 814  46.940 -16.793 -17.088

  No H/Q in entry =           7
  In of MODEL   16
    1    H    MET 815           H        MET 815  42.878 -17.583 -15.640
    2    HA   MET 815           HA       MET 815  41.713 -15.722 -17.582
    3    HB2  MET 815           HB2      MET 815  40.239 -16.776 -15.171
    4    HB3  MET 815           HB3      MET 815  39.624 -15.629 -16.354
    5    HG2  MET 815           HG2      MET 815  40.064 -17.555 -18.052
    6    HG3  MET 815           HG3      MET 815  40.181 -18.481 -16.559
    7    HE3  MET 815           HE1      MET 815  38.240 -19.078 -18.946
    8    HE2  MET 815           HE2      MET 815  36.889 -19.708 -17.976
    9    HE1  MET 815           HE3      MET 815  38.576 -20.032 -17.516

  No H/Q in entry =           9
  In of MODEL   16
    1    H    SER 816           H        SER 816  40.921 -13.810 -16.538
    2    HA   SER 816           HA       SER 816  42.824 -12.856 -14.588
    3    HB2  SER 816           HB2      SER 816  40.437 -11.454 -15.837
    4    HB3  SER 816           HB3      SER 816  41.761 -10.691 -14.949
    5    HG   SER 816           HG       SER 816  42.368 -12.302 -17.131

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLU 817           H        GLU 817  42.172 -12.041 -12.631
    2    HA   GLU 817           HA       GLU 817  40.799 -13.540 -10.882
    3    HB2  GLU 817           HB2      GLU 817  42.382 -11.688 -10.558
    4    HB3  GLU 817           HB3      GLU 817  41.066 -10.597 -10.930
    5    HG2  GLU 817           HG2      GLU 817  39.887 -11.370  -8.952
    6    HG3  GLU 817           HG3      GLU 817  41.245 -12.422  -8.571

  No H/Q in entry =           6
  In of MODEL   16
    1    H    CYS 818           H        CYS 818  39.532 -10.399 -12.037
    2    HA   CYS 818           HA       CYS 818  36.969 -10.788 -10.965
    3    HB2  CYS 818           HB2      CYS 818  37.927  -8.560 -11.517
    4    HB3  CYS 818           HB3      CYS 818  37.775  -8.957 -13.226

  No H/Q in entry =           4
  In of MODEL   16
    1    H    GLU 819           H        GLU 819  38.416 -11.727 -13.931
    2    HA   GLU 819           HA       GLU 819  36.086 -12.193 -15.456
    3    HB2  GLU 819           HB2      GLU 819  38.215 -11.946 -16.528
    4    HB3  GLU 819           HB3      GLU 819  38.885 -13.285 -15.616
    5    HG2  GLU 819           HG2      GLU 819  37.561 -14.848 -16.847
    6    HG3  GLU 819           HG3      GLU 819  36.699 -13.547 -17.663

  No H/Q in entry =           6
  In of MODEL   16
    1    H    ALA 820           H        ALA 820  38.282 -14.619 -13.969
    2    HA   ALA 820           HA       ALA 820  36.625 -16.763 -14.269
    3    HB2  ALA 820           HB1      ALA 820  37.921 -17.868 -12.504
    4    HB3  ALA 820           HB2      ALA 820  38.555 -16.302 -12.011
    5    HB1  ALA 820           HB3      ALA 820  38.958 -16.955 -13.605

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLY 821           H        GLY 821  36.806 -14.384 -11.675
    2    HA3  GLY 821           HA2      GLY 821  35.022 -15.559  -9.824
    3    HA2  GLY 821           HA3      GLY 821  35.461 -13.858  -9.898

  No H/Q in entry =           3
  In of MODEL   16
    1    H    ALA 822           H        ALA 822  34.519 -13.180 -12.450
    2    HA   ALA 822           HA       ALA 822  31.806 -12.763 -11.950
    3    HB2  ALA 822           HB1      ALA 822  33.204 -11.286 -13.321
    4    HB3  ALA 822           HB2      ALA 822  31.733 -11.779 -14.140
    5    HB1  ALA 822           HB3      ALA 822  33.279 -12.531 -14.574

  No H/Q in entry =           5
  In of MODEL   16
    1    H    LEU 823           H        LEU 823  33.516 -15.031 -14.075
    2    HA   LEU 823           HA       LEU 823  31.196 -16.178 -15.124
    3    HB2  LEU 823           HB2      LEU 823  33.972 -17.311 -14.839
    4    HB3  LEU 823           HB3      LEU 823  32.665 -18.316 -15.410
    5    HG   LEU 823           HG       LEU 823  33.802 -17.654 -17.326
    6   HD11  LEU 823          HD11      LEU 823  31.420 -17.476 -17.586
    7   HD13  LEU 823          HD12      LEU 823  32.285 -16.345 -18.623
    8   HD12  LEU 823          HD13      LEU 823  31.493 -15.761 -17.166
    9   HD21  LEU 823          HD21      LEU 823  33.758 -14.802 -16.375
   10   HD23  LEU 823          HD22      LEU 823  34.363 -15.355 -17.935
   11   HD22  LEU 823          HD23      LEU 823  35.166 -15.859 -16.451

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ARG 824           H        ARG 824  33.011 -17.047 -12.200
    2    HA   ARG 824           HA       ARG 824  31.379 -19.219 -11.426
    3    HB2  ARG 824           HB2      ARG 824  33.243 -17.446  -9.947
    4    HB3  ARG 824           HB3      ARG 824  32.065 -18.324  -8.998
    5    HG2  ARG 824           HG2      ARG 824  34.199 -19.482 -10.783
    6    HG3  ARG 824           HG3      ARG 824  34.115 -19.541  -9.028
    7    HD2  ARG 824           HD2      ARG 824  32.363 -21.001 -11.017
    8    HD3  ARG 824           HD3      ARG 824  33.410 -21.677  -9.782
    9    HE   ARG 824           HE       ARG 824  31.140 -20.063  -8.917
   10   HH11  ARG 824          HH11      ARG 824  32.561 -23.306  -9.246
   11   HH12  ARG 824          HH12      ARG 824  31.371 -24.054  -8.301
   12   HH21  ARG 824          HH21      ARG 824  29.450 -21.158  -7.643
   13   HH22  ARG 824          HH22      ARG 824  29.597 -22.819  -7.375

  No H/Q in entry =          13
  In of MODEL   16
    1    H    CYS 825           H        CYS 825  31.077 -15.799 -10.772
    2    HA   CYS 825           HA       CYS 825  28.936 -16.091  -8.962
    3    HB2  CYS 825           HB2      CYS 825  30.344 -14.020  -9.085
    4    HB3  CYS 825           HB3      CYS 825  29.609 -13.686 -10.641

  No H/Q in entry =           4
  In of MODEL   16
    1    H    ARG 826           H        ARG 826  29.068 -15.532 -12.456
    2    HA   ARG 826           HA       ARG 826  26.301 -15.004 -12.645
    3    HB2  ARG 826           HB2      ARG 826  26.547 -15.054 -15.020
    4    HB3  ARG 826           HB3      ARG 826  27.922 -14.207 -14.312
    5    HG2  ARG 826           HG2      ARG 826  29.267 -16.186 -14.640
    6    HG3  ARG 826           HG3      ARG 826  27.890 -17.011 -15.376
    7    HD2  ARG 826           HD2      ARG 826  29.334 -14.560 -16.391
    8    HD3  ARG 826           HD3      ARG 826  29.240 -16.149 -17.155
    9    HE   ARG 826           HE       ARG 826  26.670 -15.391 -16.907
   10   HH11  ARG 826          HH11      ARG 826  29.500 -14.127 -18.618
   11   HH12  ARG 826          HH12      ARG 826  28.624 -13.022 -19.576
   12   HH21  ARG 826          HH21      ARG 826  25.436 -13.876 -18.274
   13   HH22  ARG 826          HH22      ARG 826  26.254 -12.954 -19.448

  No H/Q in entry =          13
  In of MODEL   16
    1    H    GLY 827           H        GLY 827  28.127 -17.991 -12.795
    2    HA3  GLY 827           HA2      GLY 827  26.561 -19.880 -12.146
    3    HA2  GLY 827           HA3      GLY 827  25.593 -19.254 -13.486

  No H/Q in entry =           3
  In of MODEL   16
    1    H    GLN 828           H        GLN 828  28.496 -18.764 -14.598
    2    HA   GLN 828           HA       GLN 828  28.411 -20.944 -16.419
    3    HB2  GLN 828           HB2      GLN 828  29.401 -18.766 -17.009
    4    HB3  GLN 828           HB3      GLN 828  30.678 -19.019 -15.837
    5    HG2  GLN 828           HG2      GLN 828  31.518 -19.471 -18.058
    6    HG3  GLN 828           HG3      GLN 828  31.452 -20.963 -17.129
    7   HE21  GLN 828          HE21      GLN 828  28.598 -19.462 -18.593
    8   HE22  GLN 828          HE22      GLN 828  28.382 -20.686 -19.773

  No H/Q in entry =           8
  In of MODEL   16
    1    H    SER 829           H        SER 829  29.740 -22.826 -16.558
    2    HA   SER 829           HA       SER 829  30.723 -23.690 -13.977
    3    HB2  SER 829           HB2      SER 829  30.444 -25.227 -16.567
    4    HB3  SER 829           HB3      SER 829  30.722 -25.909 -14.960
    5    HG   SER 829           HG       SER 829  28.581 -24.201 -15.183

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ILE 830           H        ILE 830  32.667 -23.076 -13.523
    2    HA   ILE 830           HA       ILE 830  34.971 -23.783 -15.196
    3    HB   ILE 830           HB       ILE 830  36.067 -21.640 -14.910
    4   HG12  ILE 830          HG12      ILE 830  35.114 -21.042 -12.654
    5   HG13  ILE 830          HG13      ILE 830  35.225 -19.701 -13.771
    6   HG23  ILE 830          HG21      ILE 830  34.698 -21.694 -16.832
    7   HG22  ILE 830          HG22      ILE 830  34.670 -20.051 -16.168
    8   HG21  ILE 830          HG23      ILE 830  33.301 -21.146 -15.912
    9   HD11  ILE 830          HD11      ILE 830  32.834 -19.970 -14.281
   10   HD13  ILE 830          HD12      ILE 830  33.154 -19.585 -12.597
   11   HD12  ILE 830          HD13      ILE 830  32.750 -21.242 -13.067

  No H/Q in entry =          11
  In of MODEL   16
    1    H    SER 831           H        SER 831  36.462 -24.650 -13.868
    2    HA   SER 831           HA       SER 831  35.923 -24.437 -11.009
    3    HB2  SER 831           HB2      SER 831  36.962 -26.685 -12.675
    4    HB3  SER 831           HB3      SER 831  37.056 -26.691 -10.924
    5    HG   SER 831           HG       SER 831  34.759 -26.429 -10.908

  No H/Q in entry =           5
  In of MODEL   16
    1    H    VAL 832           H        VAL 832  37.307 -22.983 -10.234
    2    HA   VAL 832           HA       VAL 832  39.888 -22.485 -11.282
    3    HB   VAL 832           HB       VAL 832  38.790 -21.808  -8.548
    4   HG12  VAL 832          HG11      VAL 832  41.155 -20.624 -10.025
    5   HG11  VAL 832          HG12      VAL 832  41.240 -21.650  -8.596
    6   HG13  VAL 832          HG13      VAL 832  40.521 -20.042  -8.484
    7   HG23  VAL 832          HG21      VAL 832  38.854 -20.158 -11.070
    8   HG22  VAL 832          HG22      VAL 832  38.325 -19.579  -9.488
    9   HG21  VAL 832          HG23      VAL 832  37.422 -20.852 -10.309

  No H/Q in entry =           9
  In of MODEL   16
    1    H    THR 833           H        THR 833  41.604 -23.748 -11.161
    2    HA   THR 833           HA       THR 833  41.692 -25.805  -9.128
    3    HB   THR 833           HB       THR 833  43.555 -26.672 -10.602
    4    HG1  THR 833           HG1      THR 833  43.692 -25.751 -12.710
    5   HG22  THR 833          HG21      THR 833  40.832 -26.317 -11.880
    6   HG21  THR 833          HG22      THR 833  41.273 -27.584 -10.735
    7   HG23  THR 833          HG23      THR 833  42.018 -27.540 -12.334

  No H/Q in entry =           7
  In of MODEL   16
    1    H    SER 834           H        SER 834  43.461 -23.023 -10.354
    2    HA   SER 834           HA       SER 834  45.183 -23.147  -8.004
    3    HB2  SER 834           HB2      SER 834  46.233 -22.812 -10.805
    4    HB3  SER 834           HB3      SER 834  47.183 -22.767  -9.323
    5    HG   SER 834           HG       SER 834  45.677 -24.963 -10.254

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ILE 835           H        ILE 835  45.876 -21.207  -7.300
    2    HA   ILE 835           HA       ILE 835  44.558 -18.856  -8.340
    3    HB   ILE 835           HB       ILE 835  45.618 -17.734  -6.364
    4   HG12  ILE 835          HG12      ILE 835  46.300 -19.312  -4.486
    5   HG13  ILE 835          HG13      ILE 835  46.481 -20.561  -5.711
    6   HG23  ILE 835          HG21      ILE 835  44.097 -18.697  -4.798
    7   HG22  ILE 835          HG22      ILE 835  43.885 -20.089  -5.874
    8   HG21  ILE 835          HG23      ILE 835  43.357 -18.481  -6.391
    9   HD12  ILE 835          HD11      ILE 835  47.984 -17.996  -5.502
   10   HD11  ILE 835          HD12      ILE 835  48.210 -19.215  -6.771
   11   HD13  ILE 835          HD13      ILE 835  48.590 -19.599  -5.078

  No H/Q in entry =          11
  In of MODEL   16
    1    H    ARG 836           H        ARG 836  47.138 -20.363  -9.342
    2    HA   ARG 836           HA       ARG 836  48.479 -17.881 -10.003
    3    HB2  ARG 836           HB2      ARG 836  50.567 -19.239 -10.407
    4    HB3  ARG 836           HB3      ARG 836  50.031 -19.249  -8.744
    5    HG2  ARG 836           HG2      ARG 836  50.750 -21.427  -9.190
    6    HG3  ARG 836           HG3      ARG 836  48.989 -21.503  -9.245
    7    HD2  ARG 836           HD2      ARG 836  49.074 -21.396 -11.693
    8    HD3  ARG 836           HD3      ARG 836  50.832 -21.331 -11.630
    9    HE   ARG 836           HE       ARG 836  50.236 -23.561 -10.260
   10   HH11  ARG 836          HH11      ARG 836  49.419 -22.399 -13.516
   11   HH12  ARG 836          HH12      ARG 836  49.291 -23.964 -14.187
   12   HH21  ARG 836          HH21      ARG 836  50.079 -25.735 -11.245
   13   HH22  ARG 836          HH22      ARG 836  49.671 -25.852 -12.887

  No H/Q in entry =          13
  In of MODEL   16
    1    HA   PRO 837           HA       PRO 837  47.134 -18.488 -14.077
    2    HB2  PRO 837           HB2      PRO 837  49.651 -17.686 -15.302
    3    HB3  PRO 837           HB3      PRO 837  48.135 -16.794 -15.211
    4    HG2  PRO 837           HG2      PRO 837  50.361 -16.051 -13.840
    5    HG3  PRO 837           HG3      PRO 837  48.715 -15.737 -13.262
    6    HD2  PRO 837           HD2      PRO 837  50.631 -17.877 -12.452
    7    HD3  PRO 837           HD3      PRO 837  49.537 -16.903 -11.448

  No H/Q in entry =           7
  In of MODEL   16
    1    H    CYS 838           H        CYS 838  47.335 -19.744 -16.045
    2    HA   CYS 838           HA       CYS 838  49.263 -21.849 -15.766
    3    HB2  CYS 838           HB2      CYS 838  46.527 -21.787 -16.928
    4    HB3  CYS 838           HB3      CYS 838  47.692 -22.886 -17.661

  No H/Q in entry =           4
  In of MODEL   16
    1    H    ALA 839           H        ALA 839  49.871 -22.762 -18.069
    2    HA   ALA 839           HA       ALA 839  50.801 -20.523 -19.697
    3    HB3  ALA 839           HB1      ALA 839  52.240 -22.230 -20.739
    4    HB1  ALA 839           HB2      ALA 839  51.451 -23.475 -19.770
    5    HB2  ALA 839           HB3      ALA 839  52.415 -22.228 -18.983

  No H/Q in entry =           5
  In of MODEL   16
    1    H    ALA 840           H        ALA 840  48.068 -21.133 -19.720
    2    HA   ALA 840           HA       ALA 840  47.519 -22.680 -22.136
    3    HB3  ALA 840           HB1      ALA 840  46.109 -23.070 -20.176
    4    HB1  ALA 840           HB2      ALA 840  45.176 -22.441 -21.535
    5    HB2  ALA 840           HB3      ALA 840  45.621 -21.376 -20.202

  No H/Q in entry =           5
  In of MODEL   16
    1    H    GLU 841           H        GLU 841  46.284 -19.656 -20.878
    2    HA   GLU 841           HA       GLU 841  45.716 -17.768 -21.652
    3    HB2  GLU 841           HB2      GLU 841  47.715 -18.169 -23.881
    4    HB3  GLU 841           HB3      GLU 841  47.098 -16.641 -23.264
    5    HG2  GLU 841           HG2      GLU 841  48.986 -18.558 -21.927
    6    HG3  GLU 841           HG3      GLU 841  49.285 -16.891 -22.406

  No H/Q in entry =           6
  In of MODEL   16
    1    H    THR 842           H        THR 842  44.903 -16.683 -23.472
    2    HA   THR 842           HA       THR 842  43.116 -18.401 -24.938
    3    HB   THR 842           HB       THR 842  42.124 -16.401 -24.158
    4    HG1  THR 842           HG1      THR 842  41.231 -17.028 -26.040
    5   HG23  THR 842          HG21      THR 842  44.014 -14.887 -24.046
    6   HG22  THR 842          HG22      THR 842  42.723 -14.119 -24.972
    7   HG21  THR 842          HG23      THR 842  44.107 -14.831 -25.806

  No H/Q in entry =           7
  In of MODEL   16
    1    H    GLN 843           H        GLN 843  44.314 -19.557 -26.044
    2    HA   GLN 843           HA       GLN 843  45.941 -18.455 -28.246
    3    HB2  GLN 843           HB2      GLN 843  47.196 -19.370 -26.207
    4    HB3  GLN 843           HB3      GLN 843  46.540 -20.936 -26.633
    5    HG2  GLN 843           HG2      GLN 843  48.669 -20.997 -27.519
    6    HG3  GLN 843           HG3      GLN 843  47.685 -20.551 -28.907
    7   HE21  GLN 843          HE21      GLN 843  47.414 -17.725 -27.892
    8   HE22  GLN 843          HE22      GLN 843  48.925 -17.019 -28.253

  No H/Q in entry =           8
  In of MODEL   17
    1    H1   GLY 689           H2       GLY 689  48.034  15.987 -13.783
    2    H2   GLY 689           H1       GLY 689  48.176  14.564 -14.650
    3    H3   GLY 689           H3       GLY 689  47.614  15.976 -15.415
    4    HA2  GLY 689           HA2      GLY 689  45.817  14.403 -14.880
    5    HA3  GLY 689           HA3      GLY 689  45.649  15.935 -14.018

  No H/Q in entry =           5
  In of MODEL   17
    1    H    SER 690           H        SER 690  44.477  14.973 -12.328
    2    HA   SER 690           HA       SER 690  46.184  13.988 -10.279
    3    HB2  SER 690           HB2      SER 690  43.217  14.520 -10.288
    4    HB3  SER 690           HB3      SER 690  44.224  14.263  -8.859
    5    HG   SER 690           HG       SER 690  45.480  16.084  -9.647

  No H/Q in entry =           5
  In of MODEL   17
    1    H    HIS 691           H        HIS 691  46.809  11.970 -10.627
    2    HA   HIS 691           HA       HIS 691  44.792   9.887 -10.306
    3    HB2  HIS 691           HB2      HIS 691  47.062   9.904 -12.308
    4    HB3  HIS 691           HB3      HIS 691  46.399   8.398 -11.703
    5    HD1  HIS 691           HD1      HIS 691  44.435   7.485 -12.974
    6    HD2  HIS 691           HD2      HIS 691  45.106  11.513 -13.775
    7    HE1  HIS 691           HE1      HIS 691  42.849   8.079 -14.790
    8    HE2  HIS 691           HE2      HIS 691  43.445  10.423 -15.427

  No H/Q in entry =           8
  In of MODEL   17
    1    H    MET 692           H        MET 692  45.554   8.161  -9.026
    2    HA   MET 692           HA       MET 692  47.628   8.984  -7.234
    3    HB2  MET 692           HB2      MET 692  47.189   6.952  -5.961
    4    HB3  MET 692           HB3      MET 692  45.687   7.760  -6.351
    5    HG2  MET 692           HG2      MET 692  45.214   6.151  -8.073
    6    HG3  MET 692           HG3      MET 692  46.777   5.361  -7.820
    7    HE2  MET 692           HE1      MET 692  44.247   2.702  -6.464
    8    HE1  MET 692           HE2      MET 692  45.588   3.014  -7.570
    9    HE3  MET 692           HE3      MET 692  44.020   3.765  -7.851

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ASN 693           H        ASN 693  47.458   7.008 -10.035
    2    HA   ASN 693           HA       ASN 693  50.133   6.010  -9.530
    3    HB2  ASN 693           HB2      ASN 693  49.805   4.621 -11.569
    4    HB3  ASN 693           HB3      ASN 693  48.545   4.331 -10.384
    5   HD21  ASN 693          HD21      ASN 693  48.506   3.769 -13.237
    6   HD22  ASN 693          HD22      ASN 693  47.191   4.673 -13.880

  No H/Q in entry =           6
  In of MODEL   17
    1    HA   PRO 694           HA       PRO 694  51.520   9.424 -12.070
    2    HB2  PRO 694           HB2      PRO 694  54.148   9.131 -11.640
    3    HB3  PRO 694           HB3      PRO 694  53.078   9.739 -10.371
    4    HG2  PRO 694           HG2      PRO 694  54.235   7.002 -10.725
    5    HG3  PRO 694           HG3      PRO 694  54.014   7.939  -9.238
    6    HD2  PRO 694           HD2      PRO 694  52.323   5.927 -10.088
    7    HD3  PRO 694           HD3      PRO 694  51.858   7.233  -8.982

  No H/Q in entry =           7
  In of MODEL   17
    1    H    LEU 695           H        LEU 695  52.344   6.115 -12.331
    2    HA   LEU 695           HA       LEU 695  52.931   6.347 -15.162
    3    HB2  LEU 695           HB2      LEU 695  54.619   4.879 -13.127
    4    HB3  LEU 695           HB3      LEU 695  54.791   4.726 -14.856
    5    HG   LEU 695           HG       LEU 695  55.288   7.272 -13.309
    6   HD12  LEU 695          HD11      LEU 695  57.655   6.794 -13.706
    7   HD11  LEU 695          HD12      LEU 695  57.217   5.238 -14.421
    8   HD13  LEU 695          HD13      LEU 695  56.904   5.545 -12.714
    9   HD21  LEU 695          HD21      LEU 695  55.860   6.492 -16.164
   10   HD23  LEU 695          HD22      LEU 695  56.378   7.982 -15.382
   11   HD22  LEU 695          HD23      LEU 695  54.660   7.669 -15.626

  No H/Q in entry =          11
  In of MODEL   17
    1    H    THR 696           H        THR 696  52.100   4.524 -16.202
    2    HA   THR 696           HA       THR 696  50.801   2.554 -14.519
    3    HB   THR 696           HB       THR 696  49.619   3.259 -16.610
    4    HG1  THR 696           HG1      THR 696  50.397   0.624 -16.147
    5   HG23  THR 696          HG21      THR 696  51.570   3.676 -18.041
    6   HG22  THR 696          HG22      THR 696  50.468   2.532 -18.810
    7   HG21  THR 696          HG23      THR 696  51.944   1.954 -18.040

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLN 697           H        GLN 697  53.689   3.216 -15.961
    2    HA   GLN 697           HA       GLN 697  55.692   2.340 -16.040
    3    HB2  GLN 697           HB2      GLN 697  55.013   1.591 -13.675
    4    HB3  GLN 697           HB3      GLN 697  54.786  -0.005 -14.341
    5    HG2  GLN 697           HG2      GLN 697  56.944   0.029 -13.403
    6    HG3  GLN 697           HG3      GLN 697  57.189   0.160 -15.151
    7   HE21  GLN 697          HE21      GLN 697  57.954   2.117 -16.016
    8   HE22  GLN 697          HE22      GLN 697  58.560   3.375 -15.026

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ALA 698           H        ALA 698  54.624  -0.887 -15.730
    2    HA   ALA 698           HA       ALA 698  53.892  -1.785 -18.167
    3    HB2  ALA 698           HB1      ALA 698  56.002  -0.949 -19.145
    4    HB1  ALA 698           HB2      ALA 698  56.046  -2.711 -19.068
    5    HB3  ALA 698           HB3      ALA 698  56.924  -1.753 -17.877

  No H/Q in entry =           5
  In of MODEL   17
    1    H    VAL 699           H        VAL 699  54.534  -4.220 -18.229
    2    HA   VAL 699           HA       VAL 699  54.741  -5.153 -15.470
    3    HB   VAL 699           HB       VAL 699  54.185  -6.762 -17.996
    4   HG12  VAL 699          HG11      VAL 699  53.850  -7.512 -15.090
    5   HG11  VAL 699          HG12      VAL 699  55.108  -8.100 -16.171
    6   HG13  VAL 699          HG13      VAL 699  53.423  -8.524 -16.472
    7   HG22  VAL 699          HG21      VAL 699  51.833  -6.810 -17.280
    8   HG21  VAL 699          HG22      VAL 699  52.373  -5.164 -17.603
    9   HG23  VAL 699          HG23      VAL 699  52.220  -5.733 -15.940

  No H/Q in entry =           9
  In of MODEL   17
    1    HA   PRO 700           HA       PRO 700  59.005  -5.733 -16.790
    2    HB2  PRO 700           HB2      PRO 700  60.188  -5.527 -14.395
    3    HB3  PRO 700           HB3      PRO 700  59.445  -4.135 -15.164
    4    HG2  PRO 700           HG2      PRO 700  58.373  -5.811 -12.941
    5    HG3  PRO 700           HG3      PRO 700  58.273  -4.058 -13.177
    6    HD2  PRO 700           HD2      PRO 700  56.270  -5.916 -13.813
    7    HD3  PRO 700           HD3      PRO 700  56.356  -4.240 -14.388

  No H/Q in entry =           7
  In of MODEL   17
    1    H    LYS 701           H        LYS 701  59.916  -7.221 -13.896
    2    HA   LYS 701           HA       LYS 701  59.286  -9.818 -15.050
    3    HB2  LYS 701           HB2      LYS 701  61.833  -8.901 -13.726
    4    HB3  LYS 701           HB3      LYS 701  61.463 -10.598 -14.016
    5    HG2  LYS 701           HG2      LYS 701  61.750  -8.465 -16.133
    6    HG3  LYS 701           HG3      LYS 701  62.973  -9.668 -15.711
    7    HD2  LYS 701           HD2      LYS 701  61.390 -11.451 -16.327
    8    HD3  LYS 701           HD3      LYS 701  60.218 -10.229 -16.822
    9    HE2  LYS 701           HE2      LYS 701  61.791  -9.417 -18.511
   10    HE3  LYS 701           HE3      LYS 701  62.957 -10.639 -18.003
   11    HZ1  LYS 701           HZ1      LYS 701  61.366 -12.360 -18.668
   12    HZ3  LYS 701           HZ2      LYS 701  61.733 -11.355 -19.965
   13    HZ2  LYS 701           HZ3      LYS 701  60.273 -11.189 -19.169

  No H/Q in entry =          13
  In of MODEL   17
    1    H    CYS 702           H        CYS 702  58.133  -8.071 -12.980
    2    HA   CYS 702           HA       CYS 702  58.242  -9.937 -10.694
    3    HB2  CYS 702           HB2      CYS 702  56.953  -7.223 -10.294
    4    HB3  CYS 702           HB3      CYS 702  57.820  -8.260  -9.236

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLN 703           H        GLN 703  56.177 -10.245  -9.644
    2    HA   GLN 703           HA       GLN 703  54.018 -10.328 -11.614
    3    HB2  GLN 703           HB2      GLN 703  54.531 -11.873  -9.095
    4    HB3  GLN 703           HB3      GLN 703  53.076 -12.036 -10.065
    5    HG2  GLN 703           HG2      GLN 703  55.863 -12.534 -11.076
    6    HG3  GLN 703           HG3      GLN 703  54.776 -13.788 -10.488
    7   HE21  GLN 703          HE21      GLN 703  55.398 -11.494 -13.035
    8   HE22  GLN 703          HE22      GLN 703  54.342 -12.205 -14.188

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ARG 704           H        ARG 704  51.892 -10.572  -9.998
    2    HA   ARG 704           HA       ARG 704  51.547  -7.746  -9.457
    3    HB2  ARG 704           HB2      ARG 704  49.608 -10.018  -9.596
    4    HB3  ARG 704           HB3      ARG 704  49.125  -8.421  -9.049
    5    HG2  ARG 704           HG2      ARG 704  49.725  -7.461 -11.168
    6    HG3  ARG 704           HG3      ARG 704  50.399  -9.016 -11.688
    7    HD2  ARG 704           HD2      ARG 704  48.369  -9.994 -11.917
    8    HD3  ARG 704           HD3      ARG 704  47.588  -8.907 -10.774
    9    HE   ARG 704           HE       ARG 704  47.937  -7.172 -12.588
   10   HH11  ARG 704          HH11      ARG 704  47.447 -10.614 -13.533
   11   HH12  ARG 704          HH12      ARG 704  46.547 -10.218 -14.894
   12   HH21  ARG 704          HH21      ARG 704  46.650  -6.705 -14.449
   13   HH22  ARG 704          HH22      ARG 704  46.071  -7.954 -15.462

  No H/Q in entry =          13
  In of MODEL   17
    1    H    TRP 705           H        TRP 705  52.305 -10.340  -7.543
    2    HA   TRP 705           HA       TRP 705  51.267  -9.072  -5.104
    3    HB2  TRP 705           HB2      TRP 705  52.182 -11.110  -3.974
    4    HB3  TRP 705           HB3      TRP 705  50.949 -11.449  -5.174
    5    HD1  TRP 705           HD1      TRP 705  54.637 -11.923  -4.445
    6    HE1  TRP 705           HE1      TRP 705  55.571 -13.695  -6.010
    7    HE3  TRP 705           HE3      TRP 705  50.599 -12.468  -7.484
    8    HZ2  TRP 705           HZ2      TRP 705  54.683 -15.156  -8.302
    9    HZ3  TRP 705           HZ3      TRP 705  50.704 -14.043  -9.317
   10    HH2  TRP 705           HH2      TRP 705  52.709 -15.392  -9.725

  No H/Q in entry =          10
  In of MODEL   17
    1    H    GLU 706           H        GLU 706  53.620  -8.459  -7.095
    2    HA   GLU 706           HA       GLU 706  55.589  -7.842  -5.036
    3    HB2  GLU 706           HB2      GLU 706  56.051  -8.555  -7.917
    4    HB3  GLU 706           HB3      GLU 706  57.283  -8.073  -6.751
    5    HG2  GLU 706           HG2      GLU 706  56.820 -10.036  -5.419
    6    HG3  GLU 706           HG3      GLU 706  55.534 -10.504  -6.531

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LYS 707           H        LYS 707  56.779  -6.035  -5.366
    2    HA   LYS 707           HA       LYS 707  55.629  -3.985  -7.123
    3    HB2  LYS 707           HB2      LYS 707  56.721  -3.730  -4.315
    4    HB3  LYS 707           HB3      LYS 707  56.427  -2.356  -5.364
    5    HG2  LYS 707           HG2      LYS 707  54.324  -4.320  -4.524
    6    HG3  LYS 707           HG3      LYS 707  54.641  -2.791  -3.699
    7    HD2  LYS 707           HD2      LYS 707  54.178  -1.611  -5.847
    8    HD3  LYS 707           HD3      LYS 707  53.787  -3.162  -6.582
    9    HE2  LYS 707           HE2      LYS 707  51.956  -3.455  -4.970
   10    HE3  LYS 707           HE3      LYS 707  52.353  -1.907  -4.246
   11    HZ3  LYS 707           HZ1      LYS 707  51.861  -0.826  -6.341
   12    HZ2  LYS 707           HZ2      LYS 707  50.522  -1.698  -5.804
   13    HZ1  LYS 707           HZ3      LYS 707  51.484  -2.313  -7.049

  No H/Q in entry =          13
  In of MODEL   17
    1    H    LEU 708           H        LEU 708  57.189  -2.454  -7.871
    2    HA   LEU 708           HA       LEU 708  59.839  -3.654  -8.112
    3    HB2  LEU 708           HB2      LEU 708  58.597  -3.335 -10.205
    4    HB3  LEU 708           HB3      LEU 708  58.416  -1.632  -9.840
    5    HG   LEU 708           HG       LEU 708  60.887  -1.382 -10.000
    6   HD12  LEU 708          HD11      LEU 708  62.193  -3.151 -11.074
    7   HD11  LEU 708          HD12      LEU 708  60.800  -4.228 -10.980
    8   HD13  LEU 708          HD13      LEU 708  61.573  -3.650  -9.504
    9   HD23  LEU 708          HD21      LEU 708  60.982  -1.553 -12.446
   10   HD22  LEU 708          HD22      LEU 708  59.478  -0.821 -11.884
   11   HD21  LEU 708          HD23      LEU 708  59.493  -2.496 -12.430

  No H/Q in entry =          11
  In of MODEL   17
    1    H    GLN 709           H        GLN 709  61.127  -2.827  -6.625
    2    HA   GLN 709           HA       GLN 709  61.623   0.020  -6.651
    3    HB2  GLN 709           HB2      GLN 709  61.457   0.375  -4.291
    4    HB3  GLN 709           HB3      GLN 709  59.984  -0.489  -4.692
    5    HG2  GLN 709           HG2      GLN 709  60.939  -2.527  -3.802
    6    HG3  GLN 709           HG3      GLN 709  62.479  -1.696  -3.545
    7   HE21  GLN 709          HE21      GLN 709  60.832  -2.978  -1.636
    8   HE22  GLN 709          HE22      GLN 709  60.404  -1.803  -0.441

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ASN 710           H        ASN 710  63.752   0.431  -5.960
    2    HA   ASN 710           HA       ASN 710  65.996  -0.028  -5.638
    3    HB2  ASN 710           HB2      ASN 710  64.935  -1.065  -3.570
    4    HB3  ASN 710           HB3      ASN 710  64.997  -2.617  -4.362
    5   HD21  ASN 710          HD21      ASN 710  66.754  -0.156  -2.821
    6   HD22  ASN 710          HD22      ASN 710  68.269  -0.979  -2.625

  No H/Q in entry =           6
  In of MODEL   17
    1    H    SER 711           H        SER 711  64.529  -0.867  -8.025
    2    HA   SER 711           HA       SER 711  64.817  -1.902  -9.997
    3    HB2  SER 711           HB2      SER 711  67.560  -2.485  -8.891
    4    HB3  SER 711           HB3      SER 711  67.113  -2.588 -10.602
    5    HG   SER 711           HG       SER 711  67.692  -0.458  -9.009

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ARG 712           H        ARG 712  63.878  -3.463  -7.581
    2    HA   ARG 712           HA       ARG 712  64.258  -6.101  -8.746
    3    HB2  ARG 712           HB2      ARG 712  64.571  -7.087  -6.522
    4    HB3  ARG 712           HB3      ARG 712  65.873  -6.003  -7.002
    5    HG2  ARG 712           HG2      ARG 712  65.036  -4.274  -5.578
    6    HG3  ARG 712           HG3      ARG 712  63.627  -5.249  -5.166
    7    HD2  ARG 712           HD2      ARG 712  65.388  -5.278  -3.425
    8    HD3  ARG 712           HD3      ARG 712  65.010  -6.877  -4.068
    9    HE   ARG 712           HE       ARG 712  67.100  -5.925  -5.579
   10   HH11  ARG 712          HH11      ARG 712  66.588  -6.586  -2.146
   11   HH12  ARG 712          HH12      ARG 712  68.185  -7.121  -1.881
   12   HH21  ARG 712          HH21      ARG 712  69.261  -6.639  -5.223
   13   HH22  ARG 712          HH22      ARG 712  69.772  -7.117  -3.685

  No H/Q in entry =          13
  In of MODEL   17
    1    H    CYS 713           H        CYS 713  62.819  -7.673  -7.572
    2    HA   CYS 713           HA       CYS 713  60.164  -6.494  -7.412
    3    HB2  CYS 713           HB2      CYS 713  61.026  -9.362  -7.750
    4    HB3  CYS 713           HB3      CYS 713  59.396  -8.722  -7.969

  No H/Q in entry =           4
  In of MODEL   17
    1    H    VAL 714           H        VAL 714  59.475  -6.202  -5.421
    2    HA   VAL 714           HA       VAL 714  60.370  -8.040  -3.310
    3    HB   VAL 714           HB       VAL 714  59.847  -6.222  -1.677
    4   HG13  VAL 714          HG11      VAL 714  61.791  -4.806  -2.151
    5   HG12  VAL 714          HG12      VAL 714  61.835  -5.439  -3.800
    6   HG11  VAL 714          HG13      VAL 714  62.136  -6.513  -2.434
    7   HG21  VAL 714          HG21      VAL 714  58.215  -4.971  -3.023
    8   HG23  VAL 714          HG22      VAL 714  59.499  -4.480  -4.129
    9   HG22  VAL 714          HG23      VAL 714  59.513  -3.920  -2.462

  No H/Q in entry =           9
  In of MODEL   17
    1    H    CYS 715           H        CYS 715  58.711  -8.537  -1.682
    2    HA   CYS 715           HA       CYS 715  56.161  -8.928  -3.032
    3    HB2  CYS 715           HB2      CYS 715  56.875  -9.771  -0.213
    4    HB3  CYS 715           HB3      CYS 715  55.663 -10.470  -1.274

  No H/Q in entry =           4
  In of MODEL   17
    1    H    LYS 716           H        LYS 716  54.332  -7.813  -2.465
    2    HA   LYS 716           HA       LYS 716  54.709  -5.494  -0.796
    3    HB2  LYS 716           HB2      LYS 716  52.464  -4.805  -1.522
    4    HB3  LYS 716           HB3      LYS 716  53.458  -5.274  -2.875
    5    HG2  LYS 716           HG2      LYS 716  52.275  -7.462  -2.908
    6    HG3  LYS 716           HG3      LYS 716  51.197  -6.836  -1.652
    7    HD2  LYS 716           HD2      LYS 716  50.638  -4.939  -3.149
    8    HD3  LYS 716           HD3      LYS 716  51.632  -5.684  -4.400
    9    HE2  LYS 716           HE2      LYS 716  50.138  -7.683  -4.270
   10    HE3  LYS 716           HE3      LYS 716  49.132  -6.769  -3.147
   11    HZ1  LYS 716           HZ1      LYS 716  48.736  -5.119  -4.883
   12    HZ3  LYS 716           HZ2      LYS 716  48.279  -6.642  -5.414
   13    HZ2  LYS 716           HZ3      LYS 716  49.723  -5.977  -5.955

  No H/Q in entry =          13
  In of MODEL   17
    1    H    MET 717           H        MET 717  52.008  -5.288   0.367
    2    HA   MET 717           HA       MET 717  52.611  -7.127   2.532
    3    HB2  MET 717           HB2      MET 717  50.817  -4.694   2.601
    4    HB3  MET 717           HB3      MET 717  51.211  -5.699   3.984
    5    HG2  MET 717           HG2      MET 717  53.066  -3.919   2.419
    6    HG3  MET 717           HG3      MET 717  52.556  -3.743   4.090
    7    HE1  MET 717           HE1      MET 717  53.431  -5.276   6.089
    8    HE3  MET 717           HE2      MET 717  54.498  -6.660   5.863
    9    HE2  MET 717           HE3      MET 717  52.846  -6.718   5.250

  No H/Q in entry =           9
  In of MODEL   17
    1    HA   PRO 718           HA       PRO 718  49.294  -9.794   1.408
    2    HB2  PRO 718           HB2      PRO 718  49.019 -10.669   4.183
    3    HB3  PRO 718           HB3      PRO 718  49.605 -11.571   2.787
    4    HG2  PRO 718           HG2      PRO 718  51.217 -10.735   4.826
    5    HG3  PRO 718           HG3      PRO 718  51.791 -10.983   3.167
    6    HD2  PRO 718           HD2      PRO 718  51.169  -8.467   4.625
    7    HD3  PRO 718           HD3      PRO 718  52.414  -8.809   3.405

  No H/Q in entry =           7
  In of MODEL   17
    1    H    TYR 719           H        TYR 719  48.863  -7.814   4.233
    2    HA   TYR 719           HA       TYR 719  45.980  -8.174   4.244
    3    HB2  TYR 719           HB2      TYR 719  46.003  -6.776   6.231
    4    HB3  TYR 719           HB3      TYR 719  47.241  -8.019   6.373
    5    HD1  TYR 719           HD1      TYR 719  49.662  -7.356   5.988
    6    HD2  TYR 719           HD2      TYR 719  46.545  -4.498   6.311
    7    HE1  TYR 719           HE1      TYR 719  51.320  -5.606   6.404
    8    HE2  TYR 719           HE2      TYR 719  48.192  -2.735   6.729
    9    HH   TYR 719           HH       TYR 719  50.449  -2.594   7.609

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLU 720           H        GLU 720  47.987  -6.398   2.370
    2    HA   GLU 720           HA       GLU 720  46.339  -3.984   2.436
    3    HB2  GLU 720           HB2      GLU 720  48.800  -3.719   2.759
    4    HB3  GLU 720           HB3      GLU 720  49.060  -4.423   1.173
    5    HG2  GLU 720           HG2      GLU 720  49.292  -2.024   1.056
    6    HG3  GLU 720           HG3      GLU 720  47.861  -2.520   0.160

  No H/Q in entry =           6
  In of MODEL   17
    1    H    CYS 721           H        CYS 721  46.097  -6.792   0.997
    2    HA   CYS 721           HA       CYS 721  45.861  -5.717  -1.654
    3    HB2  CYS 721           HB2      CYS 721  45.382  -8.005  -2.399
    4    HB3  CYS 721           HB3      CYS 721  46.892  -7.906  -1.509

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLY 722           H        GLY 722  43.528  -7.817   0.099
    2    HA3  GLY 722           HA2      GLY 722  41.356  -7.199   0.708
    3    HA2  GLY 722           HA3      GLY 722  41.480  -5.760  -0.281

  No H/Q in entry =           3
  In of MODEL   17
    1    HA   PRO 723           HA       PRO 723  38.772  -7.619  -3.341
    2    HB2  PRO 723           HB2      PRO 723  40.111  -6.487  -5.548
    3    HB3  PRO 723           HB3      PRO 723  38.754  -5.782  -4.668
    4    HG2  PRO 723           HG2      PRO 723  41.679  -5.288  -4.371
    5    HG3  PRO 723           HG3      PRO 723  40.329  -4.142  -4.265
    6    HD2  PRO 723           HD2      PRO 723  41.538  -4.971  -2.089
    7    HD3  PRO 723           HD3      PRO 723  39.766  -4.833  -2.108

  No H/Q in entry =           7
  In of MODEL   17
    1    H    SER 724           H        SER 724  39.037  -9.863  -3.633
    2    HA   SER 724           HA       SER 724  40.749 -10.872  -5.627
    3    HB2  SER 724           HB2      SER 724  42.360 -10.429  -3.829
    4    HB3  SER 724           HB3      SER 724  41.410 -11.375  -2.705
    5    HG   SER 724           HG       SER 724  42.227 -12.457  -5.133

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU 725           H        LEU 725  40.413 -13.181  -5.749
    2    HA   LEU 725           HA       LEU 725  37.815 -14.098  -4.983
    3    HB2  LEU 725           HB2      LEU 725  40.070 -15.196  -6.563
    4    HB3  LEU 725           HB3      LEU 725  39.023 -16.373  -5.802
    5    HG   LEU 725           HG       LEU 725  37.102 -15.409  -7.069
    6   HD13  LEU 725          HD11      LEU 725  37.414 -13.913  -8.850
    7   HD12  LEU 725          HD12      LEU 725  39.119 -13.767  -8.471
    8   HD11  LEU 725          HD13      LEU 725  37.911 -13.166  -7.331
    9   HD21  LEU 725          HD21      LEU 725  39.439 -16.258  -8.751
   10   HD23  LEU 725          HD22      LEU 725  37.748 -16.246  -9.250
   11   HD22  LEU 725          HD23      LEU 725  38.277 -17.328  -7.959

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ASP 726           H        ASP 726  37.307 -15.184  -3.232
    2    HA   ASP 726           HA       ASP 726  39.253 -15.703  -1.200
    3    HB2  ASP 726           HB2      ASP 726  36.299 -16.361  -1.351
    4    HB3  ASP 726           HB3      ASP 726  37.302 -16.600   0.073

  No H/Q in entry =           4
  In of MODEL   17
    1    H    VAL 727           H        VAL 727  40.159 -17.608  -0.694
    2    HA   VAL 727           HA       VAL 727  39.211 -20.041  -2.006
    3    HB   VAL 727           HB       VAL 727  41.563 -20.718  -2.525
    4   HG12  VAL 727          HG11      VAL 727  40.663 -18.199  -3.918
    5   HG11  VAL 727          HG12      VAL 727  40.165 -19.841  -4.316
    6   HG13  VAL 727          HG13      VAL 727  41.840 -19.349  -4.552
    7   HG21  VAL 727          HG21      VAL 727  42.749 -19.244  -0.975
    8   HG23  VAL 727          HG22      VAL 727  42.227 -17.836  -1.896
    9   HG22  VAL 727          HG23      VAL 727  43.331 -19.004  -2.623

  No H/Q in entry =           9
  In of MODEL   17
    1    H    CYS 728           H        CYS 728  40.011 -22.004  -0.974
    2    HA   CYS 728           HA       CYS 728  40.501 -21.569   1.871
    3    HB2  CYS 728           HB2      CYS 728  39.663 -24.056   0.371
    4    HB3  CYS 728           HB3      CYS 728  39.933 -23.979   2.102

  No H/Q in entry =           4
  In of MODEL   17
    1    H    ALA 729           H        ALA 729  42.515 -21.705   2.534
    2    HA   ALA 729           HA       ALA 729  44.288 -23.474   1.048
    3    HB2  ALA 729           HB1      ALA 729  46.097 -21.930   1.539
    4    HB1  ALA 729           HB2      ALA 729  44.950 -20.840   2.326
    5    HB3  ALA 729           HB3      ALA 729  44.824 -21.164   0.591

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLN 730           H        GLN 730  45.737 -24.567   2.241
    2    HA   GLN 730           HA       GLN 730  45.037 -24.890   5.043
    3    HB2  GLN 730           HB2      GLN 730  45.000 -26.918   3.611
    4    HB3  GLN 730           HB3      GLN 730  46.687 -26.635   3.234
    5    HG2  GLN 730           HG2      GLN 730  47.351 -26.987   5.479
    6    HG3  GLN 730           HG3      GLN 730  45.694 -27.102   6.035
    7   HE21  GLN 730          HE21      GLN 730  45.911 -29.186   6.835
    8   HE22  GLN 730          HE22      GLN 730  46.186 -30.549   5.809

  No H/Q in entry =           8
  In of MODEL   17
    1    H    ASP 731           H        ASP 731  46.270 -24.085   6.464
    2    HA   ASP 731           HA       ASP 731  48.780 -22.832   5.954
    3    HB2  ASP 731           HB2      ASP 731  47.205 -22.118   7.744
    4    HB3  ASP 731           HB3      ASP 731  47.461 -23.652   8.555

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLU 732           H        GLU 732  50.743 -23.928   5.839
    2    HA   GLU 732           HA       GLU 732  50.753 -26.733   6.223
    3    HB2  GLU 732           HB2      GLU 732  52.845 -24.772   5.459
    4    HB3  GLU 732           HB3      GLU 732  53.291 -26.425   5.866
    5    HG2  GLU 732           HG2      GLU 732  51.325 -25.610   3.739
    6    HG3  GLU 732           HG3      GLU 732  52.992 -26.127   3.467

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ARG 733           H        ARG 733  51.283 -24.263   8.502
    2    HA   ARG 733           HA       ARG 733  53.078 -25.908  10.041
    3    HB2  ARG 733           HB2      ARG 733  51.996 -23.128  10.433
    4    HB3  ARG 733           HB3      ARG 733  53.197 -23.913  11.444
    5    HG2  ARG 733           HG2      ARG 733  53.530 -23.256   8.515
    6    HG3  ARG 733           HG3      ARG 733  54.223 -22.337   9.852
    7    HD2  ARG 733           HD2      ARG 733  55.522 -24.273  10.529
    8    HD3  ARG 733           HD3      ARG 733  54.803 -25.238   9.241
    9    HE   ARG 733           HE       ARG 733  55.901 -23.189   7.904
   10   HH11  ARG 733          HH11      ARG 733  57.188 -25.365  10.377
   11   HH12  ARG 733          HH12      ARG 733  58.777 -25.367   9.776
   12   HH21  ARG 733          HH21      ARG 733  58.134 -23.169   7.052
   13   HH22  ARG 733          HH22      ARG 733  59.320 -24.086   7.867

  No H/Q in entry =          13
  In of MODEL   17
    1    H    SER 734           H        SER 734  49.898 -24.467  10.144
    2    HA   SER 734           HA       SER 734  49.310 -25.767  12.689
    3    HB2  SER 734           HB2      SER 734  47.579 -23.926  11.066
    4    HB3  SER 734           HB3      SER 734  47.473 -24.273  12.793
    5    HG   SER 734           HG       SER 734  49.488 -22.856  11.402

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LYS 735           H        LYS 735  48.763 -26.276   9.283
    2    HA   LYS 735           HA       LYS 735  47.610 -27.605   8.064
    3    HB2  LYS 735           HB2      LYS 735  47.562 -29.257  10.571
    4    HB3  LYS 735           HB3      LYS 735  46.930 -29.837   9.035
    5    HG2  LYS 735           HG2      LYS 735  49.774 -28.995   9.598
    6    HG3  LYS 735           HG3      LYS 735  49.190 -30.644   9.365
    7    HD2  LYS 735           HD2      LYS 735  48.385 -29.860   7.064
    8    HD3  LYS 735           HD3      LYS 735  49.305 -28.412   7.362
    9    HE2  LYS 735           HE2      LYS 735  51.359 -29.538   7.506
   10    HE3  LYS 735           HE3      LYS 735  50.588 -31.122   7.513
   11    HZ1  LYS 735           HZ1      LYS 735  50.555 -29.232   5.180
   12    HZ3  LYS 735           HZ2      LYS 735  49.962 -30.814   5.216
   13    HZ2  LYS 735           HZ3      LYS 735  51.596 -30.530   5.382

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ARG 736           H        ARG 736  46.161 -25.566   9.564
    2    HA   ARG 736           HA       ARG 736  43.451 -26.640   9.596
    3    HB2  ARG 736           HB2      ARG 736  42.791 -24.480  10.422
    4    HB3  ARG 736           HB3      ARG 736  44.157 -25.075  11.356
    5    HG2  ARG 736           HG2      ARG 736  45.654 -23.660  10.063
    6    HG3  ARG 736           HG3      ARG 736  44.276 -23.067   9.138
    7    HD2  ARG 736           HD2      ARG 736  44.904 -21.536  10.812
    8    HD3  ARG 736           HD3      ARG 736  43.299 -22.171  11.176
    9    HE   ARG 736           HE       ARG 736  44.439 -23.670  12.789
   10   HH11  ARG 736          HH11      ARG 736  46.125 -20.672  11.860
   11   HH12  ARG 736          HH12      ARG 736  46.909 -20.495  13.341
   12   HH21  ARG 736          HH21      ARG 736  45.527 -23.427  14.818
   13   HH22  ARG 736          HH22      ARG 736  46.568 -22.097  15.063

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ILE 737           H        ILE 737  41.820 -25.702   8.217
    2    HA   ILE 737           HA       ILE 737  42.949 -24.694   5.721
    3    HB   ILE 737           HB       ILE 737  40.067 -25.429   6.203
    4   HG12  ILE 737          HG12      ILE 737  41.526 -27.410   6.762
    5   HG13  ILE 737          HG13      ILE 737  40.466 -27.682   5.391
    6   HG23  ILE 737          HG21      ILE 737  40.002 -25.584   3.810
    7   HG22  ILE 737          HG22      ILE 737  41.752 -25.474   3.714
    8   HG21  ILE 737          HG23      ILE 737  40.825 -24.069   4.224
    9   HD11  ILE 737          HD11      ILE 737  42.339 -27.238   3.901
   10   HD13  ILE 737          HD12      ILE 737  42.640 -28.615   4.969
   11   HD12  ILE 737          HD13      ILE 737  43.410 -27.054   5.291

  No H/Q in entry =          11
  In of MODEL   17
    1    H    LEU 738           H        LEU 738  42.856 -22.546   5.514
    2    HA   LEU 738           HA       LEU 738  40.670 -21.216   6.873
    3    HB2  LEU 738           HB2      LEU 738  42.049 -19.262   7.412
    4    HB3  LEU 738           HB3      LEU 738  42.604 -20.698   8.238
    5    HG   LEU 738           HG       LEU 738  43.947 -19.630   5.744
    6   HD12  LEU 738          HD11      LEU 738  45.589 -18.640   7.258
    7   HD11  LEU 738          HD12      LEU 738  44.602 -19.105   8.646
    8   HD13  LEU 738          HD13      LEU 738  44.001 -17.908   7.495
    9   HD22  LEU 738          HD21      LEU 738  45.802 -20.968   6.570
   10   HD21  LEU 738          HD22      LEU 738  44.318 -21.930   6.363
   11   HD23  LEU 738          HD23      LEU 738  44.810 -21.409   7.972

  No H/Q in entry =          11
  In of MODEL   17
    1    HA   PRO 739           HA       PRO 739  39.874 -19.264   3.054
    2    HB2  PRO 739           HB2      PRO 739  38.575 -17.077   4.007
    3    HB3  PRO 739           HB3      PRO 739  37.826 -18.676   3.911
    4    HG2  PRO 739           HG2      PRO 739  38.980 -17.272   6.273
    5    HG3  PRO 739           HG3      PRO 739  37.554 -18.320   6.171
    6    HD2  PRO 739           HD2      PRO 739  40.035 -19.205   7.095
    7    HD3  PRO 739           HD3      PRO 739  38.795 -20.238   6.336

  No H/Q in entry =           7
  In of MODEL   17
    1    H    LEU 740           H        LEU 740  41.474 -18.447   2.076
    2    HA   LEU 740           HA       LEU 740  42.726 -15.925   2.966
    3    HB2  LEU 740           HB2      LEU 740  43.832 -18.136   1.235
    4    HB3  LEU 740           HB3      LEU 740  44.582 -16.574   1.443
    5    HG   LEU 740           HG       LEU 740  44.252 -18.715   3.544
    6   HD11  LEU 740          HD11      LEU 740  45.978 -19.105   1.877
    7   HD13  LEU 740          HD12      LEU 740  46.671 -18.762   3.462
    8   HD12  LEU 740          HD13      LEU 740  46.666 -17.517   2.211
    9   HD22  LEU 740          HD21      LEU 740  43.990 -16.528   4.575
   10   HD21  LEU 740          HD22      LEU 740  45.442 -15.949   3.763
   11   HD23  LEU 740          HD23      LEU 740  45.564 -17.209   4.990

  No H/Q in entry =          11
  In of MODEL   17
    1    H    THR 741           H        THR 741  43.511 -14.846   0.801
    2    HA   THR 741           HA       THR 741  41.524 -15.343  -1.255
    3    HB   THR 741           HB       THR 741  42.363 -12.907  -1.840
    4    HG1  THR 741           HG1      THR 741  42.453 -11.795   0.298
    5   HG22  THR 741          HG21      THR 741  40.287 -13.511   0.263
    6   HG21  THR 741          HG22      THR 741  40.082 -13.573  -1.493
    7   HG23  THR 741          HG23      THR 741  40.389 -12.021  -0.698

  No H/Q in entry =           7
  In of MODEL   17
    1    H    VAL 742           H        VAL 742  42.360 -14.738  -3.386
    2    HA   VAL 742           HA       VAL 742  44.638 -16.101  -4.082
    3    HB   VAL 742           HB       VAL 742  43.418 -13.733  -5.473
    4   HG11  VAL 742          HG11      VAL 742  45.219 -15.810  -6.636
    5   HG13  VAL 742          HG12      VAL 742  45.479 -14.056  -6.427
    6   HG12  VAL 742          HG13      VAL 742  44.240 -14.633  -7.531
    7   HG21  VAL 742          HG21      VAL 742  42.749 -16.637  -5.716
    8   HG23  VAL 742          HG22      VAL 742  42.266 -15.354  -6.847
    9   HG22  VAL 742          HG23      VAL 742  41.739 -15.271  -5.163

  No H/Q in entry =           9
  In of MODEL   17
    1    H    CYS 743           H        CYS 743  44.025 -12.713  -3.574
    2    HA   CYS 743           HA       CYS 743  46.531 -11.697  -4.179
    3    HB2  CYS 743           HB2      CYS 743  45.787  -9.652  -3.218
    4    HB3  CYS 743           HB3      CYS 743  44.435 -10.389  -4.052

  No H/Q in entry =           4
  In of MODEL   17
    1    H    LYS 744           H        LYS 744  45.110 -12.519  -1.085
    2    HA   LYS 744           HA       LYS 744  47.241 -11.685   0.422
    3    HB2  LYS 744           HB2      LYS 744  44.919 -12.106   1.127
    4    HB3  LYS 744           HB3      LYS 744  45.248 -13.822   1.097
    5    HG2  LYS 744           HG2      LYS 744  46.860 -13.613   2.868
    6    HG3  LYS 744           HG3      LYS 744  46.715 -11.854   2.843
    7    HD2  LYS 744           HD2      LYS 744  44.477 -13.774   3.475
    8    HD3  LYS 744           HD3      LYS 744  45.412 -12.892   4.687
    9    HE2  LYS 744           HE2      LYS 744  44.609 -10.762   3.708
   10    HE3  LYS 744           HE3      LYS 744  43.658 -11.663   2.532
   11    HZ3  LYS 744           HZ1      LYS 744  42.356 -12.592   4.339
   12    HZ2  LYS 744           HZ2      LYS 744  42.324 -10.913   4.411
   13    HZ1  LYS 744           HZ3      LYS 744  43.289 -11.765   5.469

  No H/Q in entry =          13
  In of MODEL   17
    1    H    MET 745           H        MET 745  46.204 -15.024  -0.431
    2    HA   MET 745           HA       MET 745  48.318 -16.546   0.533
    3    HB2  MET 745           HB2      MET 745  46.836 -17.894  -0.156
    4    HB3  MET 745           HB3      MET 745  46.193 -16.882  -1.467
    5    HG2  MET 745           HG2      MET 745  47.034 -18.719  -2.646
    6    HG3  MET 745           HG3      MET 745  48.374 -17.618  -2.671
    7    HE3  MET 745           HE1      MET 745  47.130 -20.082   0.227
    8    HE2  MET 745           HE2      MET 745  48.153 -21.473  -0.172
    9    HE1  MET 745           HE3      MET 745  46.958 -20.897  -1.322

  No H/Q in entry =           9
  In of MODEL   17
    1    H    HIS 746           H        HIS 746  48.172 -14.718  -2.522
    2    HA   HIS 746           HA       HIS 746  50.569 -15.877  -3.540
    3    HB2  HIS 746           HB2      HIS 746  48.808 -13.708  -4.321
    4    HB3  HIS 746           HB3      HIS 746  50.487 -13.484  -4.860
    5    HD1  HIS 746           HD1      HIS 746  51.254 -16.123  -5.917
    6    HD2  HIS 746           HD2      HIS 746  47.391 -14.682  -6.317
    7    HE1  HIS 746           HE1      HIS 746  50.310 -17.311  -7.899
    8    HE2  HIS 746           HE2      HIS 746  47.904 -16.607  -7.972

  No H/Q in entry =           8
  In of MODEL   17
    1    H    VAL 747           H        VAL 747  49.951 -12.813  -1.874
    2    HA   VAL 747           HA       VAL 747  52.689 -12.050  -1.866
    3    HB   VAL 747           HB       VAL 747  50.352 -11.146  -0.153
    4   HG13  VAL 747          HG11      VAL 747  51.771  -9.258   0.485
    5   HG12  VAL 747          HG12      VAL 747  53.107  -9.956  -0.430
    6   HG11  VAL 747          HG13      VAL 747  52.490 -10.783   0.999
    7   HG23  VAL 747          HG21      VAL 747  51.760  -9.822  -2.433
    8   HG22  VAL 747          HG22      VAL 747  50.380  -9.171  -1.542
    9   HG21  VAL 747          HG23      VAL 747  50.195 -10.626  -2.532

  No H/Q in entry =           9
  In of MODEL   17
    1    H    LEU 748           H        LEU 748  50.556 -13.596   0.350
    2    HA   LEU 748           HA       LEU 748  51.941 -14.190   2.645
    3    HB2  LEU 748           HB2      LEU 748  49.610 -14.550   2.233
    4    HB3  LEU 748           HB3      LEU 748  49.953 -15.528   0.858
    5    HG   LEU 748           HG       LEU 748  48.868 -16.759   2.459
    6   HD13  LEU 748          HD11      LEU 748  50.222 -18.069   1.308
    7   HD12  LEU 748          HD12      LEU 748  50.329 -18.608   2.984
    8   HD11  LEU 748          HD13      LEU 748  51.651 -17.665   2.262
    9   HD21  LEU 748          HD21      LEU 748  50.884 -15.919   4.515
   10   HD23  LEU 748          HD22      LEU 748  49.690 -17.232   4.683
   11   HD22  LEU 748          HD23      LEU 748  49.133 -15.594   4.400

  No H/Q in entry =          11
  In of MODEL   17
    1    H    HIS 749           H        HIS 749  51.845 -15.993  -0.404
    2    HA   HIS 749           HA       HIS 749  53.697 -18.005   0.339
    3    HB2  HIS 749           HB2      HIS 749  51.863 -17.808  -1.585
    4    HB3  HIS 749           HB3      HIS 749  53.254 -17.269  -2.511
    5    HD1  HIS 749           HD1      HIS 749  55.072 -19.090  -3.053
    6    HD2  HIS 749           HD2      HIS 749  51.772 -20.436  -0.944
    7    HE1  HIS 749           HE1      HIS 749  55.193 -21.591  -3.160
    8    HE2  HIS 749           HE2      HIS 749  53.274 -22.401  -1.768

  No H/Q in entry =           8
  In of MODEL   17
    1    H    CYS 750           H        CYS 750  53.948 -14.880  -1.239
    2    HA   CYS 750           HA       CYS 750  56.611 -15.184  -2.218
    3    HB2  CYS 750           HB2      CYS 750  54.882 -13.582  -3.110
    4    HB3  CYS 750           HB3      CYS 750  55.071 -12.591  -1.690

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLN 751           H        GLN 751  55.150 -14.022   0.718
    2    HA   GLN 751           HA       GLN 751  57.442 -12.943   1.976
    3    HB2  GLN 751           HB2      GLN 751  54.962 -14.165   3.197
    4    HB3  GLN 751           HB3      GLN 751  56.158 -13.240   4.086
    5    HG2  GLN 751           HG2      GLN 751  54.529 -12.177   1.800
    6    HG3  GLN 751           HG3      GLN 751  54.099 -11.966   3.486
    7   HE21  GLN 751          HE21      GLN 751  54.620  -9.904   1.516
    8   HE22  GLN 751          HE22      GLN 751  55.973  -9.015   2.067

  No H/Q in entry =           8
  In of MODEL   17
    1    H    GLY 752           H        GLY 752  56.551 -16.189   1.318
    2    HA3  GLY 752           HA2      GLY 752  58.194 -17.914   1.544
    3    HA2  GLY 752           HA3      GLY 752  58.822 -17.081   2.957

  No H/Q in entry =           3
  In of MODEL   17
    1    H    ARG 753           H        ARG 753  55.408 -17.359   2.688
    2    HA   ARG 753           HA       ARG 753  55.442 -19.250   4.905
    3    HB2  ARG 753           HB2      ARG 753  53.119 -17.717   3.712
    4    HB3  ARG 753           HB3      ARG 753  53.093 -18.653   5.199
    5    HG2  ARG 753           HG2      ARG 753  54.717 -16.157   4.726
    6    HG3  ARG 753           HG3      ARG 753  53.201 -16.243   5.620
    7    HD2  ARG 753           HD2      ARG 753  54.232 -17.699   7.268
    8    HD3  ARG 753           HD3      ARG 753  55.738 -17.707   6.346
    9    HE   ARG 753           HE       ARG 753  55.517 -15.137   6.750
   10   HH11  ARG 753          HH11      ARG 753  54.944 -17.735   9.072
   11   HH12  ARG 753          HH12      ARG 753  55.337 -16.791  10.422
   12   HH21  ARG 753          HH21      ARG 753  56.034 -13.858   8.575
   13   HH22  ARG 753          HH22      ARG 753  55.999 -14.508  10.144

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ASN 754           H        ASN 754  54.850 -21.304   4.656
    2    HA   ASN 754           HA       ASN 754  54.288 -22.207   1.956
    3    HB2  ASN 754           HB2      ASN 754  54.923 -23.770   4.471
    4    HB3  ASN 754           HB3      ASN 754  54.650 -24.484   2.890
    5   HD21  ASN 754          HD21      ASN 754  56.979 -24.600   4.580
    6   HD22  ASN 754          HD22      ASN 754  58.291 -23.950   3.676

  No H/Q in entry =           6
  In of MODEL   17
    1    H    TYR 755           H        TYR 755  52.344 -22.608   1.309
    2    HA   TYR 755           HA       TYR 755  50.301 -23.506   3.179
    3    HB2  TYR 755           HB2      TYR 755  50.180 -21.061   1.458
    4    HB3  TYR 755           HB3      TYR 755  48.718 -21.980   1.740
    5    HD1  TYR 755           HD1      TYR 755  47.369 -21.124   3.385
    6    HD2  TYR 755           HD2      TYR 755  51.560 -20.649   3.809
    7    HE1  TYR 755           HE1      TYR 755  47.019 -19.881   5.439
    8    HE2  TYR 755           HE2      TYR 755  51.216 -19.419   5.890
    9    HH   TYR 755           HH       TYR 755  48.559 -19.546   7.604

  No H/Q in entry =           9
  In of MODEL   17
    1    H    THR 756           H        THR 756  48.800 -24.794   2.257
    2    HA   THR 756           HA       THR 756  49.421 -25.716  -0.450
    3    HB   THR 756           HB       THR 756  48.184 -27.107   1.929
    4    HG1  THR 756           HG1      THR 756  50.147 -27.630   2.417
    5   HG22  THR 756          HG21      THR 756  48.369 -29.157   0.587
    6   HG21  THR 756          HG22      THR 756  48.960 -28.178  -0.776
    7   HG23  THR 756          HG23      THR 756  47.320 -27.941  -0.154

  No H/Q in entry =           7
  In of MODEL   17
    1    H    LEU 757           H        LEU 757  47.578 -25.933  -1.864
    2    HA   LEU 757           HA       LEU 757  45.278 -24.578  -0.773
    3    HB2  LEU 757           HB2      LEU 757  45.934 -25.169  -3.630
    4    HB3  LEU 757           HB3      LEU 757  44.386 -24.526  -3.111
    5    HG   LEU 757           HG       LEU 757  46.009 -22.785  -1.924
    6   HD11  LEU 757          HD11      LEU 757  47.524 -23.558  -4.392
    7   HD13  LEU 757          HD12      LEU 757  48.055 -23.707  -2.714
    8   HD12  LEU 757          HD13      LEU 757  47.800 -22.113  -3.418
    9   HD21  LEU 757          HD21      LEU 757  44.138 -22.259  -3.275
   10   HD23  LEU 757          HD22      LEU 757  45.031 -22.638  -4.759
   11   HD22  LEU 757          HD23      LEU 757  45.514 -21.270  -3.740

  No H/Q in entry =          11
  In of MODEL   17
    1    H    THR 758           H        THR 758  43.207 -25.219  -0.933
    2    HA   THR 758           HA       THR 758  42.770 -28.076  -1.263
    3    HB   THR 758           HB       THR 758  41.333 -27.937   0.837
    4    HG1  THR 758           HG1      THR 758  42.167 -25.349   0.676
    5   HG22  THR 758          HG21      THR 758  44.301 -27.418   1.213
    6   HG21  THR 758          HG22      THR 758  43.561 -28.989   0.901
    7   HG23  THR 758          HG23      THR 758  43.232 -28.155   2.407

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLY 759           H        GLY 759  40.156 -28.305  -0.974
    2    HA3  GLY 759           HA2      GLY 759  39.085 -26.644  -3.057
    3    HA2  GLY 759           HA3      GLY 759  38.259 -27.967  -2.242

  No H/Q in entry =           3
  In of MODEL   17
    1    H    ARG 760           H        ARG 760  36.944 -25.671  -2.847
    2    HA   ARG 760           HA       ARG 760  36.925 -23.664  -0.819
    3    HB2  ARG 760           HB2      ARG 760  35.005 -22.742  -1.842
    4    HB3  ARG 760           HB3      ARG 760  35.864 -23.497  -3.166
    5    HG2  ARG 760           HG2      ARG 760  33.457 -24.630  -1.734
    6    HG3  ARG 760           HG3      ARG 760  33.437 -23.869  -3.324
    7    HD2  ARG 760           HD2      ARG 760  34.856 -25.643  -4.192
    8    HD3  ARG 760           HD3      ARG 760  34.944 -26.346  -2.564
    9    HE   ARG 760           HE       ARG 760  32.288 -26.207  -3.228
   10   HH11  ARG 760          HH11      ARG 760  35.175 -27.817  -4.525
   11   HH12  ARG 760          HH12      ARG 760  34.375 -29.205  -5.054
   12   HH21  ARG 760          HH21      ARG 760  31.147 -28.115  -3.995
   13   HH22  ARG 760          HH22      ARG 760  32.000 -29.390  -4.737

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ASP 761           H        ASP 761  35.863 -26.825  -0.732
    2    HA   ASP 761           HA       ASP 761  33.674 -26.471   1.074
    3    HB2  ASP 761           HB2      ASP 761  33.584 -28.917   1.036
    4    HB3  ASP 761           HB3      ASP 761  33.656 -28.253  -0.596

  No H/Q in entry =           4
  In of MODEL   17
    1    H    SER 762           H        SER 762  37.064 -26.705   1.245
    2    HA   SER 762           HA       SER 762  37.197 -28.210   3.657
    3    HB2  SER 762           HB2      SER 762  39.332 -26.655   2.202
    4    HB3  SER 762           HB3      SER 762  39.609 -27.824   3.497
    5    HG   SER 762           HG       SER 762  38.034 -28.798   1.495

  No H/Q in entry =           5
  In of MODEL   17
    1    H    CYS 763           H        CYS 763  36.907 -24.823   2.867
    2    HA   CYS 763           HA       CYS 763  37.119 -24.274   5.733
    3    HB2  CYS 763           HB2      CYS 763  38.146 -22.169   5.388
    4    HB3  CYS 763           HB3      CYS 763  39.068 -23.309   4.422

  No H/Q in entry =           4
  In of MODEL   17
    1    H    THR 764           H        THR 764  36.053 -21.991   6.142
    2    HA   THR 764           HA       THR 764  33.445 -22.103   4.905
    3    HB   THR 764           HB       THR 764  34.429 -20.440   7.239
    4    HG1  THR 764           HG1      THR 764  33.470 -23.063   6.985
    5   HG22  THR 764          HG21      THR 764  31.643 -21.238   6.376
    6   HG21  THR 764          HG22      THR 764  32.372 -19.652   6.134
    7   HG23  THR 764          HG23      THR 764  32.054 -20.231   7.771

  No H/Q in entry =           7
  In of MODEL   17
    1    H    LEU 765           H        LEU 765  33.692 -21.184   2.966
    2    HA   LEU 765           HA       LEU 765  35.292 -18.789   2.698
    3    HB2  LEU 765           HB2      LEU 765  35.185 -20.974   1.218
    4    HB3  LEU 765           HB3      LEU 765  33.856 -20.097   0.481
    5    HG   LEU 765           HG       LEU 765  35.398 -18.237  -0.027
    6   HD13  LEU 765          HD11      LEU 765  36.999 -18.534   1.739
    7   HD12  LEU 765          HD12      LEU 765  37.833 -18.711   0.190
    8   HD11  LEU 765          HD13      LEU 765  37.405 -20.134   1.139
    9   HD22  LEU 765          HD21      LEU 765  36.603 -19.384  -1.797
   10   HD21  LEU 765          HD22      LEU 765  34.949 -19.984  -1.686
   11   HD23  LEU 765          HD23      LEU 765  36.284 -20.940  -1.030

  No H/Q in entry =          11
  In of MODEL   17
    1    HA   PRO 766           HA       PRO 766  31.615 -16.322   2.932
    2    HB2  PRO 766           HB2      PRO 766  32.688 -13.941   2.150
    3    HB3  PRO 766           HB3      PRO 766  32.922 -14.636   3.755
    4    HG2  PRO 766           HG2      PRO 766  34.764 -14.637   1.403
    5    HG3  PRO 766           HG3      PRO 766  35.150 -14.456   3.122
    6    HD2  PRO 766           HD2      PRO 766  35.475 -16.761   1.698
    7    HD3  PRO 766           HD3      PRO 766  35.206 -16.741   3.445

  No H/Q in entry =           7
  In of MODEL   17
    1    H    ALA 767           H        ALA 767  33.468 -15.139   0.092
    2    HA   ALA 767           HA       ALA 767  31.082 -14.497  -1.342
    3    HB1  ALA 767           HB1      ALA 767  33.930 -14.525  -2.245
    4    HB2  ALA 767           HB2      ALA 767  33.116 -13.160  -1.469
    5    HB3  ALA 767           HB3      ALA 767  32.594 -13.718  -3.068

  No H/Q in entry =           5
  In of MODEL   17
    1    H    SER 768           H        SER 768  31.753 -17.338  -0.787
    2    HA   SER 768           HA       SER 768  32.018 -18.541  -3.394
    3    HB2  SER 768           HB2      SER 768  32.965 -19.639  -1.379
    4    HB3  SER 768           HB3      SER 768  31.345 -19.802  -0.715
    5    HG   SER 768           HG       SER 768  31.340 -21.620  -1.723

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA 769           H        ALA 769  29.486 -18.245  -0.883
    2    HA   ALA 769           HA       ALA 769  27.558 -19.069  -2.912
    3    HB2  ALA 769           HB1      ALA 769  26.153 -19.855  -1.102
    4    HB3  ALA 769           HB2      ALA 769  27.344 -19.314   0.081
    5    HB1  ALA 769           HB3      ALA 769  27.738 -20.623  -1.032

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLU 770           H        GLU 770  25.934 -17.867  -3.367
    2    HA   GLU 770           HA       GLU 770  24.565 -16.199  -3.645
    3    HB2  GLU 770           HB2      GLU 770  24.668 -16.060  -0.664
    4    HB3  GLU 770           HB3      GLU 770  23.497 -15.193  -1.656
    5    HG2  GLU 770           HG2      GLU 770  22.859 -17.332  -2.671
    6    HG3  GLU 770           HG3      GLU 770  23.931 -18.136  -1.534

  No H/Q in entry =           6
  In of MODEL   17
    1    H    LYS 771           H        LYS 771  25.128 -14.638  -4.792
    2    HA   LYS 771           HA       LYS 771  27.085 -12.757  -3.775
    3    HB2  LYS 771           HB2      LYS 771  25.783 -12.821  -6.499
    4    HB3  LYS 771           HB3      LYS 771  27.171 -11.862  -6.003
    5    HG2  LYS 771           HG2      LYS 771  27.049 -14.858  -6.340
    6    HG3  LYS 771           HG3      LYS 771  27.920 -13.712  -7.358
    7    HD2  LYS 771           HD2      LYS 771  29.713 -14.159  -6.081
    8    HD3  LYS 771           HD3      LYS 771  28.918 -13.241  -4.805
    9    HE2  LYS 771           HE2      LYS 771  29.556 -15.385  -3.888
   10    HE3  LYS 771           HE3      LYS 771  27.806 -15.375  -4.069
   11    HZ2  LYS 771           HZ1      LYS 771  28.820 -17.457  -4.849
   12    HZ1  LYS 771           HZ2      LYS 771  29.691 -16.609  -5.995
   13    HZ3  LYS 771           HZ3      LYS 771  28.021 -16.662  -6.091

  No H/Q in entry =          13
  In of MODEL   17
    1    H    ALA 772           H        ALA 772  26.483 -10.996  -2.821
    2    HA   ALA 772           HA       ALA 772  24.167  -9.525  -3.639
    3    HB1  ALA 772           HB1      ALA 772  23.194  -9.477  -1.372
    4    HB3  ALA 772           HB2      ALA 772  24.393 -10.652  -0.835
    5    HB2  ALA 772           HB3      ALA 772  23.184 -11.113  -2.032

  No H/Q in entry =           5
  In of MODEL   17
    1    H    CYS 773           H        CYS 773  24.103  -7.514  -2.085
    2    HA   CYS 773           HA       CYS 773  26.675  -6.358  -2.292
    3    HB2  CYS 773           HB2      CYS 773  24.273  -5.355  -0.760
    4    HB3  CYS 773           HB3      CYS 773  25.624  -4.389  -1.355

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLY 774           H        GLY 774  28.241  -6.413  -0.857
    2    HA3  GLY 774           HA2      GLY 774  28.757  -6.389   1.602
    3    HA2  GLY 774           HA3      GLY 774  27.689  -7.793   1.675

  No H/Q in entry =           3
  In of MODEL   17
    1    H    ALA 775           H        ALA 775  28.567  -8.667  -1.030
    2    HA   ALA 775           HA       ALA 775  31.420  -8.908  -0.959
    3    HB2  ALA 775           HB1      ALA 775  30.803 -10.801   0.504
    4    HB1  ALA 775           HB2      ALA 775  31.474 -11.369  -1.023
    5    HB3  ALA 775           HB3      ALA 775  29.731 -11.417  -0.755

  No H/Q in entry =           5
  In of MODEL   17
    1    H    CYS 776           H        CYS 776  31.549  -8.023  -2.876
    2    HA   CYS 776           HA       CYS 776  31.416  -9.349  -5.261
    3    HB2  CYS 776           HB2      CYS 776  29.388  -8.357  -6.391
    4    HB3  CYS 776           HB3      CYS 776  28.949  -9.424  -5.068

  No H/Q in entry =           4
  In of MODEL   17
    1    HA   PRO 777           HA       PRO 777  33.103  -5.031  -4.950
    2    HB2  PRO 777           HB2      PRO 777  35.817  -5.844  -4.897
    3    HB3  PRO 777           HB3      PRO 777  34.830  -5.294  -3.548
    4    HG2  PRO 777           HG2      PRO 777  35.832  -7.894  -3.879
    5    HG3  PRO 777           HG3      PRO 777  34.567  -7.398  -2.748
    6    HD2  PRO 777           HD2      PRO 777  34.315  -8.689  -5.430
    7    HD3  PRO 777           HD3      PRO 777  33.314  -8.894  -3.975

  No H/Q in entry =           7
  In of MODEL   17
    1    H    LEU 778           H        LEU 778  35.209  -7.287  -6.742
    2    HA   LEU 778           HA       LEU 778  35.906  -5.296  -8.699
    3    HB2  LEU 778           HB2      LEU 778  36.401  -8.281  -8.855
    4    HB3  LEU 778           HB3      LEU 778  37.183  -7.056  -9.814
    5    HG   LEU 778           HG       LEU 778  38.323  -6.262  -7.692
    6   HD13  LEU 778          HD11      LEU 778  36.806  -7.202  -6.041
    7   HD12  LEU 778          HD12      LEU 778  38.426  -7.865  -5.831
    8   HD11  LEU 778          HD13      LEU 778  37.172  -8.830  -6.607
    9   HD23  LEU 778          HD21      LEU 778  38.778  -9.118  -8.484
   10   HD22  LEU 778          HD22      LEU 778  39.945  -8.048  -7.694
   11   HD21  LEU 778          HD23      LEU 778  39.416  -7.711  -9.346

  No H/Q in entry =          11
  In of MODEL   17
    1    H    TRP 779           H        TRP 779  34.396  -8.432  -8.923
    2    HA   TRP 779           HA       TRP 779  33.482  -8.087 -11.616
    3    HB2  TRP 779           HB2      TRP 779  32.535 -10.378 -11.118
    4    HB3  TRP 779           HB3      TRP 779  34.295 -10.222 -11.066
    5    HD1  TRP 779           HD1      TRP 779  31.249 -10.712  -8.774
    6    HE1  TRP 779           HE1      TRP 779  32.077 -11.502  -6.460
    7    HE3  TRP 779           HE3      TRP 779  36.269 -10.317  -9.532
    8    HZ2  TRP 779           HZ2      TRP 779  34.563 -11.890  -5.146
    9    HZ3  TRP 779           HZ3      TRP 779  37.790 -10.912  -7.715
   10    HH2  TRP 779           HH2      TRP 779  36.950 -11.688  -5.571

  No H/Q in entry =          10
  In of MODEL   17
    1    H    GLY 780           H        GLY 780  32.248  -6.845  -8.881
    2    HA3  GLY 780           HA2      GLY 780  29.512  -7.358  -9.760
    3    HA2  GLY 780           HA3      GLY 780  29.952  -7.516  -8.066

  No H/Q in entry =           3
  In of MODEL   17
    1    H    LYS 781           H        LYS 781  28.044  -5.819  -9.171
    2    HA   LYS 781           HA       LYS 781  29.033  -3.333  -8.069
    3    HB2  LYS 781           HB2      LYS 781  29.151  -3.053 -10.501
    4    HB3  LYS 781           HB3      LYS 781  27.480  -3.583 -10.655
    5    HG2  LYS 781           HG2      LYS 781  26.729  -1.596  -9.436
    6    HG3  LYS 781           HG3      LYS 781  28.402  -1.081  -9.239
    7    HD2  LYS 781           HD2      LYS 781  27.077  -1.495 -11.920
    8    HD3  LYS 781           HD3      LYS 781  27.144   0.066 -11.101
    9    HE2  LYS 781           HE2      LYS 781  29.540   0.062 -11.192
   10    HE3  LYS 781           HE3      LYS 781  29.593  -1.557 -11.854
   11    HZ3  LYS 781           HZ1      LYS 781  29.897   0.004 -13.639
   12    HZ2  LYS 781           HZ2      LYS 781  28.566   0.904 -13.164
   13    HZ1  LYS 781           HZ3      LYS 781  28.346  -0.629 -13.823

  No H/Q in entry =          13
  In of MODEL   17
    1    H    CYS 782           H        CYS 782  27.714  -2.871  -6.508
    2    HA   CYS 782           HA       CYS 782  25.271  -4.335  -6.190
    3    HB2  CYS 782           HB2      CYS 782  26.600  -3.919  -4.236
    4    HB3  CYS 782           HB3      CYS 782  26.555  -2.175  -4.504

  No H/Q in entry =           4
  In of MODEL   17
    1    H    ASP 783           H        ASP 783  23.265  -3.680  -6.658
    2    HA   ASP 783           HA       ASP 783  22.907  -1.232  -8.111
    3    HB2  ASP 783           HB2      ASP 783  21.618  -3.366  -8.562
    4    HB3  ASP 783           HB3      ASP 783  20.770  -3.093  -7.044

  No H/Q in entry =           4
  In of MODEL   17
    1    H    ALA 784           H        ALA 784  21.703  -2.545  -5.075
    2    HA   ALA 784           HA       ALA 784  22.096  -0.206  -3.568
    3    HB2  ALA 784           HB1      ALA 784  19.714   0.232  -3.014
    4    HB1  ALA 784           HB2      ALA 784  19.228  -0.923  -4.256
    5    HB3  ALA 784           HB3      ALA 784  20.056   0.566  -4.713

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLU 785           H        GLU 785  21.756  -0.741  -1.312
    2    HA   GLU 785           HA       GLU 785  21.788  -3.582  -0.951
    3    HB2  GLU 785           HB2      GLU 785  22.258  -1.330   0.995
    4    HB3  GLU 785           HB3      GLU 785  22.291  -3.032   1.458
    5    HG2  GLU 785           HG2      GLU 785  24.102  -3.447  -0.074
    6    HG3  GLU 785           HG3      GLU 785  24.048  -1.783  -0.637

  No H/Q in entry =           6
  In of MODEL   17
    1    H    SER 786           H        SER 786  19.786  -3.829  -1.661
    2    HA   SER 786           HA       SER 786  17.787  -4.332   0.310
    3    HB2  SER 786           HB2      SER 786  17.059  -2.417  -1.947
    4    HB3  SER 786           HB3      SER 786  15.979  -3.005  -0.691
    5    HG   SER 786           HG       SER 786  18.176  -1.803   0.325

  No H/Q in entry =           5
  In of MODEL   17
    1    H    SER 787           H        SER 787  18.786  -3.848  -3.005
    2    HA   SER 787           HA       SER 787  17.296  -6.103  -3.992
    3    HB2  SER 787           HB2      SER 787  19.112  -4.125  -5.385
    4    HB3  SER 787           HB3      SER 787  17.904  -5.181  -6.127
    5    HG   SER 787           HG       SER 787  16.299  -3.963  -5.329

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LYS 788           H        LYS 788  19.057  -7.039  -5.873
    2    HA   LYS 788           HA       LYS 788  21.099  -8.262  -4.225
    3    HB2  LYS 788           HB2      LYS 788  21.393  -9.811  -6.089
    4    HB3  LYS 788           HB3      LYS 788  19.711  -9.734  -5.585
    5    HG2  LYS 788           HG2      LYS 788  19.212  -8.266  -7.472
    6    HG3  LYS 788           HG3      LYS 788  20.902  -8.333  -7.975
    7    HD2  LYS 788           HD2      LYS 788  20.688 -10.769  -8.250
    8    HD3  LYS 788           HD3      LYS 788  18.986 -10.651  -7.800
    9    HE2  LYS 788           HE2      LYS 788  18.579  -9.184  -9.712
   10    HE3  LYS 788           HE3      LYS 788  20.278  -9.306 -10.171
   11    HZ3  LYS 788           HZ1      LYS 788  18.933 -10.821 -11.461
   12    HZ2  LYS 788           HZ2      LYS 788  18.336 -11.541 -10.063
   13    HZ1  LYS 788           HZ3      LYS 788  19.944 -11.715 -10.452

  No H/Q in entry =          13
  In of MODEL   17
    1    H    CYS 789           H        CYS 789  23.204  -8.740  -5.471
    2    HA   CYS 789           HA       CYS 789  24.196  -6.209  -6.557
    3    HB2  CYS 789           HB2      CYS 789  25.333  -7.321  -4.553
    4    HB3  CYS 789           HB3      CYS 789  25.764  -8.636  -5.634

  No H/Q in entry =           4
  In of MODEL   17
    1    H    VAL 790           H        VAL 790  25.032  -6.244  -8.659
    2    HA   VAL 790           HA       VAL 790  24.412  -8.736 -10.054
    3    HB   VAL 790           HB       VAL 790  24.250  -7.448 -12.149
    4   HG12  VAL 790          HG11      VAL 790  22.472  -6.409  -9.950
    5   HG11  VAL 790          HG12      VAL 790  22.258  -7.913 -10.842
    6   HG13  VAL 790          HG13      VAL 790  22.112  -6.373 -11.679
    7   HG21  VAL 790          HG21      VAL 790  25.724  -5.573 -11.607
    8   HG23  VAL 790          HG22      VAL 790  24.579  -5.005 -10.391
    9   HG22  VAL 790          HG23      VAL 790  24.134  -4.986 -12.097

  No H/Q in entry =           9
  In of MODEL   17
    1    H    CYS 791           H        CYS 791  25.738  -9.448 -11.715
    2    HA   CYS 791           HA       CYS 791  28.555  -8.968 -11.065
    3    HB2  CYS 791           HB2      CYS 791  27.424 -11.235 -12.701
    4    HB3  CYS 791           HB3      CYS 791  28.971 -11.101 -11.892

  No H/Q in entry =           4
  In of MODEL   17
    1    H    ARG 792           H        ARG 792  29.873  -8.264 -12.491
    2    HA   ARG 792           HA       ARG 792  28.690  -7.201 -14.918
    3    HB2  ARG 792           HB2      ARG 792  31.216  -6.532 -13.413
    4    HB3  ARG 792           HB3      ARG 792  30.726  -5.765 -14.922
    5    HG2  ARG 792           HG2      ARG 792  28.660  -5.008 -13.876
    6    HG3  ARG 792           HG3      ARG 792  29.155  -5.755 -12.361
    7    HD2  ARG 792           HD2      ARG 792  30.786  -3.662 -13.753
    8    HD3  ARG 792           HD3      ARG 792  29.488  -3.279 -12.635
    9    HE   ARG 792           HE       ARG 792  31.114  -4.981 -11.256
   10   HH11  ARG 792          HH11      ARG 792  31.821  -1.967 -13.039
   11   HH12  ARG 792          HH12      ARG 792  32.885  -1.375 -11.823
   12   HH21  ARG 792          HH21      ARG 792  32.529  -4.071  -9.591
   13   HH22  ARG 792          HH22      ARG 792  33.284  -2.569  -9.853

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLU 793           H        GLU 793  30.428  -7.052 -16.720
    2    HA   GLU 793           HA       GLU 793  31.260  -9.784 -17.211
    3    HB2  GLU 793           HB2      GLU 793  31.413  -7.322 -18.967
    4    HB3  GLU 793           HB3      GLU 793  31.808  -8.956 -19.471
    5    HG2  GLU 793           HG2      GLU 793  29.483  -9.627 -19.086
    6    HG3  GLU 793           HG3      GLU 793  29.096  -7.975 -18.604

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ALA 794           H        ALA 794  33.486  -9.966 -18.300
    2    HA   ALA 794           HA       ALA 794  35.445  -9.178 -16.430
    3    HB1  ALA 794           HB1      ALA 794  35.756 -10.303 -19.202
    4    HB2  ALA 794           HB2      ALA 794  35.609 -11.237 -17.716
    5    HB3  ALA 794           HB3      ALA 794  37.030 -10.221 -17.985

  No H/Q in entry =           5
  In of MODEL   17
    1    H    SER 795           H        SER 795  34.080  -7.578 -19.077
    2    HA   SER 795           HA       SER 795  36.127  -5.912 -19.931
    3    HB2  SER 795           HB2      SER 795  33.221  -5.229 -19.685
    4    HB3  SER 795           HB3      SER 795  34.374  -4.617 -20.874
    5    HG   SER 795           HG       SER 795  34.424  -6.554 -21.861

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLU 796           H        GLU 796  33.844  -5.758 -17.186
    2    HA   GLU 796           HA       GLU 796  34.998  -3.239 -16.417
    3    HB2  GLU 796           HB2      GLU 796  32.583  -4.696 -15.362
    4    HB3  GLU 796           HB3      GLU 796  33.322  -3.391 -14.448
    5    HG2  GLU 796           HG2      GLU 796  32.977  -1.894 -16.399
    6    HG3  GLU 796           HG3      GLU 796  32.119  -3.206 -17.205

  No H/Q in entry =           6
  In of MODEL   17
    1    H    CYS 797           H        CYS 797  36.869  -4.662 -16.407
    2    HA   CYS 797           HA       CYS 797  37.386  -6.003 -13.919
    3    HB2  CYS 797           HB2      CYS 797  38.421  -6.791 -15.957
    4    HB3  CYS 797           HB3      CYS 797  39.200  -5.229 -16.218

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLU 798           H        GLU 798  36.707  -4.337 -12.731
    2    HA   GLU 798           HA       GLU 798  37.736  -1.718 -12.687
    3    HB2  GLU 798           HB2      GLU 798  35.524  -2.556 -11.841
    4    HB3  GLU 798           HB3      GLU 798  36.367  -3.215 -10.459
    5    HG2  GLU 798           HG2      GLU 798  36.805  -1.106  -9.584
    6    HG3  GLU 798           HG3      GLU 798  36.502  -0.303 -11.131

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU 799           H        GLU 799  38.743  -4.662 -11.190
    2    HA   GLU 799           HA       GLU 799  41.216  -3.371 -10.390
    3    HB2  GLU 799           HB2      GLU 799  39.441  -4.009  -8.434
    4    HB3  GLU 799           HB3      GLU 799  40.144  -5.597  -8.696
    5    HG2  GLU 799           HG2      GLU 799  41.561  -3.094  -7.772
    6    HG3  GLU 799           HG3      GLU 799  41.252  -4.578  -6.877

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLU 800           H        GLU 800  42.913  -4.853 -10.716
    2    HA   GLU 800           HA       GLU 800  42.482  -6.628 -12.922
    3    HB2  GLU 800           HB2      GLU 800  44.930  -6.228 -11.215
    4    HB3  GLU 800           HB3      GLU 800  44.872  -7.031 -12.767
    5    HG2  GLU 800           HG2      GLU 800  44.339  -4.940 -13.861
    6    HG3  GLU 800           HG3      GLU 800  44.278  -4.120 -12.295

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLY 801           H        GLY 801  43.172  -7.006  -9.438
    2    HA3  GLY 801           HA2      GLY 801  43.548  -8.750  -8.175
    3    HA2  GLY 801           HA3      GLY 801  42.618  -9.716  -9.310

  No H/Q in entry =           3
  In of MODEL   17
    1    H    PHE 802           H        PHE 802  43.962 -11.399  -9.360
    2    HA   PHE 802           HA       PHE 802  46.640 -10.997 -10.509
    3    HB2  PHE 802           HB2      PHE 802  45.499 -13.138  -8.752
    4    HB3  PHE 802           HB3      PHE 802  47.061 -13.324  -9.525
    5    HD1  PHE 802           HD1      PHE 802  45.122 -11.491  -7.066
    6    HD2  PHE 802           HD2      PHE 802  48.918 -12.016  -8.833
    7    HE1  PHE 802           HE1      PHE 802  46.094 -10.153  -5.320
    8    HE2  PHE 802           HE2      PHE 802  49.922 -10.680  -7.075
    9    HZ   PHE 802           HZ       PHE 802  48.527  -9.730  -5.288

  No H/Q in entry =           9
  In of MODEL   17
    1    H    SER 803           H        SER 803  47.220 -13.383 -11.429
    2    HA   SER 803           HA       SER 803  45.138 -14.030 -13.358
    3    HB2  SER 803           HB2      SER 803  48.145 -14.421 -13.570
    4    HB3  SER 803           HB3      SER 803  46.935 -14.706 -14.830
    5    HG   SER 803           HG       SER 803  47.254 -12.757 -15.373

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ILE 804           H        ILE 804  44.302 -15.992 -13.043
    2    HA   ILE 804           HA       ILE 804  45.826 -17.930 -11.452
    3    HB   ILE 804           HB       ILE 804  43.868 -18.680 -10.255
    4   HG12  ILE 804          HG12      ILE 804  42.134 -18.183 -12.021
    5   HG13  ILE 804          HG13      ILE 804  41.650 -17.744 -10.395
    6   HG21  ILE 804          HG21      ILE 804  45.081 -16.890  -9.208
    7   HG23  ILE 804          HG22      ILE 804  43.359 -16.719  -8.856
    8   HG22  ILE 804          HG23      ILE 804  44.118 -15.696 -10.076
    9   HD13  ILE 804          HD11      ILE 804  40.925 -16.092 -11.982
   10   HD12  ILE 804          HD12      ILE 804  42.562 -15.875 -12.577
   11   HD11  ILE 804          HD13      ILE 804  42.151 -15.386 -10.930

  No H/Q in entry =          11
  In of MODEL   17
    1    H    CYS 805           H        CYS 805  44.833 -20.185 -11.673
    2    HA   CYS 805           HA       CYS 805  44.356 -20.610 -14.533
    3    HB2  CYS 805           HB2      CYS 805  46.425 -21.546 -13.480
    4    HB3  CYS 805           HB3      CYS 805  45.391 -22.508 -12.427

  No H/Q in entry =           4
  In of MODEL   17
    1    H    VAL 806           H        VAL 806  42.340 -21.214 -15.057
    2    HA   VAL 806           HA       VAL 806  40.708 -22.492 -12.983
    3    HB   VAL 806           HB       VAL 806  39.728 -20.568 -15.073
    4   HG13  VAL 806          HG11      VAL 806  38.049 -22.090 -14.371
    5   HG12  VAL 806          HG12      VAL 806  37.690 -20.485 -13.715
    6   HG11  VAL 806          HG13      VAL 806  38.362 -21.744 -12.677
    7   HG22  VAL 806          HG21      VAL 806  41.127 -19.325 -13.571
    8   HG21  VAL 806          HG22      VAL 806  40.262 -19.971 -12.167
    9   HG23  VAL 806          HG23      VAL 806  39.439 -18.900 -13.310

  No H/Q in entry =           9
  In of MODEL   17
    1    H    GLU 807           H        GLU 807  39.647 -24.292 -13.626
    2    HA   GLU 807           HA       GLU 807  40.054 -25.262 -16.292
    3    HB2  GLU 807           HB2      GLU 807  40.259 -26.810 -14.408
    4    HB3  GLU 807           HB3      GLU 807  38.622 -26.445 -13.902
    5    HG2  GLU 807           HG2      GLU 807  37.754 -27.446 -15.949
    6    HG3  GLU 807           HG3      GLU 807  39.398 -27.773 -16.491

  No H/Q in entry =           6
  In of MODEL   17
    1    H    VAL 808           H        VAL 808  38.719 -25.022 -17.822
    2    HA   VAL 808           HA       VAL 808  35.889 -24.622 -17.430
    3    HB   VAL 808           HB       VAL 808  36.835 -22.345 -17.347
    4   HG13  VAL 808          HG11      VAL 808  38.845 -22.573 -18.609
    5   HG12  VAL 808          HG12      VAL 808  37.860 -21.290 -19.311
    6   HG11  VAL 808          HG13      VAL 808  37.929 -22.873 -20.086
    7   HG23  VAL 808          HG21      VAL 808  35.473 -21.309 -19.122
    8   HG22  VAL 808          HG22      VAL 808  34.618 -22.573 -18.230
    9   HG21  VAL 808          HG23      VAL 808  35.257 -22.909 -19.838

  No H/Q in entry =           9
  In of MODEL   17
    1    H    ASN 809           H        ASN 809  34.829 -25.670 -19.027
    2    HA   ASN 809           HA       ASN 809  34.406 -26.824 -20.944
    3    HB2  ASN 809           HB2      ASN 809  36.580 -25.018 -21.839
    4    HB3  ASN 809           HB3      ASN 809  35.940 -26.210 -22.988
    5   HD21  ASN 809          HD21      ASN 809  35.633 -23.148 -21.614
    6   HD22  ASN 809          HD22      ASN 809  34.080 -22.715 -22.220

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLY 810           H        GLY 810  36.474 -27.650 -18.964
    2    HA3  GLY 810           HA2      GLY 810  37.601 -29.671 -18.698
    3    HA2  GLY 810           HA3      GLY 810  37.476 -29.932 -20.436

  No H/Q in entry =           3
  In of MODEL   17
    1    H    LYS 811           H        LYS 811  38.613 -26.887 -20.212
    2    HA   LYS 811           HA       LYS 811  41.394 -27.817 -20.429
    3    HB2  LYS 811           HB2      LYS 811  40.398 -25.076 -21.170
    4    HB3  LYS 811           HB3      LYS 811  41.861 -25.873 -21.704
    5    HG2  LYS 811           HG2      LYS 811  39.048 -26.452 -22.537
    6    HG3  LYS 811           HG3      LYS 811  40.338 -25.693 -23.480
    7    HD2  LYS 811           HD2      LYS 811  40.326 -28.539 -22.487
    8    HD3  LYS 811           HD3      LYS 811  39.905 -28.042 -24.124
    9    HE2  LYS 811           HE2      LYS 811  42.198 -27.109 -24.384
   10    HE3  LYS 811           HE3      LYS 811  42.598 -27.720 -22.780
   11    HZ3  LYS 811           HZ1      LYS 811  43.361 -29.233 -24.485
   12    HZ2  LYS 811           HZ2      LYS 811  41.814 -29.361 -25.124
   13    HZ1  LYS 811           HZ3      LYS 811  42.133 -29.980 -23.596

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLU 812           H        GLU 812  42.886 -25.977 -19.706
    2    HA   GLU 812           HA       GLU 812  41.824 -24.712 -17.267
    3    HB2  GLU 812           HB2      GLU 812  44.580 -25.913 -17.577
    4    HB3  GLU 812           HB3      GLU 812  44.103 -24.892 -16.234
    5    HG2  GLU 812           HG2      GLU 812  42.367 -26.575 -15.658
    6    HG3  GLU 812           HG3      GLU 812  43.025 -27.615 -16.923

  No H/Q in entry =           6
  In of MODEL   17
    1    H    GLN 813           H        GLN 813  41.583 -22.729 -17.832
    2    HA   GLN 813           HA       GLN 813  43.651 -21.459 -19.486
    3    HB2  GLN 813           HB2      GLN 813  41.548 -21.449 -20.577
    4    HB3  GLN 813           HB3      GLN 813  40.708 -20.891 -19.134
    5    HG2  GLN 813           HG2      GLN 813  41.820 -18.732 -19.332
    6    HG3  GLN 813           HG3      GLN 813  42.701 -19.296 -20.751
    7   HE21  GLN 813          HE21      GLN 813  39.372 -20.151 -20.200
    8   HE22  GLN 813          HE22      GLN 813  38.712 -19.169 -21.454

  No H/Q in entry =           8
  In of MODEL   17
    1    H    THR 814           H        THR 814  44.660 -19.695 -18.796
    2    HA   THR 814           HA       THR 814  44.488 -18.924 -16.045
    3    HB   THR 814           HB       THR 814  46.007 -17.710 -18.345
    4    HG1  THR 814           HG1      THR 814  47.730 -19.011 -17.507
    5   HG23  THR 814          HG21      THR 814  47.531 -16.876 -16.590
    6   HG22  THR 814          HG22      THR 814  46.485 -17.585 -15.357
    7   HG21  THR 814          HG23      THR 814  45.891 -16.268 -16.363

  No H/Q in entry =           7
  In of MODEL   17
    1    H    MET 815           H        MET 815  43.233 -17.329 -15.357
    2    HA   MET 815           HA       MET 815  42.182 -15.429 -17.350
    3    HB2  MET 815           HB2      MET 815  40.705 -16.307 -14.887
    4    HB3  MET 815           HB3      MET 815  40.078 -15.363 -16.227
    5    HG2  MET 815           HG2      MET 815  40.535 -17.538 -17.613
    6    HG3  MET 815           HG3      MET 815  40.658 -18.239 -16.006
    7    HE3  MET 815           HE1      MET 815  38.571 -19.113 -18.294
    8    HE2  MET 815           HE2      MET 815  37.198 -19.511 -17.253
    9    HE1  MET 815           HE3      MET 815  38.843 -19.948 -16.772

  No H/Q in entry =           9
  In of MODEL   17
    1    H    SER 816           H        SER 816  41.804 -13.354 -16.495
    2    HA   SER 816           HA       SER 816  43.476 -12.659 -14.273
    3    HB2  SER 816           HB2      SER 816  41.345 -11.002 -15.668
    4    HB3  SER 816           HB3      SER 816  42.597 -10.405 -14.574
    5    HG   SER 816           HG       SER 816  42.744 -10.705 -17.181

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLU 817           H        GLU 817  42.630 -11.838 -12.309
    2    HA   GLU 817           HA       GLU 817  40.775 -13.556 -11.185
    3    HB2  GLU 817           HB2      GLU 817  42.705 -12.269 -10.210
    4    HB3  GLU 817           HB3      GLU 817  41.559 -10.924 -10.173
    5    HG2  GLU 817           HG2      GLU 817  40.200 -11.918  -8.618
    6    HG3  GLU 817           HG3      GLU 817  40.938 -13.515  -8.950

  No H/Q in entry =           6
  In of MODEL   17
    1    H    CYS 818           H        CYS 818  40.475 -10.193 -12.205
    2    HA   CYS 818           HA       CYS 818  37.823  -9.779 -11.419
    3    HB2  CYS 818           HB2      CYS 818  37.825  -8.036 -13.242
    4    HB3  CYS 818           HB3      CYS 818  39.150  -7.904 -12.087

  No H/Q in entry =           4
  In of MODEL   17
    1    H    GLU 819           H        GLU 819  39.218 -11.240 -14.245
    2    HA   GLU 819           HA       GLU 819  36.908 -11.508 -15.849
    3    HB2  GLU 819           HB2      GLU 819  39.212 -11.574 -16.720
    4    HB3  GLU 819           HB3      GLU 819  39.507 -13.034 -15.804
    5    HG2  GLU 819           HG2      GLU 819  37.924 -14.244 -17.194
    6    HG3  GLU 819           HG3      GLU 819  37.598 -12.768 -18.107

  No H/Q in entry =           6
  In of MODEL   17
    1    H    ALA 820           H        ALA 820  38.793 -14.002 -14.104
    2    HA   ALA 820           HA       ALA 820  37.038 -16.085 -14.347
    3    HB3  ALA 820           HB1      ALA 820  38.878 -15.507 -12.039
    4    HB1  ALA 820           HB2      ALA 820  39.296 -16.359 -13.529
    5    HB2  ALA 820           HB3      ALA 820  38.152 -17.071 -12.395

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLY 821           H        GLY 821  37.245 -13.589 -11.847
    2    HA3  GLY 821           HA2      GLY 821  35.338 -14.569 -10.058
    3    HA2  GLY 821           HA3      GLY 821  35.845 -12.895 -10.203

  No H/Q in entry =           3
  In of MODEL   17
    1    H    ALA 822           H        ALA 822  35.002 -12.368 -12.819
    2    HA   ALA 822           HA       ALA 822  32.274 -11.814 -12.363
    3    HB1  ALA 822           HB1      ALA 822  33.763 -11.664 -14.985
    4    HB2  ALA 822           HB2      ALA 822  33.766 -10.407 -13.746
    5    HB3  ALA 822           HB3      ALA 822  32.247 -10.859 -14.534

  No H/Q in entry =           5
  In of MODEL   17
    1    H    LEU 823           H        LEU 823  33.926 -14.152 -14.401
    2    HA   LEU 823           HA       LEU 823  31.585 -15.251 -15.447
    3    HB2  LEU 823           HB2      LEU 823  34.341 -16.416 -15.126
    4    HB3  LEU 823           HB3      LEU 823  33.029 -17.428 -15.683
    5    HG   LEU 823           HG       LEU 823  34.255 -16.745 -17.592
    6   HD12  LEU 823          HD11      LEU 823  31.764 -15.079 -17.491
    7   HD11  LEU 823          HD12      LEU 823  31.887 -16.779 -17.938
    8   HD13  LEU 823          HD13      LEU 823  32.651 -15.545 -18.940
    9   HD23  LEU 823          HD21      LEU 823  33.939 -13.880 -16.712
   10   HD22  LEU 823          HD22      LEU 823  34.653 -14.414 -18.233
   11   HD21  LEU 823          HD23      LEU 823  35.440 -14.805 -16.707

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ARG 824           H        ARG 824  33.305 -16.059 -12.466
    2    HA   ARG 824           HA       ARG 824  31.681 -18.244 -11.648
    3    HB2  ARG 824           HB2      ARG 824  32.862 -16.139  -9.808
    4    HB3  ARG 824           HB3      ARG 824  32.270 -17.713  -9.333
    5    HG2  ARG 824           HG2      ARG 824  34.112 -18.716 -10.686
    6    HG3  ARG 824           HG3      ARG 824  34.747 -17.077 -10.907
    7    HD2  ARG 824           HD2      ARG 824  34.311 -18.556  -8.335
    8    HD3  ARG 824           HD3      ARG 824  35.858 -18.173  -9.066
    9    HE   ARG 824           HE       ARG 824  35.056 -15.752  -8.740
   10   HH11  ARG 824          HH11      ARG 824  34.272 -18.371  -6.458
   11   HH12  ARG 824          HH12      ARG 824  34.375 -17.419  -5.066
   12   HH21  ARG 824          HH21      ARG 824  35.200 -14.378  -6.746
   13   HH22  ARG 824          HH22      ARG 824  34.938 -15.067  -5.232

  No H/Q in entry =          13
  In of MODEL   17
    1    H    CYS 825           H        CYS 825  31.436 -14.841 -10.956
    2    HA   CYS 825           HA       CYS 825  29.228 -14.863  -9.296
    3    HB2  CYS 825           HB2      CYS 825  30.927 -13.002  -9.760
    4    HB3  CYS 825           HB3      CYS 825  29.972 -12.644 -11.174

  No H/Q in entry =           4
  In of MODEL   17
    1    H    ARG 826           H        ARG 826  29.426 -14.411 -12.824
    2    HA   ARG 826           HA       ARG 826  26.677 -13.807 -13.073
    3    HB2  ARG 826           HB2      ARG 826  27.001 -13.973 -15.496
    4    HB3  ARG 826           HB3      ARG 826  28.162 -12.873 -14.725
    5    HG2  ARG 826           HG2      ARG 826  29.513 -13.940 -16.196
    6    HG3  ARG 826           HG3      ARG 826  29.593 -15.114 -14.883
    7    HD2  ARG 826           HD2      ARG 826  29.228 -16.173 -17.025
    8    HD3  ARG 826           HD3      ARG 826  27.843 -16.447 -15.953
    9    HE   ARG 826           HE       ARG 826  27.137 -14.273 -17.338
   10   HH11  ARG 826          HH11      ARG 826  27.958 -17.584 -18.318
   11   HH12  ARG 826          HH12      ARG 826  27.456 -17.408 -19.918
   12   HH21  ARG 826          HH21      ARG 826  26.331 -14.035 -19.531
   13   HH22  ARG 826          HH22      ARG 826  26.538 -15.309 -20.639

  No H/Q in entry =          13
  In of MODEL   17
    1    H    GLY 827           H        GLY 827  28.249 -16.818 -12.881
    2    HA3  GLY 827           HA2      GLY 827  26.590 -18.631 -12.478
    3    HA2  GLY 827           HA3      GLY 827  25.763 -17.991 -13.899

  No H/Q in entry =           3
  In of MODEL   17
    1    H    GLN 828           H        GLN 828  28.811 -17.670 -14.768
    2    HA   GLN 828           HA       GLN 828  28.795 -19.870 -16.568
    3    HB2  GLN 828           HB2      GLN 828  30.143 -17.864 -17.031
    4    HB3  GLN 828           HB3      GLN 828  31.158 -18.209 -15.638
    5    HG2  GLN 828           HG2      GLN 828  32.392 -18.880 -17.546
    6    HG3  GLN 828           HG3      GLN 828  31.782 -20.360 -16.813
    7   HE21  GLN 828          HE21      GLN 828  29.992 -18.071 -18.865
    8   HE22  GLN 828          HE22      GLN 828  29.692 -19.220 -20.105

  No H/Q in entry =           8
  In of MODEL   17
    1    H    SER 829           H        SER 829  29.804 -21.854 -16.468
    2    HA   SER 829           HA       SER 829  30.480 -22.760 -13.803
    3    HB2  SER 829           HB2      SER 829  28.942 -24.087 -15.100
    4    HB3  SER 829           HB3      SER 829  30.132 -24.278 -16.393
    5    HG   SER 829           HG       SER 829  30.180 -25.291 -13.750

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ILE 830           H        ILE 830  32.409 -22.411 -13.181
    2    HA   ILE 830           HA       ILE 830  34.498 -23.405 -14.856
    3    HB   ILE 830           HB       ILE 830  36.060 -21.564 -14.341
    4   HG12  ILE 830          HG12      ILE 830  34.879 -20.796 -12.236
    5   HG13  ILE 830          HG13      ILE 830  35.453 -19.489 -13.242
    6   HG23  ILE 830          HG21      ILE 830  34.980 -21.438 -16.444
    7   HG22  ILE 830          HG22      ILE 830  35.068 -19.790 -15.791
    8   HG21  ILE 830          HG23      ILE 830  33.558 -20.715 -15.707
    9   HD12  ILE 830          HD11      ILE 830  32.640 -20.483 -12.915
   10   HD11  ILE 830          HD12      ILE 830  33.131 -19.337 -14.155
   11   HD13  ILE 830          HD13      ILE 830  33.314 -18.912 -12.457

  No H/Q in entry =          11
  In of MODEL   17
    1    H    SER 831           H        SER 831  36.463 -23.895 -13.595
    2    HA   SER 831           HA       SER 831  35.925 -24.213 -10.734
    3    HB2  SER 831           HB2      SER 831  37.114 -26.120 -12.706
    4    HB3  SER 831           HB3      SER 831  37.049 -26.367 -10.965
    5    HG   SER 831           HG       SER 831  35.186 -26.740 -12.898

  No H/Q in entry =           5
  In of MODEL   17
    1    H    VAL 832           H        VAL 832  37.452 -22.740  -9.889
    2    HA   VAL 832           HA       VAL 832  39.954 -22.379 -11.196
    3    HB   VAL 832           HB       VAL 832  39.104 -20.495  -9.897
    4   HG12  VAL 832          HG11      VAL 832  39.076 -20.483  -7.435
    5   HG11  VAL 832          HG12      VAL 832  39.373 -22.226  -7.450
    6   HG13  VAL 832          HG13      VAL 832  37.888 -21.572  -8.143
    7   HG22  VAL 832          HG21      VAL 832  41.506 -20.602 -10.146
    8   HG21  VAL 832          HG22      VAL 832  41.640 -21.578  -8.685
    9   HG23  VAL 832          HG23      VAL 832  41.099 -19.904  -8.578

  No H/Q in entry =           9
  In of MODEL   17
    1    H    THR 833           H        THR 833  41.497 -23.785 -11.310
    2    HA   THR 833           HA       THR 833  41.486 -25.961  -9.454
    3    HB   THR 833           HB       THR 833  43.310 -26.837 -10.994
    4    HG1  THR 833           HG1      THR 833  43.436 -25.795 -12.996
    5   HG23  THR 833          HG21      THR 833  40.985 -27.551 -11.141
    6   HG22  THR 833          HG22      THR 833  41.683 -27.396 -12.757
    7   HG21  THR 833          HG23      THR 833  40.610 -26.143 -12.131

  No H/Q in entry =           7
  In of MODEL   17
    1    H    SER 834           H        SER 834  43.451 -23.199 -10.174
    2    HA   SER 834           HA       SER 834  44.755 -23.458  -7.632
    3    HB2  SER 834           HB2      SER 834  46.369 -23.561 -10.187
    4    HB3  SER 834           HB3      SER 834  47.051 -23.266  -8.592
    5    HG   SER 834           HG       SER 834  45.448 -25.473  -8.725

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ILE 835           H        ILE 835  45.599 -21.505  -6.931
    2    HA   ILE 835           HA       ILE 835  44.601 -19.236  -8.333
    3    HB   ILE 835           HB       ILE 835  45.484 -17.886  -6.438
    4   HG12  ILE 835          HG12      ILE 835  46.094 -19.315  -4.350
    5   HG13  ILE 835          HG13      ILE 835  46.543 -20.551  -5.514
    6   HG23  ILE 835          HG21      ILE 835  43.257 -18.739  -6.396
    7   HG22  ILE 835          HG22      ILE 835  43.965 -18.804  -4.768
    8   HG21  ILE 835          HG23      ILE 835  43.839 -20.274  -5.745
    9   HD13  ILE 835          HD11      ILE 835  48.183 -19.041  -6.476
   10   HD12  ILE 835          HD12      ILE 835  48.456 -19.261  -4.736
   11   HD11  ILE 835          HD13      ILE 835  47.672 -17.793  -5.344

  No H/Q in entry =          11
  In of MODEL   17
    1    H    ARG 836           H        ARG 836  47.174 -20.995  -8.841
    2    HA   ARG 836           HA       ARG 836  49.151 -18.935  -9.358
    3    HB2  ARG 836           HB2      ARG 836  49.168 -21.875 -10.032
    4    HB3  ARG 836           HB3      ARG 836  50.538 -20.778 -10.097
    5    HG2  ARG 836           HG2      ARG 836  50.523 -20.548  -7.710
    6    HG3  ARG 836           HG3      ARG 836  49.054 -21.524  -7.597
    7    HD2  ARG 836           HD2      ARG 836  50.273 -23.349  -8.707
    8    HD3  ARG 836           HD3      ARG 836  51.751 -22.397  -8.571
    9    HE   ARG 836           HE       ARG 836  51.511 -22.492  -6.170
   10   HH11  ARG 836          HH11      ARG 836  49.755 -24.968  -8.062
   11   HH12  ARG 836          HH12      ARG 836  49.539 -25.994  -6.747
   12   HH21  ARG 836          HH21      ARG 836  51.145 -23.962  -4.348
   13   HH22  ARG 836          HH22      ARG 836  50.304 -25.411  -4.586

  No H/Q in entry =          13
  In of MODEL   17
    1    HA   PRO 837           HA       PRO 837  47.532 -18.606 -13.507
    2    HB2  PRO 837           HB2      PRO 837  49.677 -17.474 -14.735
    3    HB3  PRO 837           HB3      PRO 837  48.595 -16.561 -13.682
    4    HG2  PRO 837           HG2      PRO 837  51.285 -17.718 -13.087
    5    HG3  PRO 837           HG3      PRO 837  50.600 -16.160 -12.587
    6    HD2  PRO 837           HD2      PRO 837  50.723 -18.342 -10.953
    7    HD3  PRO 837           HD3      PRO 837  49.470 -17.093 -10.817

  No H/Q in entry =           7
  In of MODEL   17
    1    H    CYS 838           H        CYS 838  47.547 -19.978 -15.252
    2    HA   CYS 838           HA       CYS 838  49.692 -21.887 -15.323
    3    HB2  CYS 838           HB2      CYS 838  46.926 -21.837 -16.495
    4    HB3  CYS 838           HB3      CYS 838  48.121 -22.910 -17.201

  No H/Q in entry =           4
  In of MODEL   17
    1    H    ALA 839           H        ALA 839  50.248 -22.485 -17.803
    2    HA   ALA 839           HA       ALA 839  51.081 -19.996 -19.038
    3    HB1  ALA 839           HB1      ALA 839  51.672 -22.876 -19.741
    4    HB2  ALA 839           HB2      ALA 839  52.699 -21.807 -18.786
    5    HB3  ALA 839           HB3      ALA 839  52.416 -21.466 -20.493

  No H/Q in entry =           5
  In of MODEL   17
    1    H    ALA 840           H        ALA 840  48.260 -20.834 -19.024
    2    HA   ALA 840           HA       ALA 840  47.821 -21.081 -21.900
    3    HB3  ALA 840           HB1      ALA 840  46.028 -22.058 -19.694
    4    HB2  ALA 840           HB2      ALA 840  47.035 -23.071 -20.735
    5    HB1  ALA 840           HB3      ALA 840  45.690 -22.154 -21.415

  No H/Q in entry =           5
  In of MODEL   17
    1    H    GLU 841           H        GLU 841  48.112 -18.793 -21.844
    2    HA   GLU 841           HA       GLU 841  45.556 -17.525 -21.403
    3    HB2  GLU 841           HB2      GLU 841  46.901 -15.343 -21.020
    4    HB3  GLU 841           HB3      GLU 841  46.791 -16.465 -19.684
    5    HG2  GLU 841           HG2      GLU 841  49.050 -17.296 -20.259
    6    HG3  GLU 841           HG3      GLU 841  49.137 -16.076 -21.527

  No H/Q in entry =           6
  In of MODEL   17
    1    H    THR 842           H        THR 842  44.730 -17.276 -23.224
    2    HA   THR 842           HA       THR 842  46.147 -17.704 -25.593
    3    HB   THR 842           HB       THR 842  43.388 -16.642 -25.334
    4    HG1  THR 842           HG1      THR 842  44.554 -19.160 -24.739
    5   HG23  THR 842          HG21      THR 842  43.012 -18.000 -27.384
    6   HG22  THR 842          HG22      THR 842  44.709 -18.478 -27.357
    7   HG21  THR 842          HG23      THR 842  44.275 -16.792 -27.623

  No H/Q in entry =           7
  In of MODEL   17
    1    H    GLN 843           H        GLN 843  47.587 -16.202 -25.923
    2    HA   GLN 843           HA       GLN 843  46.866 -14.080 -27.602
    3    HB2  GLN 843           HB2      GLN 843  46.841 -13.185 -25.068
    4    HB3  GLN 843           HB3      GLN 843  48.583 -13.227 -25.273
    5    HG2  GLN 843           HG2      GLN 843  46.652 -11.646 -26.976
    6    HG3  GLN 843           HG3      GLN 843  47.619 -11.022 -25.653
    7   HE21  GLN 843          HE21      GLN 843  50.041 -12.445 -26.434
    8   HE22  GLN 843          HE22      GLN 843  50.621 -11.687 -27.861

  No H/Q in entry =           8
  In of MODEL   18
    1    H1   GLY 689           H2       GLY 689  82.829  14.364 -15.441
    2    H2   GLY 689           H1       GLY 689  83.206  16.005 -15.217
    3    H3   GLY 689           H3       GLY 689  81.857  15.293 -14.478
    4    HA2  GLY 689           HA2      GLY 689  82.222  15.613 -17.392
    5    HA3  GLY 689           HA3      GLY 689  81.143  16.583 -16.390

  No H/Q in entry =           5
  In of MODEL   18
    1    H    SER 690           H        SER 690  79.101  15.981 -16.524
    2    HA   SER 690           HA       SER 690  77.208  14.750 -16.619
    3    HB2  SER 690           HB2      SER 690  78.951  12.560 -17.820
    4    HB3  SER 690           HB3      SER 690  77.193  12.638 -17.896
    5    HG   SER 690           HG       SER 690  78.473  14.889 -18.841

  No H/Q in entry =           5
  In of MODEL   18
    1    H    HIS 691           H        HIS 691  76.525  12.201 -15.943
    2    HA   HIS 691           HA       HIS 691  77.671  11.913 -13.301
    3    HB2  HIS 691           HB2      HIS 691  75.329  10.528 -14.640
    4    HB3  HIS 691           HB3      HIS 691  75.934  10.080 -13.061
    5    HD1  HIS 691           HD1      HIS 691  75.142  11.443 -11.084
    6    HD2  HIS 691           HD2      HIS 691  74.114  13.155 -14.722
    7    HE1  HIS 691           HE1      HIS 691  73.608  13.329 -10.532
    8    HE2  HIS 691           HE2      HIS 691  73.281  14.511 -12.728

  No H/Q in entry =           8
  In of MODEL   18
    1    H    MET 692           H        MET 692  78.971  10.246 -12.741
    2    HA   MET 692           HA       MET 692  80.441   9.021 -14.788
    3    HB2  MET 692           HB2      MET 692  81.339   9.474 -12.537
    4    HB3  MET 692           HB3      MET 692  80.321   8.205 -11.877
    5    HG2  MET 692           HG2      MET 692  82.593   7.415 -12.163
    6    HG3  MET 692           HG3      MET 692  81.507   6.559 -13.255
    7    HE1  MET 692           HE1      MET 692  83.650   5.714 -14.593
    8    HE3  MET 692           HE2      MET 692  84.709   6.631 -13.521
    9    HE2  MET 692           HE3      MET 692  84.872   6.792 -15.267

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ASN 693           H        ASN 693  77.734   7.858 -12.917
    2    HA   ASN 693           HA       ASN 693  77.625   5.745 -14.881
    3    HB2  ASN 693           HB2      ASN 693  76.222   4.376 -13.329
    4    HB3  ASN 693           HB3      ASN 693  77.883   4.563 -12.817
    5   HD21  ASN 693          HD21      ASN 693  77.304   3.943 -10.765
    6   HD22  ASN 693          HD22      ASN 693  76.479   4.959  -9.651

  No H/Q in entry =           6
  In of MODEL   18
    1    HA   PRO 694           HA       PRO 694  74.011   7.823 -16.320
    2    HB2  PRO 694           HB2      PRO 694  73.402   5.226 -17.604
    3    HB3  PRO 694           HB3      PRO 694  73.605   6.813 -18.347
    4    HG2  PRO 694           HG2      PRO 694  75.459   4.895 -18.608
    5    HG3  PRO 694           HG3      PRO 694  75.903   6.605 -18.477
    6    HD2  PRO 694           HD2      PRO 694  76.043   4.447 -16.416
    7    HD3  PRO 694           HD3      PRO 694  77.147   5.803 -16.746

  No H/Q in entry =           7
  In of MODEL   18
    1    H    LEU 695           H        LEU 695  72.550   8.054 -14.774
    2    HA   LEU 695           HA       LEU 695  71.527   5.920 -13.207
    3    HB2  LEU 695           HB2      LEU 695  70.515   8.747 -13.514
    4    HB3  LEU 695           HB3      LEU 695  70.011   7.621 -12.270
    5    HG   LEU 695           HG       LEU 695  72.774   8.788 -12.594
    6   HD13  LEU 695          HD11      LEU 695  72.272   9.959 -10.513
    7   HD12  LEU 695          HD12      LEU 695  70.645   9.278 -10.520
    8   HD11  LEU 695          HD13      LEU 695  71.134  10.402 -11.787
    9   HD23  LEU 695          HD21      LEU 695  73.259   7.704 -10.454
   10   HD22  LEU 695          HD22      LEU 695  72.876   6.519 -11.693
   11   HD21  LEU 695          HD23      LEU 695  71.673   6.943 -10.471

  No H/Q in entry =          11
  In of MODEL   18
    1    H    THR 696           H        THR 696  70.349   4.440 -14.075
    2    HA   THR 696           HA       THR 696  68.350   5.139 -16.104
    3    HB   THR 696           HB       THR 696  69.607   2.446 -15.531
    4    HG1  THR 696           HG1      THR 696  71.105   4.175 -16.169
    5   HG23  THR 696          HG21      THR 696  68.863   1.938 -17.825
    6   HG22  THR 696          HG22      THR 696  68.193   3.564 -17.968
    7   HG21  THR 696          HG23      THR 696  67.498   2.422 -16.816

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLN 697           H        GLN 697  66.220   4.463 -15.689
    2    HA   GLN 697           HA       GLN 697  65.743   3.526 -12.999
    3    HB2  GLN 697           HB2      GLN 697  63.890   4.670 -15.084
    4    HB3  GLN 697           HB3      GLN 697  63.284   3.916 -13.623
    5    HG2  GLN 697           HG2      GLN 697  63.301   6.294 -13.332
    6    HG3  GLN 697           HG3      GLN 697  64.520   5.588 -12.288
    7   HE21  GLN 697          HE21      GLN 697  63.928   7.527 -15.071
    8   HE22  GLN 697          HE22      GLN 697  65.510   8.193 -15.226

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ALA 698           H        ALA 698  64.709   1.700 -12.466
    2    HA   ALA 698           HA       ALA 698  65.037  -0.551 -14.235
    3    HB3  ALA 698           HB1      ALA 698  65.379  -0.703 -11.781
    4    HB2  ALA 698           HB2      ALA 698  64.184  -1.853 -12.396
    5    HB1  ALA 698           HB3      ALA 698  63.653  -0.394 -11.565

  No H/Q in entry =           5
  In of MODEL   18
    1    H    VAL 699           H        VAL 699  63.522  -1.953 -14.967
    2    HA   VAL 699           HA       VAL 699  61.155  -0.587 -15.740
    3    HB   VAL 699           HB       VAL 699  61.003  -2.361 -17.377
    4   HG12  VAL 699          HG11      VAL 699  63.660  -0.936 -17.340
    5   HG11  VAL 699          HG12      VAL 699  62.141  -0.306 -17.972
    6   HG13  VAL 699          HG13      VAL 699  62.936  -1.662 -18.775
    7   HG22  VAL 699          HG21      VAL 699  62.901  -3.897 -17.794
    8   HG21  VAL 699          HG22      VAL 699  62.136  -4.184 -16.229
    9   HG23  VAL 699          HG23      VAL 699  63.662  -3.305 -16.320

  No H/Q in entry =           9
  In of MODEL   18
    1    HA   PRO 700           HA       PRO 700  58.761  -3.282 -13.090
    2    HB2  PRO 700           HB2      PRO 700  56.569  -3.100 -14.942
    3    HB3  PRO 700           HB3      PRO 700  56.684  -2.479 -13.291
    4    HG2  PRO 700           HG2      PRO 700  56.643  -0.824 -15.463
    5    HG3  PRO 700           HG3      PRO 700  57.515  -0.428 -13.973
    6    HD2  PRO 700           HD2      PRO 700  58.577  -1.480 -16.566
    7    HD3  PRO 700           HD3      PRO 700  59.270  -0.288 -15.437

  No H/Q in entry =           7
  In of MODEL   18
    1    H    LYS 701           H        LYS 701  59.125  -5.220 -13.109
    2    HA   LYS 701           HA       LYS 701  58.234  -7.017 -15.206
    3    HB2  LYS 701           HB2      LYS 701  60.557  -8.234 -14.976
    4    HB3  LYS 701           HB3      LYS 701  60.363  -6.903 -16.093
    5    HG2  LYS 701           HG2      LYS 701  62.478  -6.804 -14.914
    6    HG3  LYS 701           HG3      LYS 701  61.485  -5.401 -14.552
    7    HD2  LYS 701           HD2      LYS 701  60.879  -6.370 -12.404
    8    HD3  LYS 701           HD3      LYS 701  61.809  -7.817 -12.773
    9    HE2  LYS 701           HE2      LYS 701  62.958  -5.025 -12.564
   10    HE3  LYS 701           HE3      LYS 701  62.983  -6.225 -11.275
   11    HZ1  LYS 701           HZ1      LYS 701  64.265  -6.547 -13.934
   12    HZ3  LYS 701           HZ2      LYS 701  64.330  -7.652 -12.652
   13    HZ2  LYS 701           HZ3      LYS 701  65.078  -6.163 -12.508

  No H/Q in entry =          13
  In of MODEL   18
    1    H    CYS 702           H        CYS 702  57.484  -6.398 -12.519
    2    HA   CYS 702           HA       CYS 702  58.177  -8.851 -11.044
    3    HB2  CYS 702           HB2      CYS 702  56.913  -6.340  -9.919
    4    HB3  CYS 702           HB3      CYS 702  57.703  -7.644  -9.046

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLN 703           H        GLN 703  56.382  -9.930  -9.928
    2    HA   GLN 703           HA       GLN 703  54.033 -10.050 -11.525
    3    HB2  GLN 703           HB2      GLN 703  55.018 -11.454  -9.110
    4    HB3  GLN 703           HB3      GLN 703  53.317 -11.586  -9.549
    5    HG2  GLN 703           HG2      GLN 703  55.619 -12.214 -11.362
    6    HG3  GLN 703           HG3      GLN 703  54.679 -13.410 -10.457
    7   HE21  GLN 703          HE21      GLN 703  55.008 -13.080 -13.294
    8   HE22  GLN 703          HE22      GLN 703  53.426 -12.920 -13.965

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ARG 704           H        ARG 704  51.914 -10.369 -10.083
    2    HA   ARG 704           HA       ARG 704  51.327  -7.631  -9.412
    3    HB2  ARG 704           HB2      ARG 704  49.467 -10.013  -9.292
    4    HB3  ARG 704           HB3      ARG 704  48.978  -8.360  -9.001
    5    HG2  ARG 704           HG2      ARG 704  48.291  -8.763 -11.173
    6    HG3  ARG 704           HG3      ARG 704  49.809  -7.904 -11.389
    7    HD2  ARG 704           HD2      ARG 704  50.954 -10.077 -11.735
    8    HD3  ARG 704           HD3      ARG 704  49.413 -10.885 -11.522
    9    HE   ARG 704           HE       ARG 704  48.997  -9.041 -13.506
   10   HH11  ARG 704          HH11      ARG 704  51.173 -11.864 -13.170
   11   HH12  ARG 704          HH12      ARG 704  51.110 -12.266 -14.818
   12   HH21  ARG 704          HH21      ARG 704  48.990  -9.581 -15.766
   13   HH22  ARG 704          HH22      ARG 704  49.853 -10.945 -16.336

  No H/Q in entry =          13
  In of MODEL   18
    1    H    TRP 705           H        TRP 705  52.199 -10.371  -7.585
    2    HA   TRP 705           HA       TRP 705  51.283  -9.164  -5.080
    3    HB2  TRP 705           HB2      TRP 705  52.155 -11.300  -4.089
    4    HB3  TRP 705           HB3      TRP 705  50.835 -11.502  -5.228
    5    HD1  TRP 705           HD1      TRP 705  54.486 -12.376  -4.683
    6    HE1  TRP 705           HE1      TRP 705  55.209 -14.094  -6.455
    7    HE3  TRP 705           HE3      TRP 705  50.366 -12.263  -7.721
    8    HZ2  TRP 705           HZ2      TRP 705  54.185 -15.255  -8.793
    9    HZ3  TRP 705           HZ3      TRP 705  50.327 -13.701  -9.698
   10    HH2  TRP 705           HH2      TRP 705  52.197 -15.175 -10.222

  No H/Q in entry =          10
  In of MODEL   18
    1    H    GLU 706           H        GLU 706  53.643  -8.584  -7.107
    2    HA   GLU 706           HA       GLU 706  55.634  -8.087  -5.029
    3    HB2  GLU 706           HB2      GLU 706  56.131  -8.841  -7.922
    4    HB3  GLU 706           HB3      GLU 706  57.370  -8.422  -6.734
    5    HG2  GLU 706           HG2      GLU 706  56.736 -10.408  -5.444
    6    HG3  GLU 706           HG3      GLU 706  55.535 -10.802  -6.672

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LYS 707           H        LYS 707  56.737  -6.105  -5.271
    2    HA   LYS 707           HA       LYS 707  55.605  -4.277  -7.284
    3    HB2  LYS 707           HB2      LYS 707  56.473  -3.440  -4.505
    4    HB3  LYS 707           HB3      LYS 707  55.649  -2.457  -5.699
    5    HG2  LYS 707           HG2      LYS 707  54.488  -4.766  -4.141
    6    HG3  LYS 707           HG3      LYS 707  54.151  -3.060  -3.901
    7    HD2  LYS 707           HD2      LYS 707  53.453  -4.682  -6.359
    8    HD3  LYS 707           HD3      LYS 707  52.340  -4.240  -5.071
    9    HE2  LYS 707           HE2      LYS 707  52.649  -1.860  -5.641
   10    HE3  LYS 707           HE3      LYS 707  53.756  -2.328  -6.936
   11    HZ2  LYS 707           HZ1      LYS 707  50.881  -3.104  -6.780
   12    HZ1  LYS 707           HZ2      LYS 707  51.929  -3.550  -7.984
   13    HZ3  LYS 707           HZ3      LYS 707  51.507  -1.934  -7.808

  No H/Q in entry =          13
  In of MODEL   18
    1    H    LEU 708           H        LEU 708  57.127  -2.532  -7.860
    2    HA   LEU 708           HA       LEU 708  59.877  -3.514  -7.820
    3    HB2  LEU 708           HB2      LEU 708  58.870  -3.081 -10.007
    4    HB3  LEU 708           HB3      LEU 708  58.498  -1.440  -9.535
    5    HG   LEU 708           HG       LEU 708  60.982  -1.050  -9.331
    6   HD12  LEU 708          HD11      LEU 708  62.463  -2.559 -10.547
    7   HD11  LEU 708          HD12      LEU 708  61.126  -3.684 -10.774
    8   HD13  LEU 708          HD13      LEU 708  61.726  -3.345  -9.151
    9   HD23  LEU 708          HD21      LEU 708  59.889  -1.794 -12.039
   10   HD22  LEU 708          HD22      LEU 708  61.286  -0.763 -11.741
   11   HD21  LEU 708          HD23      LEU 708  59.682  -0.245 -11.224

  No H/Q in entry =          11
  In of MODEL   18
    1    H    GLN 709           H        GLN 709  61.016  -2.690  -6.169
    2    HA   GLN 709           HA       GLN 709  61.161   0.199  -5.865
    3    HB2  GLN 709           HB2      GLN 709  60.834   0.244  -3.518
    4    HB3  GLN 709           HB3      GLN 709  59.519  -0.759  -4.101
    5    HG2  GLN 709           HG2      GLN 709  60.714  -2.765  -3.437
    6    HG3  GLN 709           HG3      GLN 709  62.102  -1.796  -2.961
    7   HE21  GLN 709          HE21      GLN 709  62.050  -2.542  -0.880
    8   HE22  GLN 709          HE22      GLN 709  60.843  -2.082   0.262

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ASN 710           H        ASN 710  63.196   0.803  -4.995
    2    HA   ASN 710           HA       ASN 710  65.474   0.620  -4.629
    3    HB2  ASN 710           HB2      ASN 710  64.395  -0.771  -2.698
    4    HB3  ASN 710           HB3      ASN 710  64.893  -2.177  -3.616
    5   HD21  ASN 710          HD21      ASN 710  65.887   0.463  -1.712
    6   HD22  ASN 710          HD22      ASN 710  67.525  -0.009  -1.433

  No H/Q in entry =           6
  In of MODEL   18
    1    H    SER 711           H        SER 711  64.220  -0.199  -7.018
    2    HA   SER 711           HA       SER 711  64.570  -0.965  -9.029
    3    HB2  SER 711           HB2      SER 711  66.938  -1.123  -9.868
    4    HB3  SER 711           HB3      SER 711  66.573   0.321  -8.921
    5    HG   SER 711           HG       SER 711  67.449  -1.465  -7.229

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ARG 712           H        ARG 712  64.002  -2.917  -6.871
    2    HA   ARG 712           HA       ARG 712  64.602  -5.320  -8.436
    3    HB2  ARG 712           HB2      ARG 712  64.830  -6.624  -6.370
    4    HB3  ARG 712           HB3      ARG 712  66.080  -5.387  -6.460
    5    HG2  ARG 712           HG2      ARG 712  65.044  -4.116  -4.766
    6    HG3  ARG 712           HG3      ARG 712  63.531  -4.999  -4.931
    7    HD2  ARG 712           HD2      ARG 712  66.104  -6.262  -4.019
    8    HD3  ARG 712           HD3      ARG 712  64.865  -5.654  -2.913
    9    HE   ARG 712           HE       ARG 712  63.569  -7.386  -4.646
   10   HH11  ARG 712          HH11      ARG 712  66.211  -7.776  -2.321
   11   HH12  ARG 712          HH12      ARG 712  65.759  -9.353  -1.870
   12   HH21  ARG 712          HH21      ARG 712  63.010  -9.556  -4.108
   13   HH22  ARG 712          HH22      ARG 712  63.916 -10.405  -2.945

  No H/Q in entry =          13
  In of MODEL   18
    1    H    CYS 713           H        CYS 713  63.118  -7.143  -7.500
    2    HA   CYS 713           HA       CYS 713  60.439  -6.014  -7.229
    3    HB2  CYS 713           HB2      CYS 713  61.328  -8.842  -7.864
    4    HB3  CYS 713           HB3      CYS 713  59.658  -8.298  -7.777

  No H/Q in entry =           4
  In of MODEL   18
    1    H    VAL 714           H        VAL 714  59.507  -6.064  -5.337
    2    HA   VAL 714           HA       VAL 714  60.479  -7.959  -3.329
    3    HB   VAL 714           HB       VAL 714  59.893  -6.330  -1.578
    4   HG12  VAL 714          HG11      VAL 714  61.677  -4.687  -1.957
    5   HG11  VAL 714          HG12      VAL 714  61.747  -5.181  -3.650
    6   HG13  VAL 714          HG13      VAL 714  62.172  -6.328  -2.383
    7   HG22  VAL 714          HG21      VAL 714  59.323  -4.005  -2.142
    8   HG21  VAL 714          HG22      VAL 714  58.111  -5.134  -2.754
    9   HG23  VAL 714          HG23      VAL 714  59.303  -4.437  -3.853

  No H/Q in entry =           9
  In of MODEL   18
    1    H    CYS 715           H        CYS 715  58.626  -8.294  -1.674
    2    HA   CYS 715           HA       CYS 715  56.250  -8.739  -3.280
    3    HB2  CYS 715           HB2      CYS 715  56.989  -9.609  -0.499
    4    HB3  CYS 715           HB3      CYS 715  55.401  -9.891  -1.200

  No H/Q in entry =           4
  In of MODEL   18
    1    H    LYS 716           H        LYS 716  54.196  -8.098  -2.621
    2    HA   LYS 716           HA       LYS 716  54.052  -5.436  -1.596
    3    HB2  LYS 716           HB2      LYS 716  52.546  -6.625  -3.329
    4    HB3  LYS 716           HB3      LYS 716  51.773  -7.393  -1.958
    5    HG2  LYS 716           HG2      LYS 716  51.065  -5.194  -1.127
    6    HG3  LYS 716           HG3      LYS 716  51.873  -4.423  -2.497
    7    HD2  LYS 716           HD2      LYS 716  50.427  -5.923  -3.974
    8    HD3  LYS 716           HD3      LYS 716  49.491  -6.253  -2.521
    9    HE2  LYS 716           HE2      LYS 716  50.049  -3.509  -3.560
   10    HE3  LYS 716           HE3      LYS 716  48.594  -4.414  -4.010
   11    HZ3  LYS 716           HZ1      LYS 716  48.066  -2.920  -2.314
   12    HZ2  LYS 716           HZ2      LYS 716  49.384  -3.262  -1.391
   13    HZ1  LYS 716           HZ3      LYS 716  48.102  -4.397  -1.520

  No H/Q in entry =          13
  In of MODEL   18
    1    H    MET 717           H        MET 717  52.397  -5.086   0.300
    2    HA   MET 717           HA       MET 717  53.339  -6.812   2.434
    3    HB2  MET 717           HB2      MET 717  51.676  -4.303   2.499
    4    HB3  MET 717           HB3      MET 717  52.170  -5.175   3.939
    5    HG2  MET 717           HG2      MET 717  54.196  -4.120   1.986
    6    HG3  MET 717           HG3      MET 717  53.473  -3.071   3.190
    7    HE2  MET 717           HE1      MET 717  56.319  -6.614   4.179
    8    HE1  MET 717           HE2      MET 717  55.670  -6.288   2.565
    9    HE3  MET 717           HE3      MET 717  54.640  -6.961   3.833

  No H/Q in entry =           9
  In of MODEL   18
    1    HA   PRO 718           HA       PRO 718  49.814  -9.440   2.285
    2    HB2  PRO 718           HB2      PRO 718  49.771 -10.312   4.899
    3    HB3  PRO 718           HB3      PRO 718  50.862 -10.940   3.662
    4    HG2  PRO 718           HG2      PRO 718  51.383  -8.900   5.784
    5    HG3  PRO 718           HG3      PRO 718  52.425 -10.212   5.207
    6    HD2  PRO 718           HD2      PRO 718  52.781  -7.653   4.459
    7    HD3  PRO 718           HD3      PRO 718  53.119  -9.008   3.357

  No H/Q in entry =           7
  In of MODEL   18
    1    H    TYR 719           H        TYR 719  50.010  -6.934   4.636
    2    HA   TYR 719           HA       TYR 719  47.202  -7.112   5.313
    3    HB2  TYR 719           HB2      TYR 719  47.692  -5.187   6.826
    4    HB3  TYR 719           HB3      TYR 719  48.666  -6.612   7.146
    5    HD1  TYR 719           HD1      TYR 719  48.680  -3.132   6.115
    6    HD2  TYR 719           HD2      TYR 719  51.079  -6.616   6.548
    7    HE1  TYR 719           HE1      TYR 719  50.695  -1.746   6.010
    8    HE2  TYR 719           HE2      TYR 719  53.105  -5.239   6.457
    9    HH   TYR 719           HH       TYR 719  53.830  -3.083   5.635

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLU 720           H        GLU 720  48.861  -5.935   2.814
    2    HA   GLU 720           HA       GLU 720  47.183  -3.604   2.324
    3    HB2  GLU 720           HB2      GLU 720  49.558  -4.831   1.058
    4    HB3  GLU 720           HB3      GLU 720  48.530  -3.770   0.108
    5    HG2  GLU 720           HG2      GLU 720  48.988  -2.003   1.775
    6    HG3  GLU 720           HG3      GLU 720  50.158  -3.084   2.544

  No H/Q in entry =           6
  In of MODEL   18
    1    H    CYS 721           H        CYS 721  46.529  -6.628   2.302
    2    HA   CYS 721           HA       CYS 721  45.834  -7.084  -0.446
    3    HB2  CYS 721           HB2      CYS 721  46.658  -8.896   1.006
    4    HB3  CYS 721           HB3      CYS 721  45.183  -8.756   1.989

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLY 722           H        GLY 722  43.681  -7.375  -1.199
    2    HA3  GLY 722           HA2      GLY 722  41.465  -6.730   0.509
    3    HA2  GLY 722           HA3      GLY 722  41.852  -5.472  -0.656

  No H/Q in entry =           3
  In of MODEL   18
    1    HA   PRO 723           HA       PRO 723  39.170  -7.470  -3.487
    2    HB2  PRO 723           HB2      PRO 723  40.155  -6.588  -5.865
    3    HB3  PRO 723           HB3      PRO 723  39.265  -5.552  -4.742
    4    HG2  PRO 723           HG2      PRO 723  42.214  -5.815  -5.162
    5    HG3  PRO 723           HG3      PRO 723  41.244  -4.347  -4.944
    6    HD2  PRO 723           HD2      PRO 723  42.691  -5.448  -2.938
    7    HD3  PRO 723           HD3      PRO 723  41.161  -4.593  -2.656

  No H/Q in entry =           7
  In of MODEL   18
    1    H    SER 724           H        SER 724  39.312  -9.648  -3.519
    2    HA   SER 724           HA       SER 724  40.571 -11.114  -5.668
    3    HB2  SER 724           HB2      SER 724  41.846 -11.096  -2.994
    4    HB3  SER 724           HB3      SER 724  41.741 -12.595  -3.920
    5    HG   SER 724           HG       SER 724  42.530 -11.007  -5.688

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU 725           H        LEU 725  40.020 -13.030  -5.886
    2    HA   LEU 725           HA       LEU 725  37.572 -14.014  -5.022
    3    HB2  LEU 725           HB2      LEU 725  39.879 -15.125  -6.445
    4    HB3  LEU 725           HB3      LEU 725  38.675 -16.246  -5.852
    5    HG   LEU 725           HG       LEU 725  38.282 -15.649  -8.112
    6   HD11  LEU 725          HD11      LEU 725  36.348 -16.182  -6.804
    7   HD13  LEU 725          HD12      LEU 725  35.978 -14.988  -8.045
    8   HD12  LEU 725          HD13      LEU 725  36.152 -14.482  -6.367
    9   HD23  LEU 725          HD21      LEU 725  37.820 -12.850  -7.273
   10   HD22  LEU 725          HD22      LEU 725  37.802 -13.491  -8.926
   11   HD21  LEU 725          HD23      LEU 725  39.296 -13.429  -7.980

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ASP 726           H        ASP 726  37.036 -15.106  -3.234
    2    HA   ASP 726           HA       ASP 726  39.000 -15.634  -1.164
    3    HB2  ASP 726           HB2      ASP 726  36.033 -16.260  -1.172
    4    HB3  ASP 726           HB3      ASP 726  37.094 -16.295   0.223

  No H/Q in entry =           4
  In of MODEL   18
    1    H    VAL 727           H        VAL 727  39.947 -17.509  -0.677
    2    HA   VAL 727           HA       VAL 727  38.943 -19.960  -1.952
    3    HB   VAL 727           HB       VAL 727  41.241 -20.612  -2.639
    4   HG11  VAL 727          HG11      VAL 727  39.734 -19.657  -4.300
    5   HG13  VAL 727          HG12      VAL 727  41.400 -19.173  -4.623
    6   HG12  VAL 727          HG13      VAL 727  40.279 -18.036  -3.878
    7   HG21  VAL 727          HG21      VAL 727  42.503 -19.198  -1.097
    8   HG23  VAL 727          HG22      VAL 727  41.964 -17.753  -1.955
    9   HG22  VAL 727          HG23      VAL 727  43.017 -18.919  -2.757

  No H/Q in entry =           9
  In of MODEL   18
    1    H    CYS 728           H        CYS 728  40.141 -21.934  -1.132
    2    HA   CYS 728           HA       CYS 728  40.590 -21.659   1.739
    3    HB2  CYS 728           HB2      CYS 728  39.968 -24.064   0.033
    4    HB3  CYS 728           HB3      CYS 728  40.268 -24.138   1.769

  No H/Q in entry =           4
  In of MODEL   18
    1    H    ALA 729           H        ALA 729  42.523 -22.116   2.622
    2    HA   ALA 729           HA       ALA 729  44.478 -23.512   0.981
    3    HB2  ALA 729           HB1      ALA 729  46.205 -21.954   1.690
    4    HB1  ALA 729           HB2      ALA 729  45.001 -21.004   2.557
    5    HB3  ALA 729           HB3      ALA 729  44.938 -21.113   0.795

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLN 730           H        GLN 730  46.081 -24.508   2.254
    2    HA   GLN 730           HA       GLN 730  45.147 -25.028   4.970
    3    HB2  GLN 730           HB2      GLN 730  45.055 -26.992   3.457
    4    HB3  GLN 730           HB3      GLN 730  46.773 -26.817   3.175
    5    HG2  GLN 730           HG2      GLN 730  47.269 -27.249   5.470
    6    HG3  GLN 730           HG3      GLN 730  45.562 -27.317   5.879
    7   HE21  GLN 730          HE21      GLN 730  45.665 -29.393   6.644
    8   HE22  GLN 730          HE22      GLN 730  45.946 -30.754   5.631

  No H/Q in entry =           8
  In of MODEL   18
    1    H    ASP 731           H        ASP 731  46.415 -24.626   6.525
    2    HA   ASP 731           HA       ASP 731  48.952 -23.327   6.130
    3    HB2  ASP 731           HB2      ASP 731  47.483 -22.534   7.886
    4    HB3  ASP 731           HB3      ASP 731  47.420 -24.139   8.602

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLU 732           H        GLU 732  50.990 -24.210   6.623
    2    HA   GLU 732           HA       GLU 732  50.970 -27.089   6.709
    3    HB2  GLU 732           HB2      GLU 732  53.136 -25.123   6.035
    4    HB3  GLU 732           HB3      GLU 732  53.431 -26.849   6.201
    5    HG2  GLU 732           HG2      GLU 732  51.508 -25.570   4.272
    6    HG3  GLU 732           HG3      GLU 732  53.095 -26.236   3.877

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ARG 733           H        ARG 733  50.995 -24.903   9.145
    2    HA   ARG 733           HA       ARG 733  52.956 -26.393  10.708
    3    HB2  ARG 733           HB2      ARG 733  53.071 -23.920  10.751
    4    HB3  ARG 733           HB3      ARG 733  51.430 -23.870  11.378
    5    HG2  ARG 733           HG2      ARG 733  52.972 -23.518  13.188
    6    HG3  ARG 733           HG3      ARG 733  52.221 -25.102  13.391
    7    HD2  ARG 733           HD2      ARG 733  54.574 -25.307  13.836
    8    HD3  ARG 733           HD3      ARG 733  54.203 -26.111  12.306
    9    HE   ARG 733           HE       ARG 733  55.270 -23.378  12.371
   10   HH11  ARG 733          HH11      ARG 733  55.574 -26.748  11.257
   11   HH12  ARG 733          HH12      ARG 733  56.907 -26.429  10.256
   12   HH21  ARG 733          HH21      ARG 733  57.132 -22.971  10.986
   13   HH22  ARG 733          HH22      ARG 733  57.808 -24.266  10.112

  No H/Q in entry =          13
  In of MODEL   18
    1    H    SER 734           H        SER 734  49.668 -25.116  10.964
    2    HA   SER 734           HA       SER 734  49.073 -27.152  12.977
    3    HB2  SER 734           HB2      SER 734  47.487 -24.732  12.097
    4    HB3  SER 734           HB3      SER 734  47.061 -25.804  13.433
    5    HG   SER 734           HG       SER 734  49.449 -25.216  13.976

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LYS 735           H        LYS 735  48.936 -26.895   9.714
    2    HA   LYS 735           HA       LYS 735  47.903 -27.927   8.009
    3    HB2  LYS 735           HB2      LYS 735  47.306 -29.982  10.137
    4    HB3  LYS 735           HB3      LYS 735  47.130 -30.257   8.413
    5    HG2  LYS 735           HG2      LYS 735  49.702 -29.645   9.880
    6    HG3  LYS 735           HG3      LYS 735  49.217 -31.209   9.228
    7    HD2  LYS 735           HD2      LYS 735  49.736 -28.708   7.589
    8    HD3  LYS 735           HD3      LYS 735  50.858 -30.041   7.788
    9    HE2  LYS 735           HE2      LYS 735  49.230 -31.556   6.720
   10    HE3  LYS 735           HE3      LYS 735  48.118 -30.203   6.518
   11    HZ2  LYS 735           HZ1      LYS 735  50.798 -30.459   5.269
   12    HZ1  LYS 735           HZ2      LYS 735  49.805 -29.138   5.037
   13    HZ3  LYS 735           HZ3      LYS 735  49.336 -30.652   4.490

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ARG 736           H        ARG 736  46.355 -26.068   9.527
    2    HA   ARG 736           HA       ARG 736  43.637 -27.027   9.454
    3    HB2  ARG 736           HB2      ARG 736  43.061 -24.784  10.218
    4    HB3  ARG 736           HB3      ARG 736  44.271 -25.558  11.234
    5    HG2  ARG 736           HG2      ARG 736  46.005 -24.249  10.206
    6    HG3  ARG 736           HG3      ARG 736  44.832 -23.526   9.103
    7    HD2  ARG 736           HD2      ARG 736  45.414 -22.107  10.935
    8    HD3  ARG 736           HD3      ARG 736  43.690 -22.497  10.966
    9    HE   ARG 736           HE       ARG 736  44.715 -24.347  12.600
   10   HH11  ARG 736          HH11      ARG 736  45.250 -20.841  12.542
   11   HH12  ARG 736          HH12      ARG 736  45.466 -20.725  14.218
   12   HH21  ARG 736          HH21      ARG 736  45.002 -24.172  14.883
   13   HH22  ARG 736          HH22      ARG 736  45.314 -22.651  15.581

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ILE 737           H        ILE 737  42.085 -26.416   7.967
    2    HA   ILE 737           HA       ILE 737  43.048 -25.146   5.555
    3    HB   ILE 737           HB       ILE 737  40.178 -25.902   6.159
    4   HG12  ILE 737          HG12      ILE 737  41.629 -27.919   6.535
    5   HG13  ILE 737          HG13      ILE 737  40.521 -28.104   5.187
    6   HG23  ILE 737          HG21      ILE 737  39.957 -25.948   3.767
    7   HG22  ILE 737          HG22      ILE 737  41.698 -25.821   3.573
    8   HG21  ILE 737          HG23      ILE 737  40.801 -24.450   4.209
    9   HD13  ILE 737          HD11      ILE 737  42.692 -29.020   4.646
   10   HD12  ILE 737          HD12      ILE 737  43.451 -27.465   5.015
   11   HD11  ILE 737          HD13      ILE 737  42.332 -27.604   3.654

  No H/Q in entry =          11
  In of MODEL   18
    1    H    LEU 738           H        LEU 738  42.991 -23.002   5.512
    2    HA   LEU 738           HA       LEU 738  40.921 -21.702   7.069
    3    HB2  LEU 738           HB2      LEU 738  42.363 -19.796   7.605
    4    HB3  LEU 738           HB3      LEU 738  43.020 -21.276   8.265
    5    HG   LEU 738           HG       LEU 738  44.055 -19.984   5.736
    6   HD11  LEU 738          HD11      LEU 738  45.002 -19.693   8.585
    7   HD13  LEU 738          HD12      LEU 738  44.239 -18.429   7.622
    8   HD12  LEU 738          HD13      LEU 738  45.820 -19.055   7.161
    9   HD21  LEU 738          HD21      LEU 738  45.163 -21.949   7.684
   10   HD23  LEU 738          HD22      LEU 738  46.019 -21.329   6.254
   11   HD22  LEU 738          HD23      LEU 738  44.548 -22.313   6.078

  No H/Q in entry =          11
  In of MODEL   18
    1    HA   PRO 739           HA       PRO 739  39.845 -19.695   3.379
    2    HB2  PRO 739           HB2      PRO 739  38.516 -17.595   4.402
    3    HB3  PRO 739           HB3      PRO 739  37.860 -19.237   4.483
    4    HG2  PRO 739           HG2      PRO 739  39.289 -17.664   6.592
    5    HG3  PRO 739           HG3      PRO 739  37.845 -18.683   6.753
    6    HD2  PRO 739           HD2      PRO 739  40.394 -19.581   7.396
    7    HD3  PRO 739           HD3      PRO 739  39.084 -20.630   6.804

  No H/Q in entry =           7
  In of MODEL   18
    1    H    LEU 740           H        LEU 740  41.328 -18.768   2.231
    2    HA   LEU 740           HA       LEU 740  42.559 -16.253   3.153
    3    HB2  LEU 740           HB2      LEU 740  43.626 -18.368   1.306
    4    HB3  LEU 740           HB3      LEU 740  44.324 -16.772   1.450
    5    HG   LEU 740           HG       LEU 740  44.235 -18.927   3.548
    6   HD12  LEU 740          HD11      LEU 740  46.465 -17.519   2.113
    7   HD11  LEU 740          HD12      LEU 740  45.881 -19.161   1.815
    8   HD13  LEU 740          HD13      LEU 740  46.640 -18.761   3.358
    9   HD23  LEU 740          HD21      LEU 740  45.484 -17.349   4.976
   10   HD22  LEU 740          HD22      LEU 740  43.853 -16.777   4.652
   11   HD21  LEU 740          HD23      LEU 740  45.221 -16.080   3.780

  No H/Q in entry =          11
  In of MODEL   18
    1    H    THR 741           H        THR 741  43.440 -15.333   0.822
    2    HA   THR 741           HA       THR 741  41.214 -15.377  -1.060
    3    HB   THR 741           HB       THR 741  42.676 -12.805  -0.625
    4    HG1  THR 741           HG1      THR 741  40.530 -13.137   1.079
    5   HG23  THR 741          HG21      THR 741  40.469 -11.871  -0.969
    6   HG22  THR 741          HG22      THR 741  39.750 -13.473  -0.822
    7   HG21  THR 741          HG23      THR 741  40.783 -13.100  -2.197

  No H/Q in entry =           7
  In of MODEL   18
    1    H    VAL 742           H        VAL 742  42.081 -14.964  -3.270
    2    HA   VAL 742           HA       VAL 742  44.562 -16.114  -3.699
    3    HB   VAL 742           HB       VAL 742  43.137 -16.219  -5.654
    4   HG11  VAL 742          HG11      VAL 742  41.682 -14.551  -5.064
    5   HG13  VAL 742          HG12      VAL 742  42.215 -14.591  -6.745
    6   HG12  VAL 742          HG13      VAL 742  42.848 -13.336  -5.656
    7   HG22  VAL 742          HG21      VAL 742  44.302 -15.223  -7.454
    8   HG21  VAL 742          HG22      VAL 742  45.530 -15.721  -6.266
    9   HG23  VAL 742          HG23      VAL 742  45.017 -14.035  -6.379

  No H/Q in entry =           9
  In of MODEL   18
    1    H    CYS 743           H        CYS 743  43.951 -12.610  -3.840
    2    HA   CYS 743           HA       CYS 743  46.434 -11.575  -4.138
    3    HB2  CYS 743           HB2      CYS 743  44.696 -10.002  -3.846
    4    HB3  CYS 743           HB3      CYS 743  44.089 -10.865  -2.448

  No H/Q in entry =           4
  In of MODEL   18
    1    H    LYS 744           H        LYS 744  45.000 -12.677  -1.091
    2    HA   LYS 744           HA       LYS 744  47.070 -12.037   0.614
    3    HB2  LYS 744           HB2      LYS 744  44.833 -12.572   1.349
    4    HB3  LYS 744           HB3      LYS 744  45.016 -14.225   0.824
    5    HG2  LYS 744           HG2      LYS 744  45.261 -14.083   3.250
    6    HG3  LYS 744           HG3      LYS 744  46.764 -14.612   2.499
    7    HD2  LYS 744           HD2      LYS 744  47.196 -13.031   4.272
    8    HD3  LYS 744           HD3      LYS 744  47.651 -12.325   2.722
    9    HE2  LYS 744           HE2      LYS 744  46.504 -10.686   4.108
   10    HE3  LYS 744           HE3      LYS 744  45.523 -11.074   2.700
   11    HZ3  LYS 744           HZ1      LYS 744  44.190 -10.970   4.678
   12    HZ2  LYS 744           HZ2      LYS 744  45.122 -12.150   5.443
   13    HZ1  LYS 744           HZ3      LYS 744  44.191 -12.551   4.110

  No H/Q in entry =          13
  In of MODEL   18
    1    H    MET 745           H        MET 745  46.194 -15.256  -0.533
    2    HA   MET 745           HA       MET 745  48.312 -16.698   0.442
    3    HB2  MET 745           HB2      MET 745  46.908 -18.073  -0.271
    4    HB3  MET 745           HB3      MET 745  46.268 -17.096  -1.612
    5    HG2  MET 745           HG2      MET 745  47.212 -18.923  -2.764
    6    HG3  MET 745           HG3      MET 745  48.497 -17.776  -2.748
    7    HE3  MET 745           HE1      MET 745  47.466 -19.943   0.427
    8    HE2  MET 745           HE2      MET 745  48.445 -21.382   0.115
    9    HE1  MET 745           HE3      MET 745  47.135 -20.954  -0.978

  No H/Q in entry =           9
  In of MODEL   18
    1    H    HIS 746           H        HIS 746  48.221 -14.790  -2.492
    2    HA   HIS 746           HA       HIS 746  50.609 -15.940  -3.557
    3    HB2  HIS 746           HB2      HIS 746  48.858 -13.751  -4.221
    4    HB3  HIS 746           HB3      HIS 746  50.523 -13.518  -4.827
    5    HD1  HIS 746           HD1      HIS 746  51.153 -16.129  -6.101
    6    HD2  HIS 746           HD2      HIS 746  47.285 -14.644  -6.055
    7    HE1  HIS 746           HE1      HIS 746  50.027 -17.130  -8.081
    8    HE2  HIS 746           HE2      HIS 746  47.645 -16.375  -7.929

  No H/Q in entry =           8
  In of MODEL   18
    1    H    VAL 747           H        VAL 747  49.980 -12.825  -1.957
    2    HA   VAL 747           HA       VAL 747  52.690 -12.056  -1.749
    3    HB   VAL 747           HB       VAL 747  50.209 -11.284  -0.182
    4   HG12  VAL 747          HG11      VAL 747  51.495  -9.405   0.766
    5   HG11  VAL 747          HG12      VAL 747  52.959 -10.022   0.013
    6   HG13  VAL 747          HG13      VAL 747  52.162 -10.945   1.283
    7   HG23  VAL 747          HG21      VAL 747  51.825  -9.811  -2.240
    8   HG22  VAL 747          HG22      VAL 747  50.375  -9.200  -1.422
    9   HG21  VAL 747          HG23      VAL 747  50.270 -10.593  -2.504

  No H/Q in entry =           9
  In of MODEL   18
    1    H    LEU 748           H        LEU 748  50.500 -13.670   0.374
    2    HA   LEU 748           HA       LEU 748  51.800 -14.289   2.702
    3    HB2  LEU 748           HB2      LEU 748  49.493 -14.673   2.163
    4    HB3  LEU 748           HB3      LEU 748  49.929 -15.691   0.843
    5    HG   LEU 748           HG       LEU 748  48.790 -16.891   2.439
    6   HD13  LEU 748          HD11      LEU 748  50.230 -18.216   1.402
    7   HD12  LEU 748          HD12      LEU 748  50.259 -18.691   3.102
    8   HD11  LEU 748          HD13      LEU 748  51.601 -17.755   2.415
    9   HD21  LEU 748          HD21      LEU 748  50.689 -15.928   4.549
   10   HD23  LEU 748          HD22      LEU 748  49.511 -17.259   4.716
   11   HD22  LEU 748          HD23      LEU 748  48.940 -15.643   4.340

  No H/Q in entry =          11
  In of MODEL   18
    1    H    HIS 749           H        HIS 749  51.915 -16.030  -0.393
    2    HA   HIS 749           HA       HIS 749  53.613 -18.093   0.595
    3    HB2  HIS 749           HB2      HIS 749  51.839 -18.019  -1.380
    4    HB3  HIS 749           HB3      HIS 749  53.281 -17.645  -2.314
    5    HD1  HIS 749           HD1      HIS 749  55.263 -19.520  -2.099
    6    HD2  HIS 749           HD2      HIS 749  51.446 -20.573  -0.901
    7    HE1  HIS 749           HE1      HIS 749  55.281 -22.021  -2.004
    8    HE2  HIS 749           HE2      HIS 749  53.050 -22.639  -1.049

  No H/Q in entry =           8
  In of MODEL   18
    1    H    CYS 750           H        CYS 750  54.107 -15.074  -1.232
    2    HA   CYS 750           HA       CYS 750  56.785 -15.933  -1.854
    3    HB2  CYS 750           HB2      CYS 750  57.063 -13.927  -3.126
    4    HB3  CYS 750           HB3      CYS 750  55.444 -14.519  -3.466

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLN 751           H        GLN 751  55.182 -14.195   0.621
    2    HA   GLN 751           HA       GLN 751  57.408 -12.918   1.769
    3    HB2  GLN 751           HB2      GLN 751  54.848 -13.967   2.957
    4    HB3  GLN 751           HB3      GLN 751  56.046 -13.122   3.916
    5    HG2  GLN 751           HG2      GLN 751  54.650 -12.007   1.506
    6    HG3  GLN 751           HG3      GLN 751  54.178 -11.681   3.163
    7   HE21  GLN 751          HE21      GLN 751  54.935  -9.723   1.224
    8   HE22  GLN 751          HE22      GLN 751  56.380  -8.978   1.783

  No H/Q in entry =           8
  In of MODEL   18
    1    H    GLY 752           H        GLY 752  56.447 -16.200   1.621
    2    HA3  GLY 752           HA2      GLY 752  58.219 -17.831   1.971
    3    HA2  GLY 752           HA3      GLY 752  58.724 -16.879   3.358

  No H/Q in entry =           3
  In of MODEL   18
    1    H    ARG 753           H        ARG 753  55.312 -17.343   2.922
    2    HA   ARG 753           HA       ARG 753  55.401 -19.108   5.241
    3    HB2  ARG 753           HB2      ARG 753  53.013 -17.644   4.082
    4    HB3  ARG 753           HB3      ARG 753  53.054 -18.537   5.595
    5    HG2  ARG 753           HG2      ARG 753  54.553 -16.004   4.960
    6    HG3  ARG 753           HG3      ARG 753  53.178 -16.174   6.053
    7    HD2  ARG 753           HD2      ARG 753  54.500 -17.587   7.537
    8    HD3  ARG 753           HD3      ARG 753  55.856 -17.532   6.413
    9    HE   ARG 753           HE       ARG 753  54.817 -15.081   7.586
   10   HH11  ARG 753          HH11      ARG 753  57.457 -17.453   7.379
   11   HH12  ARG 753          HH12      ARG 753  58.641 -16.399   7.994
   12   HH21  ARG 753          HH21      ARG 753  56.448 -13.682   8.496
   13   HH22  ARG 753          HH22      ARG 753  58.044 -14.214   8.696

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ASN 754           H        ASN 754  54.688 -21.112   5.227
    2    HA   ASN 754           HA       ASN 754  54.361 -22.288   2.604
    3    HB2  ASN 754           HB2      ASN 754  54.734 -23.607   5.297
    4    HB3  ASN 754           HB3      ASN 754  54.665 -24.451   3.756
    5   HD21  ASN 754          HD21      ASN 754  56.526 -22.453   5.839
    6   HD22  ASN 754          HD22      ASN 754  58.018 -22.601   4.974

  No H/Q in entry =           6
  In of MODEL   18
    1    H    TYR 755           H        TYR 755  52.480 -22.476   1.832
    2    HA   TYR 755           HA       TYR 755  50.282 -23.486   3.444
    3    HB2  TYR 755           HB2      TYR 755  50.262 -20.988   1.780
    4    HB3  TYR 755           HB3      TYR 755  48.824 -21.967   2.001
    5    HD1  TYR 755           HD1      TYR 755  51.482 -20.678   4.352
    6    HD2  TYR 755           HD2      TYR 755  47.368 -20.961   3.382
    7    HE1  TYR 755           HE1      TYR 755  50.926 -19.356   6.344
    8    HE2  TYR 755           HE2      TYR 755  46.801 -19.649   5.340
    9    HH   TYR 755           HH       TYR 755  49.088 -17.924   7.111

  No H/Q in entry =           9
  In of MODEL   18
    1    H    THR 756           H        THR 756  48.969 -24.736   2.356
    2    HA   THR 756           HA       THR 756  49.703 -25.528  -0.374
    3    HB   THR 756           HB       THR 756  48.254 -26.962   1.866
    4    HG1  THR 756           HG1      THR 756  50.160 -27.426   2.521
    5   HG22  THR 756          HG21      THR 756  49.206 -28.015  -0.805
    6   HG21  THR 756          HG22      THR 756  47.527 -27.726  -0.335
    7   HG23  THR 756          HG23      THR 756  48.466 -28.978   0.486

  No H/Q in entry =           7
  In of MODEL   18
    1    H    LEU 757           H        LEU 757  47.888 -25.707  -1.907
    2    HA   LEU 757           HA       LEU 757  45.556 -24.201  -1.079
    3    HB2  LEU 757           HB2      LEU 757  46.503 -25.159  -3.764
    4    HB3  LEU 757           HB3      LEU 757  44.846 -24.655  -3.541
    5    HG   LEU 757           HG       LEU 757  46.097 -22.863  -4.514
    6   HD12  LEU 757          HD11      LEU 757  45.476 -22.257  -1.638
    7   HD11  LEU 757          HD12      LEU 757  44.348 -22.224  -2.991
    8   HD13  LEU 757          HD13      LEU 757  45.679 -21.072  -2.922
    9   HD23  LEU 757          HD21      LEU 757  47.914 -23.022  -2.113
   10   HD22  LEU 757          HD22      LEU 757  47.984 -21.792  -3.375
   11   HD21  LEU 757          HD23      LEU 757  48.334 -23.478  -3.760

  No H/Q in entry =          11
  In of MODEL   18
    1    H    THR 758           H        THR 758  43.483 -24.945  -1.007
    2    HA   THR 758           HA       THR 758  43.153 -27.793  -1.360
    3    HB   THR 758           HB       THR 758  41.663 -27.669   0.761
    4    HG1  THR 758           HG1      THR 758  43.385 -25.775   1.763
    5   HG21  THR 758          HG21      THR 758  43.771 -28.939   0.659
    6   HG23  THR 758          HG22      THR 758  43.593 -28.165   2.228
    7   HG22  THR 758          HG23      THR 758  44.673 -27.470   1.021

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLY 759           H        GLY 759  40.762 -28.349  -1.275
    2    HA3  GLY 759           HA2      GLY 759  39.499 -26.837  -3.316
    3    HA2  GLY 759           HA3      GLY 759  38.798 -28.189  -2.441

  No H/Q in entry =           3
  In of MODEL   18
    1    H    ARG 760           H        ARG 760  37.415 -25.901  -3.216
    2    HA   ARG 760           HA       ARG 760  37.207 -23.921  -1.195
    3    HB2  ARG 760           HB2      ARG 760  35.203 -23.162  -2.382
    4    HB3  ARG 760           HB3      ARG 760  36.480 -23.541  -3.527
    5    HG2  ARG 760           HG2      ARG 760  34.707 -24.531  -4.590
    6    HG3  ARG 760           HG3      ARG 760  35.249 -25.873  -3.583
    7    HD2  ARG 760           HD2      ARG 760  33.576 -25.053  -1.848
    8    HD3  ARG 760           HD3      ARG 760  32.899 -24.054  -3.134
    9    HE   ARG 760           HE       ARG 760  33.123 -26.981  -3.231
   10   HH11  ARG 760          HH11      ARG 760  31.247 -24.021  -3.936
   11   HH12  ARG 760          HH12      ARG 760  29.950 -24.881  -4.611
   12   HH21  ARG 760          HH21      ARG 760  31.302 -28.092  -4.178
   13   HH22  ARG 760          HH22      ARG 760  29.981 -27.209  -4.772

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ASP 761           H        ASP 761  36.079 -27.093  -1.332
    2    HA   ASP 761           HA       ASP 761  33.811 -26.767   0.428
    3    HB2  ASP 761           HB2      ASP 761  35.245 -29.201  -0.624
    4    HB3  ASP 761           HB3      ASP 761  33.927 -29.315   0.539

  No H/Q in entry =           4
  In of MODEL   18
    1    H    SER 762           H        SER 762  37.208 -27.143   0.774
    2    HA   SER 762           HA       SER 762  37.158 -28.566   3.210
    3    HB2  SER 762           HB2      SER 762  39.385 -26.994   1.926
    4    HB3  SER 762           HB3      SER 762  39.567 -28.160   3.237
    5    HG   SER 762           HG       SER 762  39.283 -29.757   1.902

  No H/Q in entry =           5
  In of MODEL   18
    1    H    CYS 763           H        CYS 763  37.005 -25.137   2.446
    2    HA   CYS 763           HA       CYS 763  36.887 -24.694   5.330
    3    HB2  CYS 763           HB2      CYS 763  37.974 -22.602   5.194
    4    HB3  CYS 763           HB3      CYS 763  39.030 -23.725   4.333

  No H/Q in entry =           4
  In of MODEL   18
    1    H    THR 764           H        THR 764  35.798 -22.484   5.709
    2    HA   THR 764           HA       THR 764  33.599 -22.234   3.811
    3    HB   THR 764           HB       THR 764  33.685 -21.561   6.760
    4    HG1  THR 764           HG1      THR 764  33.344 -23.875   5.452
    5   HG23  THR 764          HG21      THR 764  32.132 -20.180   5.469
    6   HG22  THR 764          HG22      THR 764  31.251 -21.300   6.515
    7   HG21  THR 764          HG23      THR 764  31.401 -21.631   4.782

  No H/Q in entry =           7
  In of MODEL   18
    1    H    LEU 765           H        LEU 765  34.122 -20.634   2.492
    2    HA   LEU 765           HA       LEU 765  35.620 -18.400   3.310
    3    HB2  LEU 765           HB2      LEU 765  34.064 -19.011   0.835
    4    HB3  LEU 765           HB3      LEU 765  34.750 -17.424   1.058
    5    HG   LEU 765           HG       LEU 765  36.304 -18.377  -0.248
    6   HD12  LEU 765          HD11      LEU 765  37.283 -19.265   2.427
    7   HD11  LEU 765          HD12      LEU 765  37.477 -17.657   1.725
    8   HD13  LEU 765          HD13      LEU 765  38.257 -19.056   0.981
    9   HD21  LEU 765          HD21      LEU 765  35.230 -20.435  -0.445
   10   HD23  LEU 765          HD22      LEU 765  35.871 -20.951   1.143
   11   HD22  LEU 765          HD23      LEU 765  36.979 -20.649  -0.231

  No H/Q in entry =          11
  In of MODEL   18
    1    HA   PRO 766           HA       PRO 766  32.707 -15.487   4.916
    2    HB2  PRO 766           HB2      PRO 766  33.377 -13.395   3.132
    3    HB3  PRO 766           HB3      PRO 766  34.138 -13.702   4.696
    4    HG2  PRO 766           HG2      PRO 766  35.016 -14.613   1.960
    5    HG3  PRO 766           HG3      PRO 766  36.022 -14.002   3.297
    6    HD2  PRO 766           HD2      PRO 766  35.899 -16.525   2.703
    7    HD3  PRO 766           HD3      PRO 766  35.834 -16.119   4.417

  No H/Q in entry =           7
  In of MODEL   18
    1    H    ALA 767           H        ALA 767  33.063 -15.364   1.388
    2    HA   ALA 767           HA       ALA 767  30.140 -15.556   1.122
    3    HB2  ALA 767           HB1      ALA 767  30.327 -14.297  -0.912
    4    HB3  ALA 767           HB2      ALA 767  32.069 -14.123  -0.677
    5    HB1  ALA 767           HB3      ALA 767  30.935 -13.328   0.439

  No H/Q in entry =           5
  In of MODEL   18
    1    H    SER 768           H        SER 768  29.774 -17.542   0.570
    2    HA   SER 768           HA       SER 768  31.860 -18.991  -0.699
    3    HB2  SER 768           HB2      SER 768  29.143 -19.968   0.170
    4    HB3  SER 768           HB3      SER 768  30.571 -20.939  -0.182
    5    HG   SER 768           HG       SER 768  31.324 -19.179   1.617

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA 769           H        ALA 769  28.342 -18.915  -1.367
    2    HA   ALA 769           HA       ALA 769  28.911 -19.510  -4.163
    3    HB3  ALA 769           HB1      ALA 769  26.560 -19.966  -4.372
    4    HB1  ALA 769           HB2      ALA 769  26.276 -19.347  -2.744
    5    HB2  ALA 769           HB3      ALA 769  27.210 -20.826  -2.973

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLU 770           H        GLU 770  27.599 -17.010  -2.218
    2    HA   GLU 770           HA       GLU 770  27.382 -15.354  -4.616
    3    HB2  GLU 770           HB2      GLU 770  25.525 -15.759  -2.368
    4    HB3  GLU 770           HB3      GLU 770  25.438 -14.264  -3.336
    5    HG2  GLU 770           HG2      GLU 770  25.504 -16.938  -4.543
    6    HG3  GLU 770           HG3      GLU 770  23.937 -16.306  -3.957

  No H/Q in entry =           6
  In of MODEL   18
    1    H    LYS 771           H        LYS 771  27.894 -13.229  -4.374
    2    HA   LYS 771           HA       LYS 771  29.805 -12.907  -2.206
    3    HB2  LYS 771           HB2      LYS 771  29.702 -11.405  -4.813
    4    HB3  LYS 771           HB3      LYS 771  31.060 -11.555  -3.701
    5    HG2  LYS 771           HG2      LYS 771  29.859 -13.820  -5.288
    6    HG3  LYS 771           HG3      LYS 771  31.340 -12.956  -5.704
    7    HD2  LYS 771           HD2      LYS 771  32.521 -13.894  -3.943
    8    HD3  LYS 771           HD3      LYS 771  31.065 -14.280  -3.022
    9    HE2  LYS 771           HE2      LYS 771  30.493 -16.041  -4.478
   10    HE3  LYS 771           HE3      LYS 771  31.732 -15.605  -5.649
   11    HZ2  LYS 771           HZ1      LYS 771  32.388 -17.527  -4.304
   12    HZ1  LYS 771           HZ2      LYS 771  32.282 -16.638  -2.877
   13    HZ3  LYS 771           HZ3      LYS 771  33.448 -16.259  -4.019

  No H/Q in entry =          13
  In of MODEL   18
    1    H    ALA 772           H        ALA 772  29.616 -11.304  -0.784
    2    HA   ALA 772           HA       ALA 772  27.214  -9.684  -0.904
    3    HB3  ALA 772           HB1      ALA 772  27.542 -11.060   1.069
    4    HB1  ALA 772           HB2      ALA 772  27.598  -9.343   1.480
    5    HB2  ALA 772           HB3      ALA 772  29.091 -10.274   1.373

  No H/Q in entry =           5
  In of MODEL   18
    1    H    CYS 773           H        CYS 773  27.300  -7.480  -0.227
    2    HA   CYS 773           HA       CYS 773  29.120  -5.879  -1.580
    3    HB2  CYS 773           HB2      CYS 773  26.855  -5.194  -0.931
    4    HB3  CYS 773           HB3      CYS 773  27.337  -5.198   0.755

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLY 774           H        GLY 774  30.873  -4.691  -0.954
    2    HA3  GLY 774           HA2      GLY 774  32.416  -3.822   0.640
    3    HA2  GLY 774           HA3      GLY 774  31.953  -5.114   1.744

  No H/Q in entry =           3
  In of MODEL   18
    1    H    ALA 775           H        ALA 775  32.106  -6.472  -1.198
    2    HA   ALA 775           HA       ALA 775  34.931  -6.893  -1.344
    3    HB3  ALA 775           HB1      ALA 775  34.149  -8.653   0.212
    4    HB1  ALA 775           HB2      ALA 775  34.596  -9.342  -1.345
    5    HB2  ALA 775           HB3      ALA 775  32.898  -9.096  -0.948

  No H/Q in entry =           5
  In of MODEL   18
    1    H    CYS 776           H        CYS 776  34.862  -8.745  -3.199
    2    HA   CYS 776           HA       CYS 776  34.656  -9.112  -5.443
    3    HB2  CYS 776           HB2      CYS 776  32.283  -9.564  -6.193
    4    HB3  CYS 776           HB3      CYS 776  32.804 -10.409  -4.743

  No H/Q in entry =           4
  In of MODEL   18
    1    HA   PRO 777           HA       PRO 777  33.078  -4.763  -6.887
    2    HB2  PRO 777           HB2      PRO 777  34.946  -2.937  -6.486
    3    HB3  PRO 777           HB3      PRO 777  33.905  -3.443  -5.145
    4    HG2  PRO 777           HG2      PRO 777  36.696  -4.340  -5.798
    5    HG3  PRO 777           HG3      PRO 777  36.042  -3.807  -4.239
    6    HD2  PRO 777           HD2      PRO 777  36.284  -6.443  -4.901
    7    HD3  PRO 777           HD3      PRO 777  35.032  -5.819  -3.828

  No H/Q in entry =           7
  In of MODEL   18
    1    H    LEU 778           H        LEU 778  35.426  -6.807  -7.592
    2    HA   LEU 778           HA       LEU 778  36.892  -5.397  -9.655
    3    HB2  LEU 778           HB2      LEU 778  36.725  -8.325  -9.077
    4    HB3  LEU 778           HB3      LEU 778  37.871  -7.632 -10.213
    5    HG   LEU 778           HG       LEU 778  38.916  -6.572  -8.075
    6   HD13  LEU 778          HD11      LEU 778  37.003  -6.915  -6.630
    7   HD12  LEU 778          HD12      LEU 778  38.421  -7.763  -6.000
    8   HD11  LEU 778          HD13      LEU 778  37.142  -8.660  -6.822
    9   HD22  LEU 778          HD21      LEU 778  39.913  -8.438  -9.295
   10   HD21  LEU 778          HD22      LEU 778  38.851  -9.554  -8.450
   11   HD23  LEU 778          HD23      LEU 778  40.082  -8.678  -7.552

  No H/Q in entry =          11
  In of MODEL   18
    1    H    TRP 779           H        TRP 779  34.268  -7.690  -9.433
    2    HA   TRP 779           HA       TRP 779  33.782  -7.399 -12.313
    3    HB2  TRP 779           HB2      TRP 779  32.967  -9.738 -12.322
    4    HB3  TRP 779           HB3      TRP 779  34.672  -9.629 -11.931
    5    HD1  TRP 779           HD1      TRP 779  31.314 -10.716 -10.455
    6    HE1  TRP 779           HE1      TRP 779  31.724 -12.004  -8.284
    7    HE3  TRP 779           HE3      TRP 779  36.257  -9.812  -9.943
    8    HZ2  TRP 779           HZ2      TRP 779  34.041 -12.599  -6.519
    9    HZ3  TRP 779           HZ3      TRP 779  37.444 -10.730  -7.981
   10    HH2  TRP 779           HH2      TRP 779  36.284 -12.078  -6.332

  No H/Q in entry =          10
  In of MODEL   18
    1    H    GLY 780           H        GLY 780  32.678  -6.315  -9.552
    2    HA3  GLY 780           HA2      GLY 780  29.959  -6.516 -10.336
    3    HA2  GLY 780           HA3      GLY 780  30.365  -7.287  -8.803

  No H/Q in entry =           3
  In of MODEL   18
    1    H    LYS 781           H        LYS 781  28.643  -5.340  -8.802
    2    HA   LYS 781           HA       LYS 781  30.104  -3.152  -7.518
    3    HB2  LYS 781           HB2      LYS 781  27.906  -3.042  -9.509
    4    HB3  LYS 781           HB3      LYS 781  28.137  -1.704  -8.386
    5    HG2  LYS 781           HG2      LYS 781  30.286  -2.678 -10.259
    6    HG3  LYS 781           HG3      LYS 781  29.058  -1.530 -10.777
    7    HD2  LYS 781           HD2      LYS 781  30.880  -0.170 -10.187
    8    HD3  LYS 781           HD3      LYS 781  29.836  -0.097  -8.779
    9    HE2  LYS 781           HE2      LYS 781  32.187  -0.305  -8.169
   10    HE3  LYS 781           HE3      LYS 781  31.301  -1.715  -7.622
   11    HZ3  LYS 781           HZ1      LYS 781  32.194  -2.991  -9.402
   12    HZ2  LYS 781           HZ2      LYS 781  33.529  -2.120  -8.790
   13    HZ1  LYS 781           HZ3      LYS 781  32.727  -1.619 -10.179

  No H/Q in entry =          13
  In of MODEL   18
    1    H    CYS 782           H        CYS 782  28.964  -2.108  -5.908
    2    HA   CYS 782           HA       CYS 782  26.520  -3.354  -4.931
    3    HB2  CYS 782           HB2      CYS 782  28.259  -4.044  -3.392
    4    HB3  CYS 782           HB3      CYS 782  28.939  -2.419  -3.358

  No H/Q in entry =           4
  In of MODEL   18
    1    H    ASP 783           H        ASP 783  25.382  -1.767  -6.052
    2    HA   ASP 783           HA       ASP 783  25.765   0.947  -5.039
    3    HB2  ASP 783           HB2      ASP 783  26.607   0.719  -7.337
    4    HB3  ASP 783           HB3      ASP 783  25.047   0.109  -7.853

  No H/Q in entry =           4
  In of MODEL   18
    1    H    ALA 784           H        ALA 784  24.043   1.933  -4.340
    2    HA   ALA 784           HA       ALA 784  22.017   2.418  -3.633
    3    HB3  ALA 784           HB1      ALA 784  20.184   2.383  -5.192
    4    HB1  ALA 784           HB2      ALA 784  21.024   1.216  -6.211
    5    HB2  ALA 784           HB3      ALA 784  21.664   2.850  -6.030

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLU 785           H        GLU 785  20.785  -0.455  -5.256
    2    HA   GLU 785           HA       GLU 785  19.387  -1.125  -2.797
    3    HB2  GLU 785           HB2      GLU 785  19.210  -2.335  -5.551
    4    HB3  GLU 785           HB3      GLU 785  18.199  -2.766  -4.188
    5    HG2  GLU 785           HG2      GLU 785  18.325  -0.044  -5.454
    6    HG3  GLU 785           HG3      GLU 785  17.071  -1.253  -5.737

  No H/Q in entry =           6
  In of MODEL   18
    1    H    SER 786           H        SER 786  21.924  -2.349  -4.800
    2    HA   SER 786           HA       SER 786  21.922  -5.016  -4.163
    3    HB2  SER 786           HB2      SER 786  24.230  -3.230  -4.877
    4    HB3  SER 786           HB3      SER 786  24.236  -4.995  -4.960
    5    HG   SER 786           HG       SER 786  23.573  -3.507  -6.894

  No H/Q in entry =           5
  In of MODEL   18
    1    H    SER 787           H        SER 787  21.943  -5.895  -2.249
    2    HA   SER 787           HA       SER 787  23.735  -4.915  -0.172
    3    HB2  SER 787           HB2      SER 787  21.706  -7.171  -0.101
    4    HB3  SER 787           HB3      SER 787  22.477  -6.398   1.294
    5    HG   SER 787           HG       SER 787  21.192  -4.762  -0.521

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LYS 788           H        LYS 788  23.108  -7.593  -2.320
    2    HA   LYS 788           HA       LYS 788  25.723  -8.750  -1.761
    3    HB2  LYS 788           HB2      LYS 788  25.124 -10.388  -3.532
    4    HB3  LYS 788           HB3      LYS 788  23.926 -10.356  -2.250
    5    HG2  LYS 788           HG2      LYS 788  22.358  -9.247  -3.576
    6    HG3  LYS 788           HG3      LYS 788  23.567  -8.768  -4.769
    7    HD2  LYS 788           HD2      LYS 788  22.871 -11.610  -4.186
    8    HD3  LYS 788           HD3      LYS 788  21.987 -10.673  -5.406
    9    HE2  LYS 788           HE2      LYS 788  24.226 -10.232  -6.495
   10    HE3  LYS 788           HE3      LYS 788  24.929 -11.377  -5.359
   11    HZ1  LYS 788           HZ1      LYS 788  22.785 -12.041  -7.308
   12    HZ3  LYS 788           HZ2      LYS 788  23.600 -13.135  -6.304
   13    HZ2  LYS 788           HZ3      LYS 788  24.416 -12.352  -7.522

  No H/Q in entry =          13
  In of MODEL   18
    1    H    CYS 789           H        CYS 789  27.038  -9.063  -4.009
    2    HA   CYS 789           HA       CYS 789  26.688  -6.469  -5.290
    3    HB2  CYS 789           HB2      CYS 789  28.956  -6.616  -6.111
    4    HB3  CYS 789           HB3      CYS 789  28.962  -6.952  -4.392

  No H/Q in entry =           4
  In of MODEL   18
    1    H    VAL 790           H        VAL 790  26.478  -6.273  -7.479
    2    HA   VAL 790           HA       VAL 790  25.552  -8.744  -8.725
    3    HB   VAL 790           HB       VAL 790  23.844  -6.971  -8.580
    4   HG11  VAL 790          HG11      VAL 790  25.225  -4.992  -8.655
    5   HG13  VAL 790          HG12      VAL 790  24.003  -4.919  -9.931
    6   HG12  VAL 790          HG13      VAL 790  25.670  -5.344 -10.324
    7   HG23  VAL 790          HG21      VAL 790  23.142  -6.933 -10.959
    8   HG22  VAL 790          HG22      VAL 790  23.647  -8.530 -10.400
    9   HG21  VAL 790          HG23      VAL 790  24.731  -7.562 -11.395

  No H/Q in entry =           9
  In of MODEL   18
    1    H    CYS 791           H        CYS 791  26.394  -9.402 -10.547
    2    HA   CYS 791           HA       CYS 791  29.061  -8.317 -11.031
    3    HB2  CYS 791           HB2      CYS 791  27.934 -11.016 -11.648
    4    HB3  CYS 791           HB3      CYS 791  29.629 -10.523 -11.703

  No H/Q in entry =           4
  In of MODEL   18
    1    H    ARG 792           H        ARG 792  29.889  -8.011 -12.903
    2    HA   ARG 792           HA       ARG 792  28.068  -7.519 -15.129
    3    HB2  ARG 792           HB2      ARG 792  30.855  -6.457 -14.601
    4    HB3  ARG 792           HB3      ARG 792  29.793  -5.985 -15.917
    5    HG2  ARG 792           HG2      ARG 792  29.367  -5.444 -12.981
    6    HG3  ARG 792           HG3      ARG 792  29.813  -4.278 -14.228
    7    HD2  ARG 792           HD2      ARG 792  27.223  -5.811 -14.031
    8    HD3  ARG 792           HD3      ARG 792  27.448  -4.091 -13.723
    9    HE   ARG 792           HE       ARG 792  28.330  -4.584 -16.312
   10   HH11  ARG 792          HH11      ARG 792  25.250  -4.748 -14.584
   11   HH12  ARG 792          HH12      ARG 792  24.332  -4.435 -15.984
   12   HH21  ARG 792          HH21      ARG 792  27.120  -4.201 -18.126
   13   HH22  ARG 792          HH22      ARG 792  25.389  -4.130 -18.067

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLU 793           H        GLU 793  29.531  -7.654 -17.277
    2    HA   GLU 793           HA       GLU 793  30.442 -10.374 -17.473
    3    HB2  GLU 793           HB2      GLU 793  30.281  -8.072 -19.394
    4    HB3  GLU 793           HB3      GLU 793  31.103  -9.561 -19.822
    5    HG2  GLU 793           HG2      GLU 793  28.267  -9.522 -18.860
    6    HG3  GLU 793           HG3      GLU 793  28.704  -9.354 -20.564

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ALA 794           H        ALA 794  32.538 -10.849 -18.501
    2    HA   ALA 794           HA       ALA 794  34.714  -9.926 -16.938
    3    HB1  ALA 794           HB1      ALA 794  34.662 -11.505 -19.504
    4    HB2  ALA 794           HB2      ALA 794  34.689 -12.165 -17.862
    5    HB3  ALA 794           HB3      ALA 794  36.073 -11.258 -18.485

  No H/Q in entry =           5
  In of MODEL   18
    1    H    SER 795           H        SER 795  33.374  -9.058 -19.985
    2    HA   SER 795           HA       SER 795  35.469  -7.566 -21.077
    3    HB2  SER 795           HB2      SER 795  32.524  -7.157 -21.522
    4    HB3  SER 795           HB3      SER 795  33.847  -7.021 -22.688
    5    HG   SER 795           HG       SER 795  34.023  -9.185 -22.793

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLU 796           H        GLU 796  33.346  -7.007 -18.440
    2    HA   GLU 796           HA       GLU 796  33.527  -4.080 -18.611
    3    HB2  GLU 796           HB2      GLU 796  31.669  -5.839 -17.009
    4    HB3  GLU 796           HB3      GLU 796  31.602  -4.085 -17.110
    5    HG2  GLU 796           HG2      GLU 796  31.037  -4.239 -19.479
    6    HG3  GLU 796           HG3      GLU 796  31.139  -5.997 -19.393

  No H/Q in entry =           6
  In of MODEL   18
    1    H    CYS 797           H        CYS 797  35.524  -6.074 -17.663
    2    HA   CYS 797           HA       CYS 797  35.864  -6.392 -14.952
    3    HB2  CYS 797           HB2      CYS 797  37.340  -7.417 -16.534
    4    HB3  CYS 797           HB3      CYS 797  37.899  -5.853 -17.104

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLU 798           H        GLU 798  35.924  -4.999 -13.306
    2    HA   GLU 798           HA       GLU 798  36.581  -2.233 -13.892
    3    HB2  GLU 798           HB2      GLU 798  35.175  -3.460 -11.541
    4    HB3  GLU 798           HB3      GLU 798  35.507  -1.741 -11.733
    5    HG2  GLU 798           HG2      GLU 798  34.188  -1.740 -13.800
    6    HG3  GLU 798           HG3      GLU 798  33.808  -3.440 -13.532

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU 799           H        GLU 799  37.839  -4.931 -12.175
    2    HA   GLU 799           HA       GLU 799  40.079  -3.264 -11.379
    3    HB2  GLU 799           HB2      GLU 799  38.696  -3.443  -9.318
    4    HB3  GLU 799           HB3      GLU 799  38.717  -5.191  -9.502
    5    HG2  GLU 799           HG2      GLU 799  40.261  -4.479  -7.770
    6    HG3  GLU 799           HG3      GLU 799  41.095  -5.264  -9.108

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLU 800           H        GLU 800  41.977  -4.294 -11.480
    2    HA   GLU 800           HA       GLU 800  41.877  -6.776 -12.959
    3    HB2  GLU 800           HB2      GLU 800  44.176  -4.850 -12.669
    4    HB3  GLU 800           HB3      GLU 800  44.114  -6.260 -13.709
    5    HG2  GLU 800           HG2      GLU 800  42.272  -5.209 -14.954
    6    HG3  GLU 800           HG3      GLU 800  42.467  -3.766 -13.955

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLY 801           H        GLY 801  41.523  -7.855 -11.276
    2    HA3  GLY 801           HA2      GLY 801  43.184  -8.265  -9.007
    3    HA2  GLY 801           HA3      GLY 801  42.096  -9.443  -9.650

  No H/Q in entry =           3
  In of MODEL   18
    1    H    PHE 802           H        PHE 802  43.699 -10.964  -9.061
    2    HA   PHE 802           HA       PHE 802  46.197 -10.993 -10.457
    3    HB2  PHE 802           HB2      PHE 802  44.917 -12.867  -8.486
    4    HB3  PHE 802           HB3      PHE 802  46.470 -13.192  -9.251
    5    HD1  PHE 802           HD1      PHE 802  48.406 -12.109  -8.568
    6    HD2  PHE 802           HD2      PHE 802  44.666 -10.869  -7.028
    7    HE1  PHE 802           HE1      PHE 802  49.551 -10.700  -6.969
    8    HE2  PHE 802           HE2      PHE 802  45.812  -9.436  -5.394
    9    HZ   PHE 802           HZ       PHE 802  48.263  -9.351  -5.347

  No H/Q in entry =           9
  In of MODEL   18
    1    H    SER 803           H        SER 803  46.896 -12.854 -11.629
    2    HA   SER 803           HA       SER 803  44.886 -13.828 -13.456
    3    HB2  SER 803           HB2      SER 803  46.983 -14.711 -14.573
    4    HB3  SER 803           HB3      SER 803  46.872 -12.953 -14.422
    5    HG   SER 803           HG       SER 803  48.161 -14.645 -12.579

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ILE 804           H        ILE 804  43.942 -15.747 -13.040
    2    HA   ILE 804           HA       ILE 804  45.412 -17.686 -11.404
    3    HB   ILE 804           HB       ILE 804  43.396 -18.457 -10.334
    4   HG12  ILE 804          HG12      ILE 804  41.792 -18.008 -12.253
    5   HG13  ILE 804          HG13      ILE 804  41.165 -17.617 -10.662
    6   HG22  ILE 804          HG21      ILE 804  43.547 -15.465 -10.157
    7   HG21  ILE 804          HG22      ILE 804  44.487 -16.632  -9.233
    8   HG23  ILE 804          HG23      ILE 804  42.744 -16.514  -8.988
    9   HD11  ILE 804          HD11      ILE 804  41.628 -15.233 -11.115
   10   HD13  ILE 804          HD12      ILE 804  40.500 -15.954 -12.254
   11   HD12  ILE 804          HD13      ILE 804  42.164 -15.665 -12.743

  No H/Q in entry =          11
  In of MODEL   18
    1    H    CYS 805           H        CYS 805  44.928 -19.923 -11.831
    2    HA   CYS 805           HA       CYS 805  44.259 -20.300 -14.617
    3    HB2  CYS 805           HB2      CYS 805  46.314 -21.355 -13.674
    4    HB3  CYS 805           HB3      CYS 805  45.260 -22.364 -12.674

  No H/Q in entry =           4
  In of MODEL   18
    1    H    VAL 806           H        VAL 806  42.220 -20.957 -15.063
    2    HA   VAL 806           HA       VAL 806  40.724 -22.378 -12.979
    3    HB   VAL 806           HB       VAL 806  39.982 -20.024 -13.109
    4   HG12  VAL 806          HG11      VAL 806  39.526 -20.577 -15.987
    5   HG11  VAL 806          HG12      VAL 806  40.760 -19.543 -15.275
    6   HG13  VAL 806          HG13      VAL 806  39.053 -19.119 -15.117
    7   HG23  VAL 806          HG21      VAL 806  37.977 -21.829 -14.434
    8   HG22  VAL 806          HG22      VAL 806  37.636 -20.301 -13.616
    9   HG21  VAL 806          HG23      VAL 806  38.238 -21.680 -12.697

  No H/Q in entry =           9
  In of MODEL   18
    1    H    GLU 807           H        GLU 807  39.567 -24.127 -13.667
    2    HA   GLU 807           HA       GLU 807  40.056 -25.100 -16.342
    3    HB2  GLU 807           HB2      GLU 807  40.235 -26.588 -14.344
    4    HB3  GLU 807           HB3      GLU 807  38.503 -26.394 -14.107
    5    HG2  GLU 807           HG2      GLU 807  38.094 -27.390 -16.297
    6    HG3  GLU 807           HG3      GLU 807  39.839 -27.558 -16.508

  No H/Q in entry =           6
  In of MODEL   18
    1    H    VAL 808           H        VAL 808  38.835 -24.537 -17.904
    2    HA   VAL 808           HA       VAL 808  35.976 -24.203 -17.508
    3    HB   VAL 808           HB       VAL 808  37.740 -22.319 -19.030
    4   HG12  VAL 808          HG11      VAL 808  34.804 -22.117 -18.514
    5   HG11  VAL 808          HG12      VAL 808  35.620 -22.450 -20.052
    6   HG13  VAL 808          HG13      VAL 808  35.819 -20.878 -19.272
    7   HG23  VAL 808          HG21      VAL 808  37.176 -20.609 -17.351
    8   HG22  VAL 808          HG22      VAL 808  38.137 -21.958 -16.738
    9   HG21  VAL 808          HG23      VAL 808  36.414 -21.887 -16.396

  No H/Q in entry =           9
  In of MODEL   18
    1    H    ASN 809           H        ASN 809  34.858 -25.105 -19.303
    2    HA   ASN 809           HA       ASN 809  34.424 -26.027 -21.320
    3    HB2  ASN 809           HB2      ASN 809  36.998 -24.668 -22.066
    4    HB3  ASN 809           HB3      ASN 809  36.157 -25.702 -23.206
    5   HD21  ASN 809          HD21      ASN 809  36.721 -22.775 -23.008
    6   HD22  ASN 809          HD22      ASN 809  35.161 -22.056 -23.266

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLY 810           H        GLY 810  36.477 -27.057 -19.220
    2    HA3  GLY 810           HA2      GLY 810  37.075 -29.331 -18.869
    3    HA2  GLY 810           HA3      GLY 810  37.052 -29.559 -20.617

  No H/Q in entry =           3
  In of MODEL   18
    1    H    LYS 811           H        LYS 811  38.535 -26.755 -20.313
    2    HA   LYS 811           HA       LYS 811  41.218 -27.966 -20.291
    3    HB2  LYS 811           HB2      LYS 811  40.142 -25.499 -21.659
    4    HB3  LYS 811           HB3      LYS 811  41.825 -26.001 -21.654
    5    HG2  LYS 811           HG2      LYS 811  41.322 -27.945 -22.960
    6    HG3  LYS 811           HG3      LYS 811  39.589 -27.662 -22.803
    7    HD2  LYS 811           HD2      LYS 811  40.484 -26.972 -25.012
    8    HD3  LYS 811           HD3      LYS 811  39.746 -25.645 -24.114
    9    HE2  LYS 811           HE2      LYS 811  41.954 -24.859 -23.430
   10    HE3  LYS 811           HE3      LYS 811  42.708 -26.220 -24.253
   11    HZ2  LYS 811           HZ1      LYS 811  42.741 -24.072 -25.449
   12    HZ1  LYS 811           HZ2      LYS 811  41.070 -24.175 -25.665
   13    HZ3  LYS 811           HZ3      LYS 811  42.091 -25.333 -26.349

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLU 812           H        GLU 812  42.863 -26.451 -19.398
    2    HA   GLU 812           HA       GLU 812  41.633 -24.648 -17.454
    3    HB2  GLU 812           HB2      GLU 812  44.434 -25.812 -17.416
    4    HB3  GLU 812           HB3      GLU 812  43.711 -24.810 -16.168
    5    HG2  GLU 812           HG2      GLU 812  43.368 -26.829 -15.184
    6    HG3  GLU 812           HG3      GLU 812  41.928 -26.797 -16.195

  No H/Q in entry =           6
  In of MODEL   18
    1    H    GLN 813           H        GLN 813  41.847 -22.616 -17.635
    2    HA   GLN 813           HA       GLN 813  43.897 -21.601 -19.460
    3    HB2  GLN 813           HB2      GLN 813  41.800 -21.694 -20.660
    4    HB3  GLN 813           HB3      GLN 813  40.950 -20.903 -19.341
    5    HG2  GLN 813           HG2      GLN 813  42.195 -18.888 -19.730
    6    HG3  GLN 813           HG3      GLN 813  43.113 -19.698 -21.004
    7   HE21  GLN 813          HE21      GLN 813  40.093 -18.319 -20.112
    8   HE22  GLN 813          HE22      GLN 813  39.372 -18.286 -21.677

  No H/Q in entry =           8
  In of MODEL   18
    1    H    THR 814           H        THR 814  44.557 -19.418 -18.923
    2    HA   THR 814           HA       THR 814  44.140 -18.734 -16.116
    3    HB   THR 814           HB       THR 814  46.006 -17.664 -18.131
    4    HG1  THR 814           HG1      THR 814  45.926 -20.033 -17.036
    5   HG21  THR 814          HG21      THR 814  46.025 -17.517 -15.110
    6   HG23  THR 814          HG22      THR 814  45.720 -16.188 -16.228
    7   HG22  THR 814          HG23      THR 814  47.323 -16.922 -16.145

  No H/Q in entry =           7
  In of MODEL   18
    1    H    MET 815           H        MET 815  42.865 -17.131 -15.721
    2    HA   MET 815           HA       MET 815  42.596 -15.024 -17.685
    3    HB2  MET 815           HB2      MET 815  40.138 -14.900 -17.068
    4    HB3  MET 815           HB3      MET 815  40.626 -16.246 -18.093
    5    HG2  MET 815           HG2      MET 815  40.728 -17.644 -16.223
    6    HG3  MET 815           HG3      MET 815  40.184 -16.416 -15.112
    7    HE2  MET 815           HE1      MET 815  37.676 -18.672 -18.273
    8    HE1  MET 815           HE2      MET 815  39.280 -19.078 -17.664
    9    HE3  MET 815           HE3      MET 815  39.070 -17.682 -18.726

  No H/Q in entry =           9
  In of MODEL   18
    1    H    SER 816           H        SER 816  41.361 -13.155 -16.553
    2    HA   SER 816           HA       SER 816  42.944 -12.644 -14.176
    3    HB2  SER 816           HB2      SER 816  41.088 -10.829 -15.734
    4    HB3  SER 816           HB3      SER 816  42.241 -10.327 -14.490
    5    HG   SER 816           HG       SER 816  42.902 -11.622 -16.933

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLU 817           H        GLU 817  42.000 -11.984 -12.188
    2    HA   GLU 817           HA       GLU 817  39.919 -13.383 -11.160
    3    HB2  GLU 817           HB2      GLU 817  41.317 -10.973 -10.465
    4    HB3  GLU 817           HB3      GLU 817  39.855 -11.215  -9.543
    5    HG2  GLU 817           HG2      GLU 817  40.724 -13.514  -9.103
    6    HG3  GLU 817           HG3      GLU 817  42.249 -13.059  -9.738

  No H/Q in entry =           6
  In of MODEL   18
    1    H    CYS 818           H        CYS 818  39.552 -10.105 -12.493
    2    HA   CYS 818           HA       CYS 818  36.829  -9.862 -11.781
    3    HB2  CYS 818           HB2      CYS 818  36.798  -8.101 -13.576
    4    HB3  CYS 818           HB3      CYS 818  38.044  -7.894 -12.348

  No H/Q in entry =           4
  In of MODEL   18
    1    H    GLU 819           H        GLU 819  38.449 -11.375 -14.368
    2    HA   GLU 819           HA       GLU 819  36.246 -11.665 -16.143
    3    HB2  GLU 819           HB2      GLU 819  38.634 -11.513 -16.767
    4    HB3  GLU 819           HB3      GLU 819  38.900 -12.999 -15.892
    5    HG2  GLU 819           HG2      GLU 819  37.846 -14.282 -17.507
    6    HG3  GLU 819           HG3      GLU 819  37.138 -12.877 -18.309

  No H/Q in entry =           6
  In of MODEL   18
    1    H    ALA 820           H        ALA 820  38.195 -13.927 -14.207
    2    HA   ALA 820           HA       ALA 820  36.621 -16.176 -14.514
    3    HB2  ALA 820           HB1      ALA 820  37.735 -17.060 -12.524
    4    HB3  ALA 820           HB2      ALA 820  38.322 -15.444 -12.138
    5    HB1  ALA 820           HB3      ALA 820  38.867 -16.257 -13.609

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLY 821           H        GLY 821  36.566 -13.684 -12.001
    2    HA3  GLY 821           HA2      GLY 821  34.612 -14.796 -10.347
    3    HA2  GLY 821           HA3      GLY 821  35.050 -13.097 -10.427

  No H/Q in entry =           3
  In of MODEL   18
    1    H    ALA 822           H        ALA 822  34.327 -12.577 -13.121
    2    HA   ALA 822           HA       ALA 822  31.596 -12.047 -12.812
    3    HB1  ALA 822           HB1      ALA 822  33.212 -12.080 -15.363
    4    HB2  ALA 822           HB2      ALA 822  33.056 -10.719 -14.242
    5    HB3  ALA 822           HB3      ALA 822  31.645 -11.299 -15.114

  No H/Q in entry =           5
  In of MODEL   18
    1    H    LEU 823           H        LEU 823  33.274 -14.424 -14.852
    2    HA   LEU 823           HA       LEU 823  30.944 -15.653 -15.831
    3    HB2  LEU 823           HB2      LEU 823  33.747 -16.732 -15.505
    4    HB3  LEU 823           HB3      LEU 823  32.471 -17.738 -16.126
    5    HG   LEU 823           HG       LEU 823  33.649 -17.041 -18.003
    6   HD13  LEU 823          HD11      LEU 823  32.187 -15.665 -19.314
    7   HD12  LEU 823          HD12      LEU 823  31.376 -15.118 -17.859
    8   HD11  LEU 823          HD13      LEU 823  31.268 -16.815 -18.336
    9   HD22  LEU 823          HD21      LEU 823  34.278 -14.730 -18.536
   10   HD21  LEU 823          HD22      LEU 823  35.022 -15.270 -17.033
   11   HD23  LEU 823          HD23      LEU 823  33.627 -14.203 -16.989

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ARG 824           H        ARG 824  32.805 -16.244 -12.947
    2    HA   ARG 824           HA       ARG 824  31.492 -18.548 -11.997
    3    HB2  ARG 824           HB2      ARG 824  33.629 -17.746 -11.121
    4    HB3  ARG 824           HB3      ARG 824  32.848 -16.305 -10.510
    5    HG2  ARG 824           HG2      ARG 824  33.261 -17.753  -8.671
    6    HG3  ARG 824           HG3      ARG 824  31.527 -17.751  -8.980
    7    HD2  ARG 824           HD2      ARG 824  33.380 -19.859 -10.042
    8    HD3  ARG 824           HD3      ARG 824  32.609 -20.009  -8.482
    9    HE   ARG 824           HE       ARG 824  30.609 -19.520 -10.325
   10   HH11  ARG 824          HH11      ARG 824  33.015 -22.039  -9.635
   11   HH12  ARG 824          HH12      ARG 824  32.148 -23.282 -10.414
   12   HH21  ARG 824          HH21      ARG 824  29.434 -21.286 -11.454
   13   HH22  ARG 824          HH22      ARG 824  30.135 -22.844 -11.467

  No H/Q in entry =          13
  In of MODEL   18
    1    H    CYS 825           H        CYS 825  30.833 -15.176 -11.538
    2    HA   CYS 825           HA       CYS 825  28.814 -15.546  -9.593
    3    HB2  CYS 825           HB2      CYS 825  30.302 -13.561  -9.864
    4    HB3  CYS 825           HB3      CYS 825  29.398 -13.152 -11.306

  No H/Q in entry =           4
  In of MODEL   18
    1    H    ARG 826           H        ARG 826  28.814 -15.204 -13.108
    2    HA   ARG 826           HA       ARG 826  25.978 -14.791 -13.231
    3    HB2  ARG 826           HB2      ARG 826  26.242 -15.135 -15.702
    4    HB3  ARG 826           HB3      ARG 826  27.183 -13.794 -15.023
    5    HG2  ARG 826           HG2      ARG 826  29.145 -15.155 -15.156
    6    HG3  ARG 826           HG3      ARG 826  28.198 -16.524 -15.736
    7    HD2  ARG 826           HD2      ARG 826  28.360 -13.865 -17.150
    8    HD3  ARG 826           HD3      ARG 826  29.388 -15.243 -17.525
    9    HE   ARG 826           HE       ARG 826  26.804 -16.172 -17.642
   10   HH11  ARG 826          HH11      ARG 826  28.475 -13.499 -19.295
   11   HH12  ARG 826          HH12      ARG 826  27.818 -13.884 -20.807
   12   HH21  ARG 826          HH21      ARG 826  25.852 -16.610 -19.752
   13   HH22  ARG 826          HH22      ARG 826  26.311 -15.651 -21.083

  No H/Q in entry =          13
  In of MODEL   18
    1    H    GLY 827           H        GLY 827  27.959 -17.593 -13.200
    2    HA3  GLY 827           HA2      GLY 827  26.839 -19.679 -12.655
    3    HA2  GLY 827           HA3      GLY 827  25.505 -19.158 -13.675

  No H/Q in entry =           3
  In of MODEL   18
    1    H    GLN 828           H        GLN 828  28.523 -18.462 -14.969
    2    HA   GLN 828           HA       GLN 828  28.357 -20.408 -17.081
    3    HB2  GLN 828           HB2      GLN 828  29.425 -18.163 -17.330
    4    HB3  GLN 828           HB3      GLN 828  30.629 -18.628 -16.152
    5    HG2  GLN 828           HG2      GLN 828  31.687 -18.802 -18.263
    6    HG3  GLN 828           HG3      GLN 828  31.337 -20.441 -17.749
    7   HE21  GLN 828          HE21      GLN 828  28.853 -18.324 -19.067
    8   HE22  GLN 828          HE22      GLN 828  28.712 -19.191 -20.549

  No H/Q in entry =           8
  In of MODEL   18
    1    H    SER 829           H        SER 829  29.850 -22.277 -17.313
    2    HA   SER 829           HA       SER 829  30.635 -23.282 -14.744
    3    HB2  SER 829           HB2      SER 829  30.685 -24.653 -17.447
    4    HB3  SER 829           HB3      SER 829  30.938 -25.422 -15.884
    5    HG   SER 829           HG       SER 829  28.682 -25.178 -17.061

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ILE 830           H        ILE 830  32.530 -22.885 -13.970
    2    HA   ILE 830           HA       ILE 830  35.011 -23.090 -15.517
    3    HB   ILE 830           HB       ILE 830  35.937 -21.024 -14.614
    4   HG12  ILE 830          HG12      ILE 830  34.652 -21.084 -12.442
    5   HG13  ILE 830          HG13      ILE 830  34.837 -19.473 -13.081
    6   HG22  ILE 830          HG21      ILE 830  34.621 -19.240 -15.667
    7   HG21  ILE 830          HG22      ILE 830  33.273 -20.371 -15.839
    8   HG23  ILE 830          HG23      ILE 830  34.792 -20.674 -16.684
    9   HD12  ILE 830          HD11      ILE 830  32.678 -19.980 -12.134
   10   HD11  ILE 830          HD12      ILE 830  32.394 -21.170 -13.412
   11   HD13  ILE 830          HD13      ILE 830  32.579 -19.455 -13.815

  No H/Q in entry =          11
  In of MODEL   18
    1    H    SER 831           H        SER 831  36.693 -23.692 -13.911
    2    HA   SER 831           HA       SER 831  35.727 -24.013 -11.139
    3    HB2  SER 831           HB2      SER 831  35.921 -26.167 -12.737
    4    HB3  SER 831           HB3      SER 831  37.603 -25.965 -12.343
    5    HG   SER 831           HG       SER 831  37.326 -26.506 -10.317

  No H/Q in entry =           5
  In of MODEL   18
    1    H    VAL 832           H        VAL 832  37.042 -22.555 -10.031
    2    HA   VAL 832           HA       VAL 832  39.650 -22.007 -11.009
    3    HB   VAL 832           HB       VAL 832  38.558 -20.223  -9.794
    4   HG13  VAL 832          HG11      VAL 832  38.113 -20.290  -7.379
    5   HG12  VAL 832          HG12      VAL 832  38.588 -21.989  -7.352
    6   HG11  VAL 832          HG13      VAL 832  37.168 -21.486  -8.269
    7   HG23  VAL 832          HG21      VAL 832  40.938 -21.226  -8.235
    8   HG22  VAL 832          HG22      VAL 832  40.310 -19.579  -8.179
    9   HG21  VAL 832          HG23      VAL 832  40.976 -20.216  -9.681

  No H/Q in entry =           9
  In of MODEL   18
    1    H    THR 833           H        THR 833  41.080 -23.499 -11.119
    2    HA   THR 833           HA       THR 833  41.213 -25.560  -9.153
    3    HB   THR 833           HB       THR 833  43.022 -26.331 -10.822
    4    HG1  THR 833           HG1      THR 833  43.214 -25.194 -12.640
    5   HG22  THR 833          HG21      THR 833  41.298 -27.158 -12.409
    6   HG21  THR 833          HG22      THR 833  40.150 -26.020 -11.715
    7   HG23  THR 833          HG23      THR 833  40.791 -27.341 -10.728

  No H/Q in entry =           7
  In of MODEL   18
    1    H    SER 834           H        SER 834  43.008 -22.762 -10.247
    2    HA   SER 834           HA       SER 834  44.776 -23.049  -7.955
    3    HB2  SER 834           HB2      SER 834  45.754 -22.788 -10.803
    4    HB3  SER 834           HB3      SER 834  46.784 -22.681  -9.381
    5    HG   SER 834           HG       SER 834  45.309 -24.878  -9.199

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ILE 835           H        ILE 835  45.447 -21.093  -7.121
    2    HA   ILE 835           HA       ILE 835  44.215 -18.677  -8.247
    3    HB   ILE 835           HB       ILE 835  44.754 -17.533  -6.304
    4   HG12  ILE 835          HG12      ILE 835  47.198 -18.000  -6.206
    5   HG13  ILE 835          HG13      ILE 835  46.446 -18.090  -4.625
    6   HG21  ILE 835          HG21      ILE 835  44.348 -20.356  -5.420
    7   HG23  ILE 835          HG22      ILE 835  43.119 -19.155  -5.821
    8   HG22  ILE 835          HG23      ILE 835  44.152 -18.928  -4.402
    9   HD13  ILE 835          HD11      ILE 835  48.097 -19.815  -4.922
   10   HD12  ILE 835          HD12      ILE 835  47.250 -20.375  -6.373
   11   HD11  ILE 835          HD13      ILE 835  46.479 -20.527  -4.791

  No H/Q in entry =          11
  In of MODEL   18
    1    H    ARG 836           H        ARG 836  46.931 -20.431  -8.683
    2    HA   ARG 836           HA       ARG 836  48.674 -18.242  -9.419
    3    HB2  ARG 836           HB2      ARG 836  49.049 -21.223  -9.550
    4    HB3  ARG 836           HB3      ARG 836  50.263 -20.040 -10.001
    5    HG2  ARG 836           HG2      ARG 836  50.119 -19.155  -7.660
    6    HG3  ARG 836           HG3      ARG 836  49.110 -20.553  -7.288
    7    HD2  ARG 836           HD2      ARG 836  51.904 -20.637  -8.383
    8    HD3  ARG 836           HD3      ARG 836  51.394 -20.909  -6.717
    9    HE   ARG 836           HE       ARG 836  50.167 -22.851  -7.501
   10   HH11  ARG 836          HH11      ARG 836  52.764 -21.623  -9.595
   11   HH12  ARG 836          HH12      ARG 836  52.984 -23.104 -10.394
   12   HH21  ARG 836          HH21      ARG 836  50.497 -24.903  -8.665
   13   HH22  ARG 836          HH22      ARG 836  51.722 -24.957  -9.863

  No H/Q in entry =          13
  In of MODEL   18
    1    HA   PRO 837           HA       PRO 837  47.323 -18.549 -13.676
    2    HB2  PRO 837           HB2      PRO 837  49.501 -17.550 -14.952
    3    HB3  PRO 837           HB3      PRO 837  48.400 -16.525 -14.024
    4    HG2  PRO 837           HG2      PRO 837  51.051 -17.661 -13.229
    5    HG3  PRO 837           HG3      PRO 837  50.408 -16.029 -12.964
    6    HD2  PRO 837           HD2      PRO 837  50.408 -17.938 -11.039
    7    HD3  PRO 837           HD3      PRO 837  49.159 -16.682 -11.148

  No H/Q in entry =           7
  In of MODEL   18
    1    H    CYS 838           H        CYS 838  47.627 -19.900 -15.551
    2    HA   CYS 838           HA       CYS 838  49.723 -21.765 -15.105
    3    HB2  CYS 838           HB2      CYS 838  48.327 -23.286 -16.740
    4    HB3  CYS 838           HB3      CYS 838  47.913 -23.197 -15.034

  No H/Q in entry =           4
  In of MODEL   18
    1    H    ALA 839           H        ALA 839  50.637 -22.814 -17.205
    2    HA   ALA 839           HA       ALA 839  51.583 -20.717 -18.887
    3    HB1  ALA 839           HB1      ALA 839  51.896 -23.706 -19.190
    4    HB2  ALA 839           HB2      ALA 839  52.985 -22.632 -18.304
    5    HB3  ALA 839           HB3      ALA 839  52.820 -22.475 -20.051

  No H/Q in entry =           5
  In of MODEL   18
    1    H    ALA 840           H        ALA 840  48.871 -22.577 -18.915
    2    HA   ALA 840           HA       ALA 840  48.094 -22.923 -21.565
    3    HB1  ALA 840           HB1      ALA 840  45.823 -22.740 -20.677
    4    HB2  ALA 840           HB2      ALA 840  46.494 -22.123 -19.161
    5    HB3  ALA 840           HB3      ALA 840  46.852 -23.764 -19.676

  No H/Q in entry =           5
  In of MODEL   18
    1    H    GLU 841           H        GLU 841  47.923 -20.185 -19.475
    2    HA   GLU 841           HA       GLU 841  47.278 -18.060 -19.643
    3    HB2  GLU 841           HB2      GLU 841  48.351 -18.265 -22.447
    4    HB3  GLU 841           HB3      GLU 841  48.043 -16.778 -21.572
    5    HG2  GLU 841           HG2      GLU 841  49.758 -17.354 -19.946
    6    HG3  GLU 841           HG3      GLU 841  50.047 -18.876 -20.789

  No H/Q in entry =           6
  In of MODEL   18
    1    H    THR 842           H        THR 842  46.624 -18.599 -22.923
    2    HA   THR 842           HA       THR 842  43.754 -18.531 -22.314
    3    HB   THR 842           HB       THR 842  44.472 -16.259 -22.704
    4    HG1  THR 842           HG1      THR 842  42.451 -17.480 -23.804
    5   HG23  THR 842          HG21      THR 842  46.291 -16.584 -24.261
    6   HG22  THR 842          HG22      THR 842  45.102 -15.500 -24.986
    7   HG21  THR 842          HG23      THR 842  45.171 -17.194 -25.477

  No H/Q in entry =           7
  In of MODEL   18
    1    H    GLN 843           H        GLN 843  46.085 -20.101 -23.716
    2    HA   GLN 843           HA       GLN 843  44.679 -20.779 -26.176
    3    HB2  GLN 843           HB2      GLN 843  47.132 -20.304 -26.260
    4    HB3  GLN 843           HB3      GLN 843  47.405 -21.703 -25.235
    5    HG2  GLN 843           HG2      GLN 843  47.851 -22.282 -27.531
    6    HG3  GLN 843           HG3      GLN 843  46.415 -23.141 -26.980
    7   HE21  GLN 843          HE21      GLN 843  45.632 -23.417 -29.046
    8   HE22  GLN 843          HE22      GLN 843  44.977 -22.124 -29.983

  No H/Q in entry =           8
  In of MODEL   19
    1    H1   GLY 689           H2       GLY 689  44.219   7.009 -29.944
    2    H2   GLY 689           H1       GLY 689  42.994   6.629 -31.046
    3    H3   GLY 689           H3       GLY 689  43.574   5.450 -29.975
    4    HA2  GLY 689           HA2      GLY 689  45.106   6.719 -32.152
    5    HA3  GLY 689           HA3      GLY 689  44.453   5.084 -32.161

  No H/Q in entry =           5
  In of MODEL   19
    1    H    SER 690           H        SER 690  47.197   6.679 -31.814
    2    HA   SER 690           HA       SER 690  48.530   4.488 -30.640
    3    HB2  SER 690           HB2      SER 690  49.515   7.278 -31.217
    4    HB3  SER 690           HB3      SER 690  50.526   5.867 -30.879
    5    HG   SER 690           HG       SER 690  48.628   5.555 -32.864

  No H/Q in entry =           5
  In of MODEL   19
    1    H    HIS 691           H        HIS 691  48.311   4.005 -28.612
    2    HA   HIS 691           HA       HIS 691  48.337   4.020 -26.415
    3    HB2  HIS 691           HB2      HIS 691  49.304   6.882 -26.636
    4    HB3  HIS 691           HB3      HIS 691  49.007   6.101 -25.084
    5    HD1  HIS 691           HD1      HIS 691  51.559   6.467 -27.731
    6    HD2  HIS 691           HD2      HIS 691  50.758   3.876 -24.581
    7    HE1  HIS 691           HE1      HIS 691  53.673   5.193 -27.343
    8    HE2  HIS 691           HE2      HIS 691  53.171   3.641 -25.421

  No H/Q in entry =           8
  In of MODEL   19
    1    H    MET 692           H        MET 692  46.382   3.543 -26.073
    2    HA   MET 692           HA       MET 692  44.214   5.405 -26.420
    3    HB2  MET 692           HB2      MET 692  44.265   2.590 -25.342
    4    HB3  MET 692           HB3      MET 692  42.807   3.521 -25.630
    5    HG2  MET 692           HG2      MET 692  44.814   2.742 -27.736
    6    HG3  MET 692           HG3      MET 692  43.298   1.901 -27.421
    7    HE1  MET 692           HE1      MET 692  40.915   2.895 -27.960
    8    HE3  MET 692           HE2      MET 692  40.646   4.552 -28.505
    9    HE2  MET 692           HE3      MET 692  41.258   4.250 -26.884

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ASN 693           H        ASN 693  46.199   4.300 -23.857
    2    HA   ASN 693           HA       ASN 693  44.917   6.116 -22.010
    3    HB2  ASN 693           HB2      ASN 693  44.446   4.494 -20.303
    4    HB3  ASN 693           HB3      ASN 693  43.741   3.845 -21.772
    5   HD21  ASN 693          HD21      ASN 693  46.024   3.380 -19.260
    6   HD22  ASN 693          HD22      ASN 693  46.595   1.830 -19.746

  No H/Q in entry =           6
  In of MODEL   19
    1    HA   PRO 694           HA       PRO 694  49.242   6.289 -20.758
    2    HB2  PRO 694           HB2      PRO 694  48.469   6.931 -18.004
    3    HB3  PRO 694           HB3      PRO 694  49.251   7.976 -19.194
    4    HG2  PRO 694           HG2      PRO 694  46.705   8.368 -18.365
    5    HG3  PRO 694           HG3      PRO 694  47.248   8.772 -20.003
    6    HD2  PRO 694           HD2      PRO 694  45.714   6.383 -19.050
    7    HD3  PRO 694           HD3      PRO 694  45.491   7.361 -20.517

  No H/Q in entry =           7
  In of MODEL   19
    1    H    LEU 695           H        LEU 695  50.209   4.363 -20.560
    2    HA   LEU 695           HA       LEU 695  49.119   2.234 -19.049
    3    HB2  LEU 695           HB2      LEU 695  51.856   2.443 -20.310
    4    HB3  LEU 695           HB3      LEU 695  51.246   1.008 -19.541
    5    HG   LEU 695           HG       LEU 695  51.071   0.657 -21.846
    6   HD11  LEU 695          HD11      LEU 695  49.154  -0.129 -20.639
    7   HD13  LEU 695          HD12      LEU 695  48.709   0.371 -22.270
    8   HD12  LEU 695          HD13      LEU 695  48.327   1.409 -20.898
    9   HD21  LEU 695          HD21      LEU 695  51.305   2.962 -22.604
   10   HD23  LEU 695          HD22      LEU 695  49.639   3.295 -22.118
   11   HD22  LEU 695          HD23      LEU 695  49.972   2.144 -23.413

  No H/Q in entry =          11
  In of MODEL   19
    1    H    THR 696           H        THR 696  48.931   2.779 -17.000
    2    HA   THR 696           HA       THR 696  51.346   3.381 -15.494
    3    HB   THR 696           HB       THR 696  48.484   3.145 -14.519
    4    HG1  THR 696           HG1      THR 696  48.822   4.828 -16.077
    5   HG21  THR 696          HG21      THR 696  50.179   2.927 -12.743
    6   HG23  THR 696          HG22      THR 696  49.293   4.440 -12.586
    7   HG22  THR 696          HG23      THR 696  50.921   4.436 -13.269

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLN 697           H        GLN 697  48.954   0.892 -16.084
    2    HA   GLN 697           HA       GLN 697  50.045  -0.817 -14.048
    3    HB2  GLN 697           HB2      GLN 697  47.890  -1.392 -16.085
    4    HB3  GLN 697           HB3      GLN 697  48.362  -2.445 -14.764
    5    HG2  GLN 697           HG2      GLN 697  47.091   0.270 -14.535
    6    HG3  GLN 697           HG3      GLN 697  46.336  -1.285 -14.187
    7   HE21  GLN 697          HE21      GLN 697  46.988  -2.406 -12.345
    8   HE22  GLN 697          HE22      GLN 697  47.771  -1.606 -11.026

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ALA 698           H        ALA 698  52.073  -0.856 -14.837
    2    HA   ALA 698           HA       ALA 698  52.585  -3.087 -16.602
    3    HB3  ALA 698           HB1      ALA 698  52.756  -1.103 -18.111
    4    HB1  ALA 698           HB2      ALA 698  54.329  -1.849 -17.812
    5    HB2  ALA 698           HB3      ALA 698  53.883  -0.371 -16.966

  No H/Q in entry =           5
  In of MODEL   19
    1    H    VAL 699           H        VAL 699  53.505  -4.352 -15.312
    2    HA   VAL 699           HA       VAL 699  54.932  -3.248 -13.156
    3    HB   VAL 699           HB       VAL 699  55.052  -5.486 -12.374
    4   HG12  VAL 699          HG11      VAL 699  52.628  -5.887 -11.981
    5   HG11  VAL 699          HG12      VAL 699  52.279  -4.697 -13.236
    6   HG13  VAL 699          HG13      VAL 699  53.107  -4.203 -11.760
    7   HG21  VAL 699          HG21      VAL 699  55.220  -6.757 -14.427
    8   HG23  VAL 699          HG22      VAL 699  53.572  -6.306 -14.864
    9   HG22  VAL 699          HG23      VAL 699  53.859  -7.361 -13.481

  No H/Q in entry =           9
  In of MODEL   19
    1    HA   PRO 700           HA       PRO 700  58.913  -4.155 -15.104
    2    HB2  PRO 700           HB2      PRO 700  60.000  -4.353 -12.389
    3    HB3  PRO 700           HB3      PRO 700  60.349  -3.142 -13.626
    4    HG2  PRO 700           HG2      PRO 700  58.970  -2.506 -11.418
    5    HG3  PRO 700           HG3      PRO 700  58.579  -1.789 -12.993
    6    HD2  PRO 700           HD2      PRO 700  57.247  -4.071 -11.576
    7    HD3  PRO 700           HD3      PRO 700  56.536  -2.638 -12.367

  No H/Q in entry =           7
  In of MODEL   19
    1    H    LYS 701           H        LYS 701  60.872  -5.715 -13.983
    2    HA   LYS 701           HA       LYS 701  59.588  -8.235 -14.422
    3    HB2  LYS 701           HB2      LYS 701  62.515  -7.533 -14.312
    4    HB3  LYS 701           HB3      LYS 701  61.949  -9.186 -14.459
    5    HG2  LYS 701           HG2      LYS 701  62.458  -8.485 -16.669
    6    HG3  LYS 701           HG3      LYS 701  60.698  -8.434 -16.516
    7    HD2  LYS 701           HD2      LYS 701  60.812  -6.020 -16.119
    8    HD3  LYS 701           HD3      LYS 701  62.560  -6.081 -16.345
    9    HE2  LYS 701           HE2      LYS 701  61.551  -5.349 -18.392
   10    HE3  LYS 701           HE3      LYS 701  62.188  -6.973 -18.606
   11    HZ2  LYS 701           HZ1      LYS 701  59.979  -6.675 -19.595
   12    HZ1  LYS 701           HZ2      LYS 701  59.317  -6.381 -18.082
   13    HZ3  LYS 701           HZ3      LYS 701  59.979  -7.881 -18.423

  No H/Q in entry =          13
  In of MODEL   19
    1    H    CYS 702           H        CYS 702  58.458  -7.955 -12.444
    2    HA   CYS 702           HA       CYS 702  59.744  -9.523 -10.332
    3    HB2  CYS 702           HB2      CYS 702  57.718  -7.340  -9.672
    4    HB3  CYS 702           HB3      CYS 702  58.783  -8.211  -8.615

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLN 703           H        GLN 703  57.900 -10.611  -9.072
    2    HA   GLN 703           HA       GLN 703  55.859 -11.398 -10.961
    3    HB2  GLN 703           HB2      GLN 703  56.367 -12.216  -8.098
    4    HB3  GLN 703           HB3      GLN 703  55.195 -12.954  -9.180
    5    HG2  GLN 703           HG2      GLN 703  58.184 -12.936  -9.591
    6    HG3  GLN 703           HG3      GLN 703  57.235 -14.292  -8.983
    7   HE21  GLN 703          HE21      GLN 703  55.979 -15.463 -10.418
    8   HE22  GLN 703          HE22      GLN 703  56.134 -15.298 -12.133

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ARG 704           H        ARG 704  53.580 -11.366 -10.267
    2    HA   ARG 704           HA       ARG 704  52.791  -8.710  -9.749
    3    HB2  ARG 704           HB2      ARG 704  51.172 -11.239  -9.770
    4    HB3  ARG 704           HB3      ARG 704  50.471  -9.628  -9.690
    5    HG2  ARG 704           HG2      ARG 704  51.107  -9.073 -11.762
    6    HG3  ARG 704           HG3      ARG 704  52.394 -10.290 -11.877
    7    HD2  ARG 704           HD2      ARG 704  50.228 -11.837 -11.619
    8    HD3  ARG 704           HD3      ARG 704  49.485 -10.422 -12.393
    9    HE   ARG 704           HE       ARG 704  51.858 -11.758 -13.447
   10   HH11  ARG 704          HH11      ARG 704  48.658 -10.273 -14.109
   11   HH12  ARG 704          HH12      ARG 704  48.665 -10.763 -15.725
   12   HH21  ARG 704          HH21      ARG 704  51.829 -12.367 -15.673
   13   HH22  ARG 704          HH22      ARG 704  50.491 -11.993 -16.637

  No H/Q in entry =          13
  In of MODEL   19
    1    H    TRP 705           H        TRP 705  53.423 -11.200  -7.513
    2    HA   TRP 705           HA       TRP 705  51.983  -9.831  -5.395
    3    HB2  TRP 705           HB2      TRP 705  52.885 -11.778  -3.993
    4    HB3  TRP 705           HB3      TRP 705  51.696 -12.154  -5.228
    5    HD1  TRP 705           HD1      TRP 705  55.309 -12.780  -4.253
    6    HE1  TRP 705           HE1      TRP 705  56.276 -14.609  -5.753
    7    HE3  TRP 705           HE3      TRP 705  51.508 -13.117  -7.641
    8    HZ2  TRP 705           HZ2      TRP 705  55.514 -16.039  -8.090
    9    HZ3  TRP 705           HZ3      TRP 705  51.705 -14.719  -9.479
   10    HH2  TRP 705           HH2      TRP 705  53.666 -16.159  -9.700

  No H/Q in entry =          10
  In of MODEL   19
    1    H    GLU 706           H        GLU 706  54.679  -9.259  -6.936
    2    HA   GLU 706           HA       GLU 706  56.158  -8.330  -4.608
    3    HB2  GLU 706           HB2      GLU 706  57.210  -9.377  -7.249
    4    HB3  GLU 706           HB3      GLU 706  58.220  -8.575  -6.056
    5    HG2  GLU 706           HG2      GLU 706  57.655 -10.420  -4.473
    6    HG3  GLU 706           HG3      GLU 706  56.779 -11.209  -5.784

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LYS 707           H        LYS 707  57.336  -6.344  -5.082
    2    HA   LYS 707           HA       LYS 707  56.425  -4.933  -7.419
    3    HB2  LYS 707           HB2      LYS 707  55.720  -2.922  -6.153
    4    HB3  LYS 707           HB3      LYS 707  54.704  -4.312  -5.843
    5    HG2  LYS 707           HG2      LYS 707  55.997  -4.629  -3.690
    6    HG3  LYS 707           HG3      LYS 707  56.742  -3.057  -4.007
    7    HD2  LYS 707           HD2      LYS 707  54.480  -2.046  -4.135
    8    HD3  LYS 707           HD3      LYS 707  53.779  -3.610  -3.747
    9    HE2  LYS 707           HE2      LYS 707  53.795  -2.375  -1.727
   10    HE3  LYS 707           HE3      LYS 707  55.117  -3.528  -1.595
   11    HZ3  LYS 707           HZ1      LYS 707  55.746  -1.318  -0.831
   12    HZ2  LYS 707           HZ2      LYS 707  55.371  -0.667  -2.324
   13    HZ1  LYS 707           HZ3      LYS 707  56.668  -1.703  -2.196

  No H/Q in entry =          13
  In of MODEL   19
    1    H    LEU 708           H        LEU 708  57.687  -3.211  -8.040
    2    HA   LEU 708           HA       LEU 708  60.443  -3.599  -7.260
    3    HB2  LEU 708           HB2      LEU 708  59.718  -3.487  -9.630
    4    HB3  LEU 708           HB3      LEU 708  59.278  -1.809  -9.378
    5    HG   LEU 708           HG       LEU 708  61.752  -1.532  -8.650
    6   HD11  LEU 708          HD11      LEU 708  62.328  -3.860  -8.563
    7   HD13  LEU 708          HD12      LEU 708  63.302  -3.025  -9.772
    8   HD12  LEU 708          HD13      LEU 708  61.950  -4.045 -10.276
    9   HD23  LEU 708          HD21      LEU 708  61.058  -1.986 -11.547
   10   HD22  LEU 708          HD22      LEU 708  62.423  -1.051 -10.931
   11   HD21  LEU 708          HD23      LEU 708  60.775  -0.504 -10.635

  No H/Q in entry =          11
  In of MODEL   19
    1    H    GLN 709           H        GLN 709  61.074  -2.486  -5.543
    2    HA   GLN 709           HA       GLN 709  60.629   0.414  -5.558
    3    HB2  GLN 709           HB2      GLN 709  60.342   0.512  -3.203
    4    HB3  GLN 709           HB3      GLN 709  59.317  -0.824  -3.699
    5    HG2  GLN 709           HG2      GLN 709  61.090  -2.400  -2.998
    6    HG3  GLN 709           HG3      GLN 709  62.048  -1.006  -2.476
    7   HE21  GLN 709          HE21      GLN 709  62.079  -1.790  -0.399
    8   HE22  GLN 709          HE22      GLN 709  60.740  -1.690   0.667

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ASN 710           H        ASN 710  62.530   1.539  -5.050
    2    HA   ASN 710           HA       ASN 710  64.799   1.902  -4.757
    3    HB2  ASN 710           HB2      ASN 710  64.113   0.634  -2.586
    4    HB3  ASN 710           HB3      ASN 710  64.881  -0.764  -3.320
    5   HD21  ASN 710          HD21      ASN 710  65.280   2.270  -1.927
    6   HD22  ASN 710          HD22      ASN 710  66.995   2.242  -1.656

  No H/Q in entry =           6
  In of MODEL   19
    1    H    SER 711           H        SER 711  63.780   0.409  -7.057
    2    HA   SER 711           HA       SER 711  64.464  -0.653  -8.911
    3    HB2  SER 711           HB2      SER 711  67.203  -0.170  -7.739
    4    HB3  SER 711           HB3      SER 711  66.908  -0.726  -9.393
    5    HG   SER 711           HG       SER 711  65.496   1.506  -8.608

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ARG 712           H        ARG 712  63.984  -2.253  -6.346
    2    HA   ARG 712           HA       ARG 712  65.119  -4.754  -7.370
    3    HB2  ARG 712           HB2      ARG 712  65.574  -5.533  -5.147
    4    HB3  ARG 712           HB3      ARG 712  66.372  -3.969  -5.321
    5    HG2  ARG 712           HG2      ARG 712  64.465  -2.932  -4.140
    6    HG3  ARG 712           HG3      ARG 712  63.783  -4.538  -3.901
    7    HD2  ARG 712           HD2      ARG 712  64.914  -4.068  -1.912
    8    HD3  ARG 712           HD3      ARG 712  65.979  -5.124  -2.846
    9    HE   ARG 712           HE       ARG 712  66.571  -2.435  -3.399
   10   HH11  ARG 712          HH11      ARG 712  67.087  -4.920  -0.919
   11   HH12  ARG 712          HH12      ARG 712  68.376  -4.122  -0.169
   12   HH21  ARG 712          HH21      ARG 712  68.323  -1.291  -2.341
   13   HH22  ARG 712          HH22      ARG 712  69.095  -1.985  -0.992

  No H/Q in entry =          13
  In of MODEL   19
    1    H    CYS 713           H        CYS 713  63.779  -6.620  -6.585
    2    HA   CYS 713           HA       CYS 713  60.967  -5.756  -6.486
    3    HB2  CYS 713           HB2      CYS 713  62.091  -8.496  -7.100
    4    HB3  CYS 713           HB3      CYS 713  60.399  -8.027  -7.213

  No H/Q in entry =           4
  In of MODEL   19
    1    H    VAL 714           H        VAL 714  60.088  -5.739  -4.543
    2    HA   VAL 714           HA       VAL 714  61.015  -7.728  -2.578
    3    HB   VAL 714           HB       VAL 714  60.198  -6.244  -0.800
    4   HG13  VAL 714          HG11      VAL 714  61.846  -4.437  -0.980
    5   HG12  VAL 714          HG12      VAL 714  62.038  -4.796  -2.696
    6   HG11  VAL 714          HG13      VAL 714  62.519  -5.986  -1.490
    7   HG22  VAL 714          HG21      VAL 714  58.371  -5.150  -1.980
    8   HG21  VAL 714          HG22      VAL 714  59.520  -4.304  -3.017
    9   HG23  VAL 714          HG23      VAL 714  59.456  -3.941  -1.293

  No H/Q in entry =           9
  In of MODEL   19
    1    H    CYS 715           H        CYS 715  59.158  -8.283  -0.998
    2    HA   CYS 715           HA       CYS 715  56.919  -9.031  -2.668
    3    HB2  CYS 715           HB2      CYS 715  57.887 -10.787  -1.283
    4    HB3  CYS 715           HB3      CYS 715  57.733  -9.780   0.150

  No H/Q in entry =           4
  In of MODEL   19
    1    H    LYS 716           H        LYS 716  54.893  -8.363  -2.388
    2    HA   LYS 716           HA       LYS 716  54.425  -5.752  -1.315
    3    HB2  LYS 716           HB2      LYS 716  53.502  -6.715  -3.439
    4    HB3  LYS 716           HB3      LYS 716  52.558  -7.837  -2.491
    5    HG2  LYS 716           HG2      LYS 716  51.231  -6.009  -1.616
    6    HG3  LYS 716           HG3      LYS 716  52.246  -4.840  -2.466
    7    HD2  LYS 716           HD2      LYS 716  51.609  -5.874  -4.609
    8    HD3  LYS 716           HD3      LYS 716  50.553  -6.992  -3.745
    9    HE2  LYS 716           HE2      LYS 716  49.203  -5.134  -2.958
   10    HE3  LYS 716           HE3      LYS 716  50.290  -3.986  -3.740
   11    HZ1  LYS 716           HZ1      LYS 716  49.704  -4.982  -5.879
   12    HZ3  LYS 716           HZ2      LYS 716  48.352  -4.362  -5.127
   13    HZ2  LYS 716           HZ3      LYS 716  48.610  -6.018  -5.148

  No H/Q in entry =          13
  In of MODEL   19
    1    H    MET 717           H        MET 717  52.387  -5.451   0.229
    2    HA   MET 717           HA       MET 717  52.535  -7.546   2.220
    3    HB2  MET 717           HB2      MET 717  51.810  -4.674   2.293
    4    HB3  MET 717           HB3      MET 717  51.067  -5.738   3.471
    5    HG2  MET 717           HG2      MET 717  53.076  -4.664   4.331
    6    HG3  MET 717           HG3      MET 717  53.207  -6.429   4.278
    7    HE3  MET 717           HE1      MET 717  53.566  -3.937   1.326
    8    HE2  MET 717           HE2      MET 717  55.300  -3.573   1.353
    9    HE1  MET 717           HE3      MET 717  54.248  -3.053   2.691

  No H/Q in entry =           9
  In of MODEL   19
    1    HA   PRO 718           HA       PRO 718  48.746  -9.444   1.276
    2    HB2  PRO 718           HB2      PRO 718  47.841 -10.127   3.794
    3    HB3  PRO 718           HB3      PRO 718  49.075 -11.011   2.899
    4    HG2  PRO 718           HG2      PRO 718  49.411  -8.959   5.048
    5    HG3  PRO 718           HG3      PRO 718  50.292 -10.479   4.805
    6    HD2  PRO 718           HD2      PRO 718  51.349  -8.114   4.121
    7    HD3  PRO 718           HD3      PRO 718  51.642  -9.571   3.154

  No H/Q in entry =           7
  In of MODEL   19
    1    H    TYR 719           H        TYR 719  48.502  -7.092   3.929
    2    HA   TYR 719           HA       TYR 719  45.667  -6.691   3.642
    3    HB2  TYR 719           HB2      TYR 719  45.884  -5.010   5.325
    4    HB3  TYR 719           HB3      TYR 719  47.063  -6.241   5.740
    5    HD1  TYR 719           HD1      TYR 719  49.589  -5.758   5.045
    6    HD2  TYR 719           HD2      TYR 719  46.528  -2.769   5.109
    7    HE1  TYR 719           HE1      TYR 719  51.278  -4.020   5.134
    8    HE2  TYR 719           HE2      TYR 719  48.260  -1.024   5.181
    9    HH   TYR 719           HH       TYR 719  50.659  -0.809   5.884

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLU 720           H        GLU 720  48.293  -5.786   1.882
    2    HA   GLU 720           HA       GLU 720  47.345  -3.186   1.014
    3    HB2  GLU 720           HB2      GLU 720  49.644  -3.528   1.801
    4    HB3  GLU 720           HB3      GLU 720  49.875  -4.759   0.586
    5    HG2  GLU 720           HG2      GLU 720  49.698  -3.054  -1.148
    6    HG3  GLU 720           HG3      GLU 720  49.476  -1.820   0.103

  No H/Q in entry =           6
  In of MODEL   19
    1    H    CYS 721           H        CYS 721  46.756  -6.348   0.253
    2    HA   CYS 721           HA       CYS 721  46.491  -5.698  -2.591
    3    HB2  CYS 721           HB2      CYS 721  48.154  -7.692  -1.686
    4    HB3  CYS 721           HB3      CYS 721  46.638  -8.543  -1.858

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLY 722           H        GLY 722  44.418  -5.098  -2.596
    2    HA3  GLY 722           HA2      GLY 722  42.415  -6.587  -1.144
    3    HA2  GLY 722           HA3      GLY 722  42.163  -5.126  -2.079

  No H/Q in entry =           3
  In of MODEL   19
    1    HA   PRO 723           HA       PRO 723  40.439  -7.201  -5.524
    2    HB2  PRO 723           HB2      PRO 723  42.106  -6.700  -7.685
    3    HB3  PRO 723           HB3      PRO 723  40.885  -5.585  -7.074
    4    HG2  PRO 723           HG2      PRO 723  43.823  -5.668  -6.526
    5    HG3  PRO 723           HG3      PRO 723  42.781  -4.264  -6.819
    6    HD2  PRO 723           HD2      PRO 723  43.570  -4.899  -4.353
    7    HD3  PRO 723           HD3      PRO 723  41.925  -4.299  -4.654

  No H/Q in entry =           7
  In of MODEL   19
    1    H    SER 724           H        SER 724  40.510  -9.396  -5.150
    2    HA   SER 724           HA       SER 724  42.243 -11.105  -6.727
    3    HB2  SER 724           HB2      SER 724  42.296 -11.157  -3.721
    4    HB3  SER 724           HB3      SER 724  43.114 -12.296  -4.795
    5    HG   SER 724           HG       SER 724  43.806  -9.821  -5.409

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU 725           H        LEU 725  41.358 -13.225  -6.764
    2    HA   LEU 725           HA       LEU 725  38.643 -13.598  -5.936
    3    HB2  LEU 725           HB2      LEU 725  40.751 -15.248  -7.224
    4    HB3  LEU 725           HB3      LEU 725  39.273 -15.988  -6.669
    5    HG   LEU 725           HG       LEU 725  39.419 -13.773  -8.710
    6   HD11  LEU 725          HD11      LEU 725  40.483 -15.835  -9.474
    7   HD13  LEU 725          HD12      LEU 725  38.953 -15.526 -10.298
    8   HD12  LEU 725          HD13      LEU 725  39.036 -16.745  -9.024
    9   HD21  LEU 725          HD21      LEU 725  37.194 -15.608  -7.842
   10   HD23  LEU 725          HD22      LEU 725  37.133 -14.450  -9.166
   11   HD22  LEU 725          HD23      LEU 725  37.300 -13.877  -7.509

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ASP 726           H        ASP 726  37.912 -14.608  -4.153
    2    HA   ASP 726           HA       ASP 726  39.755 -15.438  -2.131
    3    HB2  ASP 726           HB2      ASP 726  36.744 -15.622  -2.236
    4    HB3  ASP 726           HB3      ASP 726  37.696 -16.197  -0.877

  No H/Q in entry =           4
  In of MODEL   19
    1    H    VAL 727           H        VAL 727  40.231 -17.371  -1.404
    2    HA   VAL 727           HA       VAL 727  39.242 -19.777  -2.758
    3    HB   VAL 727           HB       VAL 727  41.590 -20.632  -3.045
    4   HG13  VAL 727          HG11      VAL 727  42.080 -19.397  -5.106
    5   HG12  VAL 727          HG12      VAL 727  40.935 -18.148  -4.625
    6   HG11  VAL 727          HG13      VAL 727  40.364 -19.781  -4.972
    7   HG23  VAL 727          HG21      VAL 727  43.447 -19.013  -3.114
    8   HG22  VAL 727          HG22      VAL 727  42.746 -19.143  -1.499
    9   HG21  VAL 727          HG23      VAL 727  42.359 -17.758  -2.518

  No H/Q in entry =           9
  In of MODEL   19
    1    H    CYS 728           H        CYS 728  40.108 -21.808  -1.634
    2    HA   CYS 728           HA       CYS 728  40.252 -21.306   1.242
    3    HB2  CYS 728           HB2      CYS 728  39.668 -23.844  -0.299
    4    HB3  CYS 728           HB3      CYS 728  39.785 -23.748   1.447

  No H/Q in entry =           4
  In of MODEL   19
    1    H    ALA 729           H        ALA 729  42.063 -21.688   2.348
    2    HA   ALA 729           HA       ALA 729  44.177 -23.184   0.998
    3    HB2  ALA 729           HB1      ALA 729  45.769 -21.585   1.862
    4    HB1  ALA 729           HB2      ALA 729  44.449 -20.641   2.556
    5    HB3  ALA 729           HB3      ALA 729  44.595 -20.805   0.802

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLN 730           H        GLN 730  45.457 -24.320   2.329
    2    HA   GLN 730           HA       GLN 730  44.472 -24.730   5.051
    3    HB2  GLN 730           HB2      GLN 730  44.634 -26.726   3.566
    4    HB3  GLN 730           HB3      GLN 730  46.344 -26.399   3.389
    5    HG2  GLN 730           HG2      GLN 730  46.735 -26.741   5.721
    6    HG3  GLN 730           HG3      GLN 730  45.029 -26.986   6.027
    7   HE21  GLN 730          HE21      GLN 730  45.268 -29.050   6.810
    8   HE22  GLN 730          HE22      GLN 730  45.766 -30.382   5.830

  No H/Q in entry =           8
  In of MODEL   19
    1    H    ASP 731           H        ASP 731  45.618 -23.978   6.659
    2    HA   ASP 731           HA       ASP 731  48.193 -22.780   6.266
    3    HB2  ASP 731           HB2      ASP 731  46.706 -21.909   8.046
    4    HB3  ASP 731           HB3      ASP 731  46.733 -23.479   8.824

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLU 732           H        GLU 732  50.155 -23.773   6.555
    2    HA   GLU 732           HA       GLU 732  50.104 -26.589   6.668
    3    HB2  GLU 732           HB2      GLU 732  52.328 -24.636   6.350
    4    HB3  GLU 732           HB3      GLU 732  52.676 -26.314   6.732
    5    HG2  GLU 732           HG2      GLU 732  51.071 -25.340   4.393
    6    HG3  GLU 732           HG3      GLU 732  52.718 -25.983   4.352

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ARG 733           H        ARG 733  50.805 -24.249   9.158
    2    HA   ARG 733           HA       ARG 733  52.093 -26.281  10.710
    3    HB2  ARG 733           HB2      ARG 733  51.655 -23.358  10.991
    4    HB3  ARG 733           HB3      ARG 733  51.967 -24.291  12.441
    5    HG2  ARG 733           HG2      ARG 733  54.005 -23.256  11.487
    6    HG3  ARG 733           HG3      ARG 733  54.119 -25.007  11.572
    7    HD2  ARG 733           HD2      ARG 733  53.580 -25.140   9.168
    8    HD3  ARG 733           HD3      ARG 733  53.460 -23.386   9.114
    9    HE   ARG 733           HE       ARG 733  55.872 -23.489   9.920
   10   HH11  ARG 733          HH11      ARG 733  54.555 -25.996   7.786
   11   HH12  ARG 733          HH12      ARG 733  56.019 -26.229   6.944
   12   HH21  ARG 733          HH21      ARG 733  57.843 -23.812   8.743
   13   HH22  ARG 733          HH22      ARG 733  57.912 -24.963   7.483

  No H/Q in entry =          13
  In of MODEL   19
    1    H    SER 734           H        SER 734  49.056 -24.577  10.692
    2    HA   SER 734           HA       SER 734  48.164 -25.998  13.068
    3    HB2  SER 734           HB2      SER 734  46.609 -24.045  11.391
    4    HB3  SER 734           HB3      SER 734  46.433 -24.395  13.115
    5    HG   SER 734           HG       SER 734  48.434 -22.970  11.755

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LYS 735           H        LYS 735  48.105 -26.386   9.633
    2    HA   LYS 735           HA       LYS 735  47.080 -27.610   8.173
    3    HB2  LYS 735           HB2      LYS 735  46.618 -29.338  10.572
    4    HB3  LYS 735           HB3      LYS 735  46.180 -29.843   8.948
    5    HG2  LYS 735           HG2      LYS 735  48.940 -29.165   9.941
    6    HG3  LYS 735           HG3      LYS 735  48.323 -30.774   9.560
    7    HD2  LYS 735           HD2      LYS 735  47.904 -29.817   7.194
    8    HD3  LYS 735           HD3      LYS 735  48.932 -28.496   7.701
    9    HE2  LYS 735           HE2      LYS 735  50.758 -29.958   8.188
   10    HE3  LYS 735           HE3      LYS 735  49.792 -31.381   7.819
   11    HZ3  LYS 735           HZ1      LYS 735  51.222 -30.900   5.991
   12    HZ2  LYS 735           HZ2      LYS 735  50.765 -29.320   5.865
   13    HZ1  LYS 735           HZ3      LYS 735  49.684 -30.545   5.466

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ARG 736           H        ARG 736  45.435 -25.572   9.525
    2    HA   ARG 736           HA       ARG 736  42.766 -26.742   9.250
    3    HB2  ARG 736           HB2      ARG 736  41.930 -24.733  10.275
    4    HB3  ARG 736           HB3      ARG 736  43.205 -25.419  11.266
    5    HG2  ARG 736           HG2      ARG 736  44.768 -23.791  10.391
    6    HG3  ARG 736           HG3      ARG 736  43.503 -23.122   9.364
    7    HD2  ARG 736           HD2      ARG 736  43.792 -21.804  11.275
    8    HD3  ARG 736           HD3      ARG 736  42.204 -22.570  11.358
    9    HE   ARG 736           HE       ARG 736  43.551 -24.259  12.824
   10   HH11  ARG 736          HH11      ARG 736  43.823 -20.723  12.870
   11   HH12  ARG 736          HH12      ARG 736  44.256 -20.655  14.519
   12   HH21  ARG 736          HH21      ARG 736  44.207 -24.155  15.060
   13   HH22  ARG 736          HH22      ARG 736  44.506 -22.646  15.785

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ILE 737           H        ILE 737  41.260 -25.866   7.800
    2    HA   ILE 737           HA       ILE 737  42.490 -24.519   5.549
    3    HB   ILE 737           HB       ILE 737  39.579 -25.271   5.754
    4   HG12  ILE 737          HG12      ILE 737  40.973 -27.293   6.320
    5   HG13  ILE 737          HG13      ILE 737  40.008 -27.481   4.866
    6   HG22  ILE 737          HG21      ILE 737  41.478 -25.132   3.419
    7   HG21  ILE 737          HG22      ILE 737  40.438 -23.824   3.928
    8   HG23  ILE 737          HG23      ILE 737  39.728 -25.337   3.334
    9   HD11  ILE 737          HD11      ILE 737  42.007 -27.035   3.530
   10   HD13  ILE 737          HD12      ILE 737  42.214 -28.433   4.594
   11   HD12  ILE 737          HD13      ILE 737  42.951 -26.881   5.013

  No H/Q in entry =          11
  In of MODEL   19
    1    H    LEU 738           H        LEU 738  42.232 -22.420   5.257
    2    HA   LEU 738           HA       LEU 738  40.019 -21.087   6.559
    3    HB2  LEU 738           HB2      LEU 738  41.377 -19.146   7.184
    4    HB3  LEU 738           HB3      LEU 738  41.946 -20.582   7.997
    5    HG   LEU 738           HG       LEU 738  43.300 -19.418   5.555
    6   HD12  LEU 738          HD11      LEU 738  44.908 -18.456   7.130
    7   HD11  LEU 738          HD12      LEU 738  43.913 -19.003   8.481
    8   HD13  LEU 738          HD13      LEU 738  43.302 -17.773   7.371
    9   HD22  LEU 738          HD21      LEU 738  45.177 -20.764   6.335
   10   HD21  LEU 738          HD22      LEU 738  43.708 -21.728   6.050
   11   HD23  LEU 738          HD23      LEU 738  44.173 -21.306   7.698

  No H/Q in entry =          11
  In of MODEL   19
    1    HA   PRO 739           HA       PRO 739  39.480 -19.244   2.587
    2    HB2  PRO 739           HB2      PRO 739  38.168 -16.997   3.341
    3    HB3  PRO 739           HB3      PRO 739  37.404 -18.593   3.395
    4    HG2  PRO 739           HG2      PRO 739  38.650 -17.030   5.626
    5    HG3  PRO 739           HG3      PRO 739  37.120 -17.932   5.611
    6    HD2  PRO 739           HD2      PRO 739  39.447 -18.994   6.650
    7    HD3  PRO 739           HD3      PRO 739  38.183 -19.975   5.856

  No H/Q in entry =           7
  In of MODEL   19
    1    H    LEU 740           H        LEU 740  41.010 -18.316   1.510
    2    HA   LEU 740           HA       LEU 740  42.210 -15.860   2.525
    3    HB2  LEU 740           HB2      LEU 740  43.563 -18.176   1.180
    4    HB3  LEU 740           HB3      LEU 740  44.224 -16.562   1.094
    5    HG   LEU 740           HG       LEU 740  43.843 -18.215   3.590
    6   HD11  LEU 740          HD11      LEU 740  46.272 -17.299   2.065
    7   HD13  LEU 740          HD12      LEU 740  45.641 -18.938   2.157
    8   HD12  LEU 740          HD13      LEU 740  46.296 -18.168   3.607
    9   HD23  LEU 740          HD21      LEU 740  45.064 -16.374   4.707
   10   HD22  LEU 740          HD22      LEU 740  43.495 -15.857   4.108
   11   HD21  LEU 740          HD23      LEU 740  44.959 -15.424   3.222

  No H/Q in entry =          11
  In of MODEL   19
    1    H    THR 741           H        THR 741  43.458 -15.014   0.432
    2    HA   THR 741           HA       THR 741  41.606 -15.235  -1.783
    3    HB   THR 741           HB       THR 741  42.856 -12.599  -1.006
    4    HG1  THR 741           HG1      THR 741  40.293 -13.469  -0.026
    5   HG21  THR 741          HG21      THR 741  41.587 -12.915  -3.121
    6   HG23  THR 741          HG22      THR 741  40.905 -11.673  -2.061
    7   HG22  THR 741          HG23      THR 741  40.161 -13.268  -2.153

  No H/Q in entry =           7
  In of MODEL   19
    1    H    VAL 742           H        VAL 742  42.724 -14.996  -3.793
    2    HA   VAL 742           HA       VAL 742  45.104 -16.304  -3.862
    3    HB   VAL 742           HB       VAL 742  43.784 -16.390  -5.851
    4   HG12  VAL 742          HG11      VAL 742  44.229 -13.476  -6.164
    5   HG11  VAL 742          HG12      VAL 742  42.719 -14.282  -5.664
    6   HG13  VAL 742          HG13      VAL 742  43.414 -14.591  -7.264
    7   HG23  VAL 742          HG21      VAL 742  46.120 -14.728  -6.656
    8   HG22  VAL 742          HG22      VAL 742  45.327 -16.014  -7.585
    9   HG21  VAL 742          HG23      VAL 742  46.291 -16.394  -6.142

  No H/Q in entry =           9
  In of MODEL   19
    1    H    CYS 743           H        CYS 743  44.986 -12.706  -4.251
    2    HA   CYS 743           HA       CYS 743  47.779 -12.629  -4.553
    3    HB2  CYS 743           HB2      CYS 743  46.337 -10.727  -5.224
    4    HB3  CYS 743           HB3      CYS 743  46.028 -10.394  -3.525

  No H/Q in entry =           4
  In of MODEL   19
    1    H    LYS 744           H        LYS 744  45.730 -12.146  -1.650
    2    HA   LYS 744           HA       LYS 744  47.608 -11.735   0.279
    3    HB2  LYS 744           HB2      LYS 744  45.295 -13.659   0.474
    4    HB3  LYS 744           HB3      LYS 744  46.282 -13.156   1.831
    5    HG2  LYS 744           HG2      LYS 744  45.505 -10.798   1.385
    6    HG3  LYS 744           HG3      LYS 744  44.418 -11.474   0.169
    7    HD2  LYS 744           HD2      LYS 744  43.393 -12.905   1.890
    8    HD3  LYS 744           HD3      LYS 744  44.432 -12.163   3.102
    9    HE2  LYS 744           HE2      LYS 744  42.266 -11.127   3.205
   10    HE3  LYS 744           HE3      LYS 744  43.412  -9.964   2.553
   11    HZ2  LYS 744           HZ1      LYS 744  41.254 -10.051   1.357
   12    HZ1  LYS 744           HZ2      LYS 744  41.588 -11.616   0.877
   13    HZ3  LYS 744           HZ3      LYS 744  42.555 -10.341   0.343

  No H/Q in entry =          13
  In of MODEL   19
    1    H    MET 745           H        MET 745  46.567 -14.983  -0.733
    2    HA   MET 745           HA       MET 745  48.407 -16.563   0.650
    3    HB2  MET 745           HB2      MET 745  46.811 -17.764  -0.344
    4    HB3  MET 745           HB3      MET 745  46.834 -16.875  -1.859
    5    HG2  MET 745           HG2      MET 745  47.699 -18.986  -2.418
    6    HG3  MET 745           HG3      MET 745  49.094 -17.966  -2.255
    7    HE2  MET 745           HE1      MET 745  47.802 -21.161   0.743
    8    HE1  MET 745           HE2      MET 745  46.984 -20.745  -0.764
    9    HE3  MET 745           HE3      MET 745  46.938 -19.636   0.603

  No H/Q in entry =           9
  In of MODEL   19
    1    H    HIS 746           H        HIS 746  48.748 -15.270  -2.676
    2    HA   HIS 746           HA       HIS 746  51.317 -16.389  -3.142
    3    HB2  HIS 746           HB2      HIS 746  49.779 -14.215  -4.395
    4    HB3  HIS 746           HB3      HIS 746  51.487 -14.350  -4.842
    5    HD1  HIS 746           HD1      HIS 746  52.016 -16.875  -5.897
    6    HD2  HIS 746           HD2      HIS 746  48.094 -15.547  -5.849
    7    HE1  HIS 746           HE1      HIS 746  50.852 -18.138  -7.738
    8    HE2  HIS 746           HE2      HIS 746  48.503 -17.232  -7.761

  No H/Q in entry =           8
  In of MODEL   19
    1    H    VAL 747           H        VAL 747  50.370 -13.212  -1.985
    2    HA   VAL 747           HA       VAL 747  52.953 -12.148  -1.742
    3    HB   VAL 747           HB       VAL 747  50.263 -11.484  -0.551
    4   HG12  VAL 747          HG11      VAL 747  51.260  -9.434   0.352
    5   HG11  VAL 747          HG12      VAL 747  52.856 -10.029  -0.122
    6   HG13  VAL 747          HG13      VAL 747  51.931 -10.877   1.107
    7   HG22  VAL 747          HG21      VAL 747  50.579 -10.967  -2.897
    8   HG21  VAL 747          HG22      VAL 747  52.045 -10.067  -2.523
    9   HG23  VAL 747          HG23      VAL 747  50.481  -9.480  -1.952

  No H/Q in entry =           9
  In of MODEL   19
    1    H    LEU 748           H        LEU 748  50.796 -13.707   0.505
    2    HA   LEU 748           HA       LEU 748  52.385 -13.797   2.764
    3    HB2  LEU 748           HB2      LEU 748  50.120 -14.271   2.981
    4    HB3  LEU 748           HB3      LEU 748  50.096 -15.317   1.604
    5    HG   LEU 748           HG       LEU 748  51.332 -16.197   4.205
    6   HD13  LEU 748          HD11      LEU 748  49.035 -15.352   4.627
    7   HD12  LEU 748          HD12      LEU 748  49.100 -17.108   4.738
    8   HD11  LEU 748          HD13      LEU 748  48.437 -16.344   3.296
    9   HD22  LEU 748          HD21      LEU 748  50.712 -18.391   3.333
   10   HD21  LEU 748          HD22      LEU 748  51.701 -17.540   2.139
   11   HD23  LEU 748          HD23      LEU 748  49.954 -17.638   1.928

  No H/Q in entry =          11
  In of MODEL   19
    1    H    HIS 749           H        HIS 749  52.374 -15.763  -0.085
    2    HA   HIS 749           HA       HIS 749  54.206 -17.729   0.822
    3    HB2  HIS 749           HB2      HIS 749  52.561 -17.948  -1.115
    4    HB3  HIS 749           HB3      HIS 749  53.683 -16.970  -2.051
    5    HD1  HIS 749           HD1      HIS 749  55.616 -18.226  -3.153
    6    HD2  HIS 749           HD2      HIS 749  53.554 -20.442  -0.333
    7    HE1  HIS 749           HE1      HIS 749  56.562 -20.525  -3.323
    8    HE2  HIS 749           HE2      HIS 749  55.503 -21.793  -1.434

  No H/Q in entry =           8
  In of MODEL   19
    1    H    CYS 750           H        CYS 750  54.591 -14.544  -0.773
    2    HA   CYS 750           HA       CYS 750  57.406 -15.076  -1.007
    3    HB2  CYS 750           HB2      CYS 750  57.621 -12.709  -1.953
    4    HB3  CYS 750           HB3      CYS 750  56.660 -13.828  -2.868

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLN 751           H        GLN 751  55.320 -13.641   1.243
    2    HA   GLN 751           HA       GLN 751  57.306 -12.295   2.744
    3    HB2  GLN 751           HB2      GLN 751  54.630 -13.458   3.533
    4    HB3  GLN 751           HB3      GLN 751  55.642 -12.537   4.629
    5    HG2  GLN 751           HG2      GLN 751  54.544 -11.497   2.029
    6    HG3  GLN 751           HG3      GLN 751  53.786 -11.234   3.589
    7   HE21  GLN 751          HE21      GLN 751  54.768  -9.241   1.735
    8   HE22  GLN 751          HE22      GLN 751  55.950  -8.327   2.549

  No H/Q in entry =           8
  In of MODEL   19
    1    H    GLY 752           H        GLY 752  56.336 -15.567   2.398
    2    HA3  GLY 752           HA2      GLY 752  58.063 -17.238   2.816
    3    HA2  GLY 752           HA3      GLY 752  58.508 -16.322   4.246

  No H/Q in entry =           3
  In of MODEL   19
    1    H    ARG 753           H        ARG 753  55.211 -17.183   3.265
    2    HA   ARG 753           HA       ARG 753  55.088 -18.788   5.711
    3    HB2  ARG 753           HB2      ARG 753  52.853 -17.482   4.184
    4    HB3  ARG 753           HB3      ARG 753  52.679 -18.391   5.675
    5    HG2  ARG 753           HG2      ARG 753  54.127 -15.767   5.334
    6    HG3  ARG 753           HG3      ARG 753  52.555 -16.017   6.096
    7    HD2  ARG 753           HD2      ARG 753  53.640 -17.469   7.782
    8    HD3  ARG 753           HD3      ARG 753  55.205 -17.098   7.060
    9    HE   ARG 753           HE       ARG 753  53.779 -14.757   7.765
   10   HH11  ARG 753          HH11      ARG 753  55.778 -17.357   9.194
   11   HH12  ARG 753          HH12      ARG 753  56.282 -16.424  10.515
   12   HH21  ARG 753          HH21      ARG 753  54.534 -13.470   9.642
   13   HH22  ARG 753          HH22      ARG 753  55.593 -14.199  10.749

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ASN 754           H        ASN 754  53.901 -20.733   5.643
    2    HA   ASN 754           HA       ASN 754  54.025 -22.033   3.008
    3    HB2  ASN 754           HB2      ASN 754  54.186 -23.299   5.754
    4    HB3  ASN 754           HB3      ASN 754  54.358 -24.130   4.214
    5   HD21  ASN 754          HD21      ASN 754  55.835 -22.111   6.548
    6   HD22  ASN 754          HD22      ASN 754  57.436 -22.138   5.887

  No H/Q in entry =           6
  In of MODEL   19
    1    H    TYR 755           H        TYR 755  52.071 -22.227   2.195
    2    HA   TYR 755           HA       TYR 755  49.914 -23.252   3.867
    3    HB2  TYR 755           HB2      TYR 755  49.774 -20.834   2.060
    4    HB3  TYR 755           HB3      TYR 755  48.362 -21.801   2.439
    5    HD1  TYR 755           HD1      TYR 755  51.148 -20.345   4.513
    6    HD2  TYR 755           HD2      TYR 755  46.972 -20.696   3.868
    7    HE1  TYR 755           HE1      TYR 755  50.739 -18.922   6.457
    8    HE2  TYR 755           HE2      TYR 755  46.545 -19.273   5.798
    9    HH   TYR 755           HH       TYR 755  47.757 -18.682   7.939

  No H/Q in entry =           9
  In of MODEL   19
    1    H    THR 756           H        THR 756  48.237 -24.245   2.533
    2    HA   THR 756           HA       THR 756  49.267 -25.216  -0.043
    3    HB   THR 756           HB       THR 756  47.733 -26.740   2.085
    4    HG1  THR 756           HG1      THR 756  49.656 -27.121   2.844
    5   HG22  THR 756          HG21      THR 756  48.140 -28.719   0.687
    6   HG21  THR 756          HG22      THR 756  48.892 -27.683  -0.541
    7   HG23  THR 756          HG23      THR 756  47.178 -27.506  -0.162

  No H/Q in entry =           7
  In of MODEL   19
    1    H    LEU 757           H        LEU 757  47.687 -25.429  -1.713
    2    HA   LEU 757           HA       LEU 757  45.176 -24.056  -1.174
    3    HB2  LEU 757           HB2      LEU 757  46.551 -24.795  -3.754
    4    HB3  LEU 757           HB3      LEU 757  44.888 -24.264  -3.720
    5    HG   LEU 757           HG       LEU 757  46.244 -22.428  -4.363
    6   HD11  LEU 757          HD11      LEU 757  44.384 -21.876  -2.954
    7   HD13  LEU 757          HD12      LEU 757  45.720 -20.767  -2.656
    8   HD12  LEU 757          HD13      LEU 757  45.377 -22.056  -1.511
    9   HD22  LEU 757          HD21      LEU 757  48.407 -23.152  -3.502
   10   HD21  LEU 757          HD22      LEU 757  47.857 -22.879  -1.851
   11   HD23  LEU 757          HD23      LEU 757  48.048 -21.514  -2.951

  No H/Q in entry =          11
  In of MODEL   19
    1    H    THR 758           H        THR 758  43.488 -25.160  -0.624
    2    HA   THR 758           HA       THR 758  43.277 -27.916  -1.497
    3    HB   THR 758           HB       THR 758  41.490 -27.920   0.367
    4    HG1  THR 758           HG1      THR 758  41.192 -26.093   1.311
    5   HG22  THR 758          HG21      THR 758  43.202 -28.232   2.111
    6   HG21  THR 758          HG22      THR 758  44.396 -27.450   1.074
    7   HG23  THR 758          HG23      THR 758  43.691 -28.992   0.596

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLY 759           H        GLY 759  40.533 -28.298  -1.274
    2    HA3  GLY 759           HA2      GLY 759  39.644 -27.114  -3.741
    3    HA2  GLY 759           HA3      GLY 759  38.756 -28.249  -2.732

  No H/Q in entry =           3
  In of MODEL   19
    1    H    ARG 760           H        ARG 760  37.433 -26.167  -3.884
    2    HA   ARG 760           HA       ARG 760  37.385 -23.837  -2.229
    3    HB2  ARG 760           HB2      ARG 760  35.713 -22.995  -3.692
    4    HB3  ARG 760           HB3      ARG 760  36.686 -24.019  -4.727
    5    HG2  ARG 760           HG2      ARG 760  34.652 -24.762  -5.400
    6    HG3  ARG 760           HG3      ARG 760  34.802 -25.795  -3.975
    7    HD2  ARG 760           HD2      ARG 760  33.755 -23.640  -2.797
    8    HD3  ARG 760           HD3      ARG 760  33.093 -23.402  -4.412
    9    HE   ARG 760           HE       ARG 760  32.776 -26.039  -3.338
   10   HH11  ARG 760          HH11      ARG 760  31.142 -22.948  -3.977
   11   HH12  ARG 760          HH12      ARG 760  29.676 -23.435  -3.244
   12   HH21  ARG 760          HH21      ARG 760  30.797 -26.644  -2.312
   13   HH22  ARG 760          HH22      ARG 760  29.460 -25.588  -2.305

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ASP 761           H        ASP 761  36.077 -26.921  -1.971
    2    HA   ASP 761           HA       ASP 761  33.904 -26.150  -0.171
    3    HB2  ASP 761           HB2      ASP 761  34.711 -28.766  -1.399
    4    HB3  ASP 761           HB3      ASP 761  33.583 -28.703  -0.052

  No H/Q in entry =           4
  In of MODEL   19
    1    H    SER 762           H        SER 762  37.034 -26.275   0.343
    2    HA   SER 762           HA       SER 762  36.831 -27.982   2.673
    3    HB2  SER 762           HB2      SER 762  39.290 -27.551   2.981
    4    HB3  SER 762           HB3      SER 762  38.861 -28.348   1.467
    5    HG   SER 762           HG       SER 762  39.051 -26.291   0.439

  No H/Q in entry =           5
  In of MODEL   19
    1    H    CYS 763           H        CYS 763  36.728 -24.631   1.938
    2    HA   CYS 763           HA       CYS 763  36.602 -24.124   4.818
    3    HB2  CYS 763           HB2      CYS 763  37.573 -21.979   4.553
    4    HB3  CYS 763           HB3      CYS 763  38.648 -23.094   3.721

  No H/Q in entry =           4
  In of MODEL   19
    1    H    THR 764           H        THR 764  35.365 -21.978   5.132
    2    HA   THR 764           HA       THR 764  33.033 -22.020   3.398
    3    HB   THR 764           HB       THR 764  33.503 -20.462   5.963
    4    HG1  THR 764           HG1      THR 764  33.416 -22.992   5.855
    5   HG22  THR 764          HG21      THR 764  30.960 -21.200   4.495
    6   HG21  THR 764          HG22      THR 764  31.714 -19.606   4.504
    7   HG23  THR 764          HG23      THR 764  31.057 -20.275   5.998

  No H/Q in entry =           7
  In of MODEL   19
    1    H    LEU 765           H        LEU 765  33.427 -20.880   1.638
    2    HA   LEU 765           HA       LEU 765  35.208 -18.617   1.746
    3    HB2  LEU 765           HB2      LEU 765  34.874 -20.531  -0.092
    4    HB3  LEU 765           HB3      LEU 765  33.674 -19.356  -0.623
    5    HG   LEU 765           HG       LEU 765  35.431 -17.659  -0.852
    6   HD11  LEU 765          HD11      LEU 765  37.226 -19.919  -0.061
    7   HD13  LEU 765          HD12      LEU 765  36.963 -18.420   0.824
    8   HD12  LEU 765          HD13      LEU 765  37.777 -18.393  -0.741
    9   HD23  LEU 765          HD21      LEU 765  36.514 -18.633  -2.817
   10   HD22  LEU 765          HD22      LEU 765  34.798 -19.029  -2.781
   11   HD21  LEU 765          HD23      LEU 765  35.991 -20.241  -2.313

  No H/Q in entry =          11
  In of MODEL   19
    1    HA   PRO 766           HA       PRO 766  31.887 -15.792   2.508
    2    HB2  PRO 766           HB2      PRO 766  33.079 -13.528   1.435
    3    HB3  PRO 766           HB3      PRO 766  33.351 -14.142   3.068
    4    HG2  PRO 766           HG2      PRO 766  35.023 -14.461   0.624
    5    HG3  PRO 766           HG3      PRO 766  35.524 -14.251   2.309
    6    HD2  PRO 766           HD2      PRO 766  35.591 -16.632   1.046
    7    HD3  PRO 766           HD3      PRO 766  35.272 -16.530   2.778

  No H/Q in entry =           7
  In of MODEL   19
    1    H    ALA 767           H        ALA 767  33.332 -15.888  -0.667
    2    HA   ALA 767           HA       ALA 767  30.664 -15.539  -1.788
    3    HB3  ALA 767           HB1      ALA 767  31.534 -14.230  -3.639
    4    HB2  ALA 767           HB2      ALA 767  33.148 -14.267  -2.921
    5    HB1  ALA 767           HB3      ALA 767  31.836 -13.403  -2.111

  No H/Q in entry =           5
  In of MODEL   19
    1    H    SER 768           H        SER 768  30.362 -17.517  -2.106
    2    HA   SER 768           HA       SER 768  31.935 -18.802  -4.183
    3    HB2  SER 768           HB2      SER 768  31.393 -20.947  -2.866
    4    HB3  SER 768           HB3      SER 768  32.723 -19.947  -2.274
    5    HG   SER 768           HG       SER 768  31.469 -19.307  -0.571

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA 769           H        ALA 769  29.062 -19.509  -2.214
    2    HA   ALA 769           HA       ALA 769  27.459 -19.483  -4.670
    3    HB3  ALA 769           HB1      ALA 769  27.090 -21.240  -2.232
    4    HB1  ALA 769           HB2      ALA 769  27.673 -21.777  -3.808
    5    HB2  ALA 769           HB3      ALA 769  26.018 -21.196  -3.630

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLU 770           H        GLU 770  25.410 -18.547  -4.477
    2    HA   GLU 770           HA       GLU 770  23.931 -17.017  -3.906
    3    HB2  GLU 770           HB2      GLU 770  24.708 -17.759  -1.089
    4    HB3  GLU 770           HB3      GLU 770  23.314 -16.754  -1.492
    5    HG2  GLU 770           HG2      GLU 770  22.330 -18.606  -2.721
    6    HG3  GLU 770           HG3      GLU 770  23.743 -19.599  -2.380

  No H/Q in entry =           6
  In of MODEL   19
    1    H    LYS 771           H        LYS 771  24.584 -15.216  -4.720
    2    HA   LYS 771           HA       LYS 771  26.924 -13.840  -3.654
    3    HB2  LYS 771           HB2      LYS 771  25.375 -12.931  -6.065
    4    HB3  LYS 771           HB3      LYS 771  27.083 -12.766  -5.688
    5    HG2  LYS 771           HG2      LYS 771  25.739 -15.375  -6.391
    6    HG3  LYS 771           HG3      LYS 771  26.646 -14.375  -7.522
    7    HD2  LYS 771           HD2      LYS 771  28.667 -14.986  -6.628
    8    HD3  LYS 771           HD3      LYS 771  28.004 -15.196  -5.006
    9    HE2  LYS 771           HE2      LYS 771  28.670 -17.337  -6.044
   10    HE3  LYS 771           HE3      LYS 771  26.966 -17.264  -5.625
   11    HZ3  LYS 771           HZ1      LYS 771  27.094 -18.237  -7.721
   12    HZ2  LYS 771           HZ2      LYS 771  28.202 -17.180  -8.319
   13    HZ1  LYS 771           HZ3      LYS 771  26.596 -16.677  -8.079

  No H/Q in entry =          13
  In of MODEL   19
    1    H    ALA 772           H        ALA 772  26.691 -12.135  -2.389
    2    HA   ALA 772           HA       ALA 772  24.204 -10.608  -2.453
    3    HB2  ALA 772           HB1      ALA 772  25.459 -11.723   0.046
    4    HB3  ALA 772           HB2      ALA 772  23.972 -12.296  -0.703
    5    HB1  ALA 772           HB3      ALA 772  24.049 -10.663  -0.031

  No H/Q in entry =           5
  In of MODEL   19
    1    H    CYS 773           H        CYS 773  24.458  -8.604  -1.118
    2    HA   CYS 773           HA       CYS 773  26.856  -7.266  -1.812
    3    HB2  CYS 773           HB2      CYS 773  24.543  -6.221  -1.452
    4    HB3  CYS 773           HB3      CYS 773  24.834  -6.403   0.274

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLY 774           H        GLY 774  28.707  -7.110  -0.630
    2    HA3  GLY 774           HA2      GLY 774  29.572  -6.913   1.690
    3    HA2  GLY 774           HA3      GLY 774  28.609  -8.345   2.027

  No H/Q in entry =           3
  In of MODEL   19
    1    H    ALA 775           H        ALA 775  29.299  -9.447  -0.696
    2    HA   ALA 775           HA       ALA 775  32.159  -9.738  -0.547
    3    HB1  ALA 775           HB1      ALA 775  32.138 -12.166  -0.401
    4    HB3  ALA 775           HB2      ALA 775  30.378 -12.163  -0.292
    5    HB2  ALA 775           HB3      ALA 775  31.342 -11.466   1.010

  No H/Q in entry =           5
  In of MODEL   19
    1    H    CYS 776           H        CYS 776  32.462  -9.012  -2.477
    2    HA   CYS 776           HA       CYS 776  32.768 -10.323  -4.704
    3    HB2  CYS 776           HB2      CYS 776  30.864  -9.666  -6.276
    4    HB3  CYS 776           HB3      CYS 776  30.432 -10.886  -5.106

  No H/Q in entry =           4
  In of MODEL   19
    1    HA   PRO 777           HA       PRO 777  34.129  -6.052  -4.248
    2    HB2  PRO 777           HB2      PRO 777  36.752  -6.459  -4.817
    3    HB3  PRO 777           HB3      PRO 777  36.023  -6.749  -3.238
    4    HG2  PRO 777           HG2      PRO 777  36.804  -8.694  -5.345
    5    HG3  PRO 777           HG3      PRO 777  36.828  -8.874  -3.586
    6    HD2  PRO 777           HD2      PRO 777  34.892  -9.895  -5.300
    7    HD3  PRO 777           HD3      PRO 777  34.702  -9.683  -3.552

  No H/Q in entry =           7
  In of MODEL   19
    1    H    LEU 778           H        LEU 778  35.539  -7.858  -6.983
    2    HA   LEU 778           HA       LEU 778  35.636  -5.385  -8.567
    3    HB2  LEU 778           HB2      LEU 778  36.515  -8.200  -9.224
    4    HB3  LEU 778           HB3      LEU 778  36.660  -6.864 -10.326
    5    HG   LEU 778           HG       LEU 778  38.381  -5.857  -8.845
    6   HD12  LEU 778          HD11      LEU 778  39.293  -7.147  -7.023
    7   HD11  LEU 778          HD12      LEU 778  38.039  -8.376  -7.226
    8   HD13  LEU 778          HD13      LEU 778  37.606  -6.745  -6.697
    9   HD21  LEU 778          HD21      LEU 778  39.019  -7.381 -10.636
   10   HD23  LEU 778          HD22      LEU 778  38.840  -8.735  -9.509
   11   HD22  LEU 778          HD23      LEU 778  40.096  -7.534  -9.237

  No H/Q in entry =          11
  In of MODEL   19
    1    H    TRP 779           H        TRP 779  34.613  -8.659  -9.083
    2    HA   TRP 779           HA       TRP 779  33.144  -8.258 -11.445
    3    HB2  TRP 779           HB2      TRP 779  32.571 -10.686 -10.983
    4    HB3  TRP 779           HB3      TRP 779  34.270 -10.279 -11.211
    5    HD1  TRP 779           HD1      TRP 779  31.805 -11.419  -8.465
    6    HE1  TRP 779           HE1      TRP 779  33.188 -12.248  -6.437
    7    HE3  TRP 779           HE3      TRP 779  36.455 -10.064 -10.016
    8    HZ2  TRP 779           HZ2      TRP 779  35.914 -12.293  -5.632
    9    HZ3  TRP 779           HZ3      TRP 779  38.391 -10.549  -8.567
   10    HH2  TRP 779           HH2      TRP 779  38.102 -11.629  -6.432

  No H/Q in entry =          10
  In of MODEL   19
    1    H    GLY 780           H        GLY 780  32.196  -7.448  -8.406
    2    HA3  GLY 780           HA2      GLY 780  29.431  -7.982  -9.104
    3    HA2  GLY 780           HA3      GLY 780  30.005  -8.445  -7.511

  No H/Q in entry =           3
  In of MODEL   19
    1    H    LYS 781           H        LYS 781  28.010  -6.550  -8.293
    2    HA   LYS 781           HA       LYS 781  29.083  -4.369  -6.728
    3    HB2  LYS 781           HB2      LYS 781  29.353  -3.773  -9.119
    4    HB3  LYS 781           HB3      LYS 781  27.616  -3.946  -9.323
    5    HG2  LYS 781           HG2      LYS 781  28.248  -1.613  -9.112
    6    HG3  LYS 781           HG3      LYS 781  27.242  -2.118  -7.753
    7    HD2  LYS 781           HD2      LYS 781  29.222  -2.359  -6.354
    8    HD3  LYS 781           HD3      LYS 781  30.252  -1.922  -7.721
    9    HE2  LYS 781           HE2      LYS 781  28.145  -0.172  -6.485
   10    HE3  LYS 781           HE3      LYS 781  29.868  -0.077  -6.142
   11    HZ3  LYS 781           HZ1      LYS 781  29.212   1.570  -7.771
   12    HZ2  LYS 781           HZ2      LYS 781  28.569   0.406  -8.772
   13    HZ1  LYS 781           HZ3      LYS 781  30.230   0.459  -8.525

  No H/Q in entry =          13
  In of MODEL   19
    1    H    CYS 782           H        CYS 782  27.739  -3.953  -5.165
    2    HA   CYS 782           HA       CYS 782  24.889  -4.314  -5.622
    3    HB2  CYS 782           HB2      CYS 782  24.723  -4.518  -3.123
    4    HB3  CYS 782           HB3      CYS 782  25.560  -5.854  -3.903

  No H/Q in entry =           4
  In of MODEL   19
    1    H    ASP 783           H        ASP 783  23.798  -2.499  -5.680
    2    HA   ASP 783           HA       ASP 783  25.106  -0.100  -4.627
    3    HB2  ASP 783           HB2      ASP 783  24.475  -0.396  -7.148
    4    HB3  ASP 783           HB3      ASP 783  22.827  -0.112  -6.613

  No H/Q in entry =           4
  In of MODEL   19
    1    H    ALA 784           H        ALA 784  22.823   1.533  -4.500
    2    HA   ALA 784           HA       ALA 784  22.075   1.141  -1.873
    3    HB3  ALA 784           HB1      ALA 784  22.004   3.288  -3.052
    4    HB1  ALA 784           HB2      ALA 784  20.526   2.957  -2.148
    5    HB2  ALA 784           HB3      ALA 784  20.553   2.754  -3.898

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLU 785           H        GLU 785  19.991   0.421  -4.705
    2    HA   GLU 785           HA       GLU 785  18.162  -0.838  -2.803
    3    HB2  GLU 785           HB2      GLU 785  16.507  -0.908  -4.719
    4    HB3  GLU 785           HB3      GLU 785  16.956   0.690  -4.160
    5    HG2  GLU 785           HG2      GLU 785  18.457   0.932  -6.056
    6    HG3  GLU 785           HG3      GLU 785  18.022  -0.690  -6.602

  No H/Q in entry =           6
  In of MODEL   19
    1    H    SER 786           H        SER 786  20.693  -2.037  -3.793
    2    HA   SER 786           HA       SER 786  19.469  -4.545  -4.651
    3    HB2  SER 786           HB2      SER 786  22.148  -3.455  -5.534
    4    HB3  SER 786           HB3      SER 786  21.521  -5.055  -5.937
    5    HG   SER 786           HG       SER 786  20.360  -2.552  -6.639

  No H/Q in entry =           5
  In of MODEL   19
    1    H    SER 787           H        SER 787  19.390  -5.658  -2.780
    2    HA   SER 787           HA       SER 787  21.519  -5.695  -0.849
    3    HB2  SER 787           HB2      SER 787  19.114  -7.513  -1.174
    4    HB3  SER 787           HB3      SER 787  20.100  -7.336   0.276
    5    HG   SER 787           HG       SER 787  19.223  -5.469   0.699

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LYS 788           H        LYS 788  20.502  -7.452  -3.608
    2    HA   LYS 788           HA       LYS 788  22.198  -9.747  -3.212
    3    HB2  LYS 788           HB2      LYS 788  21.462 -10.389  -5.442
    4    HB3  LYS 788           HB3      LYS 788  20.069  -9.879  -4.496
    5    HG2  LYS 788           HG2      LYS 788  20.139  -7.671  -5.624
    6    HG3  LYS 788           HG3      LYS 788  21.517  -8.222  -6.556
    7    HD2  LYS 788           HD2      LYS 788  20.174  -9.968  -7.568
    8    HD3  LYS 788           HD3      LYS 788  18.776  -9.472  -6.616
    9    HE2  LYS 788           HE2      LYS 788  20.226  -7.710  -8.593
   10    HE3  LYS 788           HE3      LYS 788  18.748  -8.601  -8.953
   11    HZ1  LYS 788           HZ1      LYS 788  18.976  -6.474  -6.855
   12    HZ3  LYS 788           HZ2      LYS 788  17.573  -7.281  -7.308
   13    HZ2  LYS 788           HZ3      LYS 788  18.343  -6.276  -8.391

  No H/Q in entry =          13
  In of MODEL   19
    1    H    CYS 789           H        CYS 789  23.834 -10.213  -4.962
    2    HA   CYS 789           HA       CYS 789  25.262  -7.756  -5.601
    3    HB2  CYS 789           HB2      CYS 789  26.525  -9.417  -4.311
    4    HB3  CYS 789           HB3      CYS 789  26.186 -10.638  -5.526

  No H/Q in entry =           4
  In of MODEL   19
    1    H    VAL 790           H        VAL 790  25.388  -7.122  -7.671
    2    HA   VAL 790           HA       VAL 790  24.373  -8.965  -9.690
    3    HB   VAL 790           HB       VAL 790  24.705  -5.928  -9.807
    4   HG12  VAL 790          HG11      VAL 790  23.482  -7.817 -11.824
    5   HG11  VAL 790          HG12      VAL 790  25.022  -6.983 -12.012
    6   HG13  VAL 790          HG13      VAL 790  23.520  -6.059 -11.951
    7   HG22  VAL 790          HG21      VAL 790  22.879  -6.615  -8.369
    8   HG21  VAL 790          HG22      VAL 790  22.278  -7.663  -9.658
    9   HG23  VAL 790          HG23      VAL 790  22.249  -5.907  -9.868

  No H/Q in entry =           9
  In of MODEL   19
    1    H    CYS 791           H        CYS 791  25.665  -9.514 -11.307
    2    HA   CYS 791           HA       CYS 791  28.493  -9.083 -10.705
    3    HB2  CYS 791           HB2      CYS 791  27.435 -11.199 -12.576
    4    HB3  CYS 791           HB3      CYS 791  28.912 -11.170 -11.635

  No H/Q in entry =           4
  In of MODEL   19
    1    H    ARG 792           H        ARG 792  29.849  -8.253 -12.053
    2    HA   ARG 792           HA       ARG 792  28.859  -6.831 -14.397
    3    HB2  ARG 792           HB2      ARG 792  31.474  -6.736 -12.873
    4    HB3  ARG 792           HB3      ARG 792  31.125  -5.750 -14.286
    5    HG2  ARG 792           HG2      ARG 792  29.403  -5.681 -11.826
    6    HG3  ARG 792           HG3      ARG 792  30.831  -4.660 -12.007
    7    HD2  ARG 792           HD2      ARG 792  29.916  -3.560 -13.893
    8    HD3  ARG 792           HD3      ARG 792  28.621  -4.734 -14.055
    9    HE   ARG 792           HE       ARG 792  27.554  -3.817 -12.206
   10   HH11  ARG 792          HH11      ARG 792  30.419  -1.937 -13.082
   11   HH12  ARG 792          HH12      ARG 792  29.912  -0.511 -12.296
   12   HH21  ARG 792          HH21      ARG 792  26.857  -1.785 -11.155
   13   HH22  ARG 792          HH22      ARG 792  27.861  -0.415 -11.238

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLU 793           H        GLU 793  30.442  -6.766 -16.287
    2    HA   GLU 793           HA       GLU 793  31.151  -9.469 -17.034
    3    HB2  GLU 793           HB2      GLU 793  31.298  -6.847 -18.533
    4    HB3  GLU 793           HB3      GLU 793  31.808  -8.387 -19.201
    5    HG2  GLU 793           HG2      GLU 793  29.030  -7.706 -18.284
    6    HG3  GLU 793           HG3      GLU 793  29.591  -7.727 -19.957

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ALA 794           H        ALA 794  33.304  -9.785 -18.094
    2    HA   ALA 794           HA       ALA 794  35.270  -9.502 -16.143
    3    HB1  ALA 794           HB1      ALA 794  35.555 -10.236 -19.037
    4    HB2  ALA 794           HB2      ALA 794  35.175 -11.342 -17.719
    5    HB3  ALA 794           HB3      ALA 794  36.745 -10.535 -17.769

  No H/Q in entry =           5
  In of MODEL   19
    1    H    SER 795           H        SER 795  34.632  -7.678 -19.098
    2    HA   SER 795           HA       SER 795  37.075  -6.286 -18.714
    3    HB2  SER 795           HB2      SER 795  35.001  -5.936 -20.871
    4    HB3  SER 795           HB3      SER 795  36.553  -5.093 -20.816
    5    HG   SER 795           HG       SER 795  36.814  -7.760 -20.447

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLU 796           H        GLU 796  34.300  -5.954 -17.111
    2    HA   GLU 796           HA       GLU 796  34.242  -3.043 -17.233
    3    HB2  GLU 796           HB2      GLU 796  32.482  -4.956 -15.689
    4    HB3  GLU 796           HB3      GLU 796  32.279  -3.209 -15.731
    5    HG2  GLU 796           HG2      GLU 796  31.927  -3.358 -18.168
    6    HG3  GLU 796           HG3      GLU 796  32.018  -5.110 -18.042

  No H/Q in entry =           6
  In of MODEL   19
    1    H    CYS 797           H        CYS 797  35.952  -5.342 -15.706
    2    HA   CYS 797           HA       CYS 797  36.196  -3.832 -13.218
    3    HB2  CYS 797           HB2      CYS 797  37.483  -6.425 -14.041
    4    HB3  CYS 797           HB3      CYS 797  37.673  -5.656 -12.467

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLU 798           H        GLU 798  38.540  -5.363 -15.403
    2    HA   GLU 798           HA       GLU 798  40.642  -4.780 -16.087
    3    HB2  GLU 798           HB2      GLU 798  39.544  -1.969 -15.875
    4    HB3  GLU 798           HB3      GLU 798  40.925  -2.488 -16.835
    5    HG2  GLU 798           HG2      GLU 798  39.515  -3.749 -18.296
    6    HG3  GLU 798           HG3      GLU 798  38.116  -3.462 -17.259

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU 799           H        GLU 799  40.237  -5.162 -13.343
    2    HA   GLU 799           HA       GLU 799  41.641  -3.003 -11.997
    3    HB2  GLU 799           HB2      GLU 799  39.475  -3.870 -11.087
    4    HB3  GLU 799           HB3      GLU 799  40.259  -5.414 -10.799
    5    HG2  GLU 799           HG2      GLU 799  40.081  -4.025  -8.778
    6    HG3  GLU 799           HG3      GLU 799  41.754  -4.403  -9.201

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLU 800           H        GLU 800  43.311  -3.574 -10.457
    2    HA   GLU 800           HA       GLU 800  45.257  -5.226 -11.711
    3    HB2  GLU 800           HB2      GLU 800  46.764  -4.409  -9.890
    4    HB3  GLU 800           HB3      GLU 800  46.049  -3.163 -10.904
    5    HG2  GLU 800           HG2      GLU 800  44.480  -2.589  -9.185
    6    HG3  GLU 800           HG3      GLU 800  45.018  -3.936  -8.184

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLY 801           H        GLY 801  43.764  -6.965 -11.313
    2    HA3  GLY 801           HA2      GLY 801  44.386  -8.454  -8.846
    3    HA2  GLY 801           HA3      GLY 801  43.177  -8.928 -10.043

  No H/Q in entry =           3
  In of MODEL   19
    1    H    PHE 802           H        PHE 802  44.478 -11.027  -9.679
    2    HA   PHE 802           HA       PHE 802  46.919 -11.017 -11.277
    3    HB2  PHE 802           HB2      PHE 802  45.721 -13.013  -9.363
    4    HB3  PHE 802           HB3      PHE 802  47.047 -13.430 -10.425
    5    HD1  PHE 802           HD1      PHE 802  47.843 -14.036  -7.992
    6    HD2  PHE 802           HD2      PHE 802  47.493 -10.050  -9.465
    7    HE1  PHE 802           HE1      PHE 802  49.411 -13.287  -6.341
    8    HE2  PHE 802           HE2      PHE 802  49.052  -9.301  -7.810
    9    HZ   PHE 802           HZ       PHE 802  50.044 -10.903  -6.210

  No H/Q in entry =           9
  In of MODEL   19
    1    H    SER 803           H        SER 803  47.082 -13.379 -12.223
    2    HA   SER 803           HA       SER 803  44.745 -13.853 -13.901
    3    HB2  SER 803           HB2      SER 803  46.396 -14.710 -15.586
    4    HB3  SER 803           HB3      SER 803  46.591 -12.985 -15.251
    5    HG   SER 803           HG       SER 803  48.046 -14.968 -13.889

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ILE 804           H        ILE 804  43.886 -15.771 -13.485
    2    HA   ILE 804           HA       ILE 804  45.503 -17.715 -11.994
    3    HB   ILE 804           HB       ILE 804  43.641 -18.308 -10.586
    4   HG12  ILE 804          HG12      ILE 804  41.729 -18.034 -12.184
    5   HG13  ILE 804          HG13      ILE 804  41.429 -17.253 -10.639
    6   HG21  ILE 804          HG21      ILE 804  44.911 -16.405  -9.804
    7   HG23  ILE 804          HG22      ILE 804  43.211 -16.217  -9.350
    8   HG22  ILE 804          HG23      ILE 804  43.859 -15.312 -10.708
    9   HD12  ILE 804          HD11      ILE 804  42.112 -15.903 -13.236
   10   HD11  ILE 804          HD12      ILE 804  42.026 -15.088 -11.679
   11   HD13  ILE 804          HD13      ILE 804  40.590 -15.852 -12.347

  No H/Q in entry =          11
  In of MODEL   19
    1    H    CYS 805           H        CYS 805  44.594 -20.001 -12.161
    2    HA   CYS 805           HA       CYS 805  43.819 -20.330 -14.945
    3    HB2  CYS 805           HB2      CYS 805  45.868 -21.505 -14.148
    4    HB3  CYS 805           HB3      CYS 805  44.814 -22.491 -13.124

  No H/Q in entry =           4
  In of MODEL   19
    1    H    VAL 806           H        VAL 806  41.843 -21.191 -15.415
    2    HA   VAL 806           HA       VAL 806  40.336 -22.411 -13.222
    3    HB   VAL 806           HB       VAL 806  39.157 -20.513 -15.246
    4   HG12  VAL 806          HG11      VAL 806  37.192 -20.528 -13.757
    5   HG11  VAL 806          HG12      VAL 806  37.984 -21.773 -12.776
    6   HG13  VAL 806          HG13      VAL 806  37.575 -22.106 -14.445
    7   HG23  VAL 806          HG21      VAL 806  38.906 -18.901 -13.396
    8   HG22  VAL 806          HG22      VAL 806  40.577 -19.204 -13.851
    9   HG21  VAL 806          HG23      VAL 806  39.916 -19.946 -12.387

  No H/Q in entry =           9
  In of MODEL   19
    1    H    GLU 807           H        GLU 807  39.235 -24.176 -13.795
    2    HA   GLU 807           HA       GLU 807  39.468 -25.227 -16.456
    3    HB2  GLU 807           HB2      GLU 807  39.657 -26.700 -14.520
    4    HB3  GLU 807           HB3      GLU 807  38.073 -26.190 -13.967
    5    HG2  GLU 807           HG2      GLU 807  37.136 -27.148 -16.074
    6    HG3  GLU 807           HG3      GLU 807  38.738 -27.824 -16.389

  No H/Q in entry =           6
  In of MODEL   19
    1    H    VAL 808           H        VAL 808  38.050 -24.848 -17.925
    2    HA   VAL 808           HA       VAL 808  35.305 -24.157 -17.275
    3    HB   VAL 808           HB       VAL 808  36.494 -22.061 -17.592
    4   HG11  VAL 808          HG11      VAL 808  37.327 -23.096 -20.280
    5   HG13  VAL 808          HG12      VAL 808  38.368 -22.741 -18.903
    6   HG12  VAL 808          HG13      VAL 808  37.524 -21.431 -19.731
    7   HG22  VAL 808          HG21      VAL 808  35.215 -21.069 -19.406
    8   HG21  VAL 808          HG22      VAL 808  34.215 -22.098 -18.367
    9   HG23  VAL 808          HG23      VAL 808  34.751 -22.683 -19.950

  No H/Q in entry =           9
  In of MODEL   19
    1    H    ASN 809           H        ASN 809  33.968 -25.330 -18.480
    2    HA   ASN 809           HA       ASN 809  33.086 -26.582 -20.152
    3    HB2  ASN 809           HB2      ASN 809  35.270 -25.219 -21.562
    4    HB3  ASN 809           HB3      ASN 809  34.531 -26.590 -22.430
    5   HD21  ASN 809          HD21      ASN 809  34.377 -23.317 -21.605
    6   HD22  ASN 809          HD22      ASN 809  32.814 -22.957 -22.235

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLY 810           H        GLY 810  35.963 -27.196 -18.745
    2    HA3  GLY 810           HA2      GLY 810  36.261 -29.538 -18.134
    3    HA2  GLY 810           HA3      GLY 810  36.080 -29.911 -19.860

  No H/Q in entry =           3
  In of MODEL   19
    1    H    LYS 811           H        LYS 811  37.619 -27.239 -20.171
    2    HA   LYS 811           HA       LYS 811  40.218 -28.456 -19.803
    3    HB2  LYS 811           HB2      LYS 811  40.925 -26.847 -21.691
    4    HB3  LYS 811           HB3      LYS 811  40.085 -28.334 -22.079
    5    HG2  LYS 811           HG2      LYS 811  39.247 -26.747 -23.394
    6    HG3  LYS 811           HG3      LYS 811  37.986 -27.000 -22.185
    7    HD2  LYS 811           HD2      LYS 811  38.064 -24.638 -22.501
    8    HD3  LYS 811           HD3      LYS 811  38.947 -24.936 -21.007
    9    HE2  LYS 811           HE2      LYS 811  40.154 -23.325 -22.346
   10    HE3  LYS 811           HE3      LYS 811  41.068 -24.828 -22.288
   11    HZ3  LYS 811           HZ1      LYS 811  41.033 -23.931 -24.520
   12    HZ2  LYS 811           HZ2      LYS 811  39.356 -23.912 -24.543
   13    HZ1  LYS 811           HZ3      LYS 811  40.173 -25.376 -24.511

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLU 812           H        GLU 812  41.986 -26.665 -19.779
    2    HA   GLU 812           HA       GLU 812  41.042 -24.831 -17.713
    3    HB2  GLU 812           HB2      GLU 812  43.796 -25.939 -18.167
    4    HB3  GLU 812           HB3      GLU 812  43.483 -24.593 -17.086
    5    HG2  GLU 812           HG2      GLU 812  41.979 -26.011 -15.770
    6    HG3  GLU 812           HG3      GLU 812  42.333 -27.367 -16.842

  No H/Q in entry =           6
  In of MODEL   19
    1    H    GLN 813           H        GLN 813  41.188 -22.763 -17.847
    2    HA   GLN 813           HA       GLN 813  42.729 -21.573 -20.020
    3    HB2  GLN 813           HB2      GLN 813  40.506 -21.628 -20.755
    4    HB3  GLN 813           HB3      GLN 813  39.876 -21.080 -19.204
    5    HG2  GLN 813           HG2      GLN 813  40.958 -18.906 -19.610
    6    HG3  GLN 813           HG3      GLN 813  41.468 -19.469 -21.198
    7   HE21  GLN 813          HE21      GLN 813  39.670 -17.286 -20.417
    8   HE22  GLN 813          HE22      GLN 813  38.179 -17.606 -21.208

  No H/Q in entry =           8
  In of MODEL   19
    1    H    THR 814           H        THR 814  43.758 -19.737 -19.436
    2    HA   THR 814           HA       THR 814  43.839 -19.048 -16.632
    3    HB   THR 814           HB       THR 814  45.197 -17.867 -19.015
    4    HG1  THR 814           HG1      THR 814  45.443 -20.223 -17.967
    5   HG22  THR 814          HG21      THR 814  45.884 -17.702 -16.065
    6   HG21  THR 814          HG22      THR 814  45.209 -16.403 -17.044
    7   HG23  THR 814          HG23      THR 814  46.843 -16.993 -17.370

  No H/Q in entry =           7
  In of MODEL   19
    1    H    MET 815           H        MET 815  42.701 -17.401 -15.829
    2    HA   MET 815           HA       MET 815  41.403 -15.608 -17.754
    3    HB2  MET 815           HB2      MET 815  40.252 -16.483 -15.109
    4    HB3  MET 815           HB3      MET 815  39.457 -15.531 -16.353
    5    HG2  MET 815           HG2      MET 815  39.765 -17.630 -17.845
    6    HG3  MET 815           HG3      MET 815  40.167 -18.388 -16.318
    7    HE2  MET 815           HE1      MET 815  36.568 -19.690 -17.152
    8    HE1  MET 815           HE2      MET 815  38.280 -20.126 -17.050
    9    HE3  MET 815           HE3      MET 815  37.704 -19.118 -18.371

  No H/Q in entry =           9
  In of MODEL   19
    1    H    SER 816           H        SER 816  40.908 -13.549 -16.851
    2    HA   SER 816           HA       SER 816  42.934 -12.527 -15.054
    3    HB2  SER 816           HB2      SER 816  40.442 -11.131 -16.077
    4    HB3  SER 816           HB3      SER 816  41.976 -10.396 -15.604
    5    HG   SER 816           HG       SER 816  42.916 -11.548 -17.397

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLU 817           H        GLU 817  42.385 -11.641 -12.961
    2    HA   GLU 817           HA       GLU 817  40.986 -13.113 -11.204
    3    HB2  GLU 817           HB2      GLU 817  42.438 -10.963 -10.954
    4    HB3  GLU 817           HB3      GLU 817  40.882 -10.146 -10.913
    5    HG2  GLU 817           HG2      GLU 817  41.270 -10.541  -8.649
    6    HG3  GLU 817           HG3      GLU 817  40.328 -11.961  -9.134

  No H/Q in entry =           6
  In of MODEL   19
    1    H    CYS 818           H        CYS 818  39.680 -10.237 -12.849
    2    HA   CYS 818           HA       CYS 818  37.119 -10.376 -11.685
    3    HB2  CYS 818           HB2      CYS 818  37.884  -8.298 -12.604
    4    HB3  CYS 818           HB3      CYS 818  38.011  -9.022 -14.205

  No H/Q in entry =           4
  In of MODEL   19
    1    H    GLU 819           H        GLU 819  38.417 -11.821 -14.566
    2    HA   GLU 819           HA       GLU 819  35.926 -12.306 -15.812
    3    HB2  GLU 819           HB2      GLU 819  38.051 -12.216 -17.007
    4    HB3  GLU 819           HB3      GLU 819  38.577 -13.672 -16.170
    5    HG2  GLU 819           HG2      GLU 819  37.016 -14.983 -17.347
    6    HG3  GLU 819           HG3      GLU 819  36.190 -13.535 -17.951

  No H/Q in entry =           6
  In of MODEL   19
    1    H    ALA 820           H        ALA 820  38.161 -14.419 -14.071
    2    HA   ALA 820           HA       ALA 820  36.558 -16.671 -14.101
    3    HB3  ALA 820           HB1      ALA 820  38.603 -15.766 -12.132
    4    HB1  ALA 820           HB2      ALA 820  38.868 -16.793 -13.544
    5    HB2  ALA 820           HB3      ALA 820  37.935 -17.396 -12.165

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLY 821           H        GLY 821  36.829 -13.957 -11.857
    2    HA3  GLY 821           HA2      GLY 821  35.133 -14.913  -9.809
    3    HA2  GLY 821           HA3      GLY 821  35.581 -13.232 -10.082

  No H/Q in entry =           3
  In of MODEL   19
    1    H    ALA 822           H        ALA 822  34.525 -12.816 -12.582
    2    HA   ALA 822           HA       ALA 822  31.833 -12.274 -12.012
    3    HB1  ALA 822           HB1      ALA 822  33.201 -12.359 -14.714
    4    HB2  ALA 822           HB2      ALA 822  33.186 -10.976 -13.628
    5    HB3  ALA 822           HB3      ALA 822  31.676 -11.547 -14.339

  No H/Q in entry =           5
  In of MODEL   19
    1    H    LEU 823           H        LEU 823  33.419 -14.805 -13.810
    2    HA   LEU 823           HA       LEU 823  31.089 -16.054 -14.722
    3    HB2  LEU 823           HB2      LEU 823  33.819 -17.232 -14.188
    4    HB3  LEU 823           HB3      LEU 823  32.545 -18.042 -15.081
    5    HG   LEU 823           HG       LEU 823  33.871 -15.457 -15.903
    6   HD12  LEU 823          HD11      LEU 823  34.880 -16.715 -17.685
    7   HD11  LEU 823          HD12      LEU 823  34.226 -18.220 -17.020
    8   HD13  LEU 823          HD13      LEU 823  35.406 -17.270 -16.107
    9   HD23  LEU 823          HD21      LEU 823  32.721 -15.866 -18.063
   10   HD22  LEU 823          HD22      LEU 823  31.662 -15.461 -16.726
   11   HD21  LEU 823          HD23      LEU 823  31.778 -17.139 -17.271

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ARG 824           H        ARG 824  32.998 -16.580 -11.745
    2    HA   ARG 824           HA       ARG 824  31.273 -18.639 -10.739
    3    HB2  ARG 824           HB2      ARG 824  33.029 -16.798  -9.058
    4    HB3  ARG 824           HB3      ARG 824  32.267 -18.283  -8.518
    5    HG2  ARG 824           HG2      ARG 824  33.704 -19.462 -10.264
    6    HG3  ARG 824           HG3      ARG 824  34.608 -17.947 -10.371
    7    HD2  ARG 824           HD2      ARG 824  34.190 -19.691  -7.943
    8    HD3  ARG 824           HD3      ARG 824  35.670 -19.538  -8.866
    9    HE   ARG 824           HE       ARG 824  34.772 -17.050  -7.762
   10   HH11  ARG 824          HH11      ARG 824  36.666 -19.991  -7.039
   11   HH12  ARG 824          HH12      ARG 824  37.528 -19.277  -5.751
   12   HH21  ARG 824          HH21      ARG 824  35.982 -16.122  -5.896
   13   HH22  ARG 824          HH22      ARG 824  37.131 -17.105  -5.103

  No H/Q in entry =          13
  In of MODEL   19
    1    H    CYS 825           H        CYS 825  31.019 -15.246 -10.844
    2    HA   CYS 825           HA       CYS 825  29.081 -15.057  -8.736
    3    HB2  CYS 825           HB2      CYS 825  30.660 -13.164  -9.453
    4    HB3  CYS 825           HB3      CYS 825  29.669 -13.023 -10.885

  No H/Q in entry =           4
  In of MODEL   19
    1    H    ARG 826           H        ARG 826  28.990 -14.798 -12.283
    2    HA   ARG 826           HA       ARG 826  26.220 -14.337 -12.476
    3    HB2  ARG 826           HB2      ARG 826  26.482 -14.819 -14.878
    4    HB3  ARG 826           HB3      ARG 826  27.661 -13.645 -14.266
    5    HG2  ARG 826           HG2      ARG 826  29.295 -15.463 -14.171
    6    HG3  ARG 826           HG3      ARG 826  28.106 -16.545 -14.893
    7    HD2  ARG 826           HD2      ARG 826  29.132 -14.000 -16.134
    8    HD3  ARG 826           HD3      ARG 826  29.677 -15.625 -16.537
    9    HE   ARG 826           HE       ARG 826  27.198 -15.972 -17.047
   10   HH11  ARG 826          HH11      ARG 826  28.874 -12.883 -17.563
   11   HH12  ARG 826          HH12      ARG 826  28.147 -12.534 -19.044
   12   HH21  ARG 826          HH21      ARG 826  26.174 -15.504 -19.158
   13   HH22  ARG 826          HH22      ARG 826  26.565 -14.086 -19.992

  No H/Q in entry =          13
  In of MODEL   19
    1    H    GLY 827           H        GLY 827  27.992 -17.355 -12.353
    2    HA3  GLY 827           HA2      GLY 827  26.522 -19.225 -11.613
    3    HA2  GLY 827           HA3      GLY 827  25.414 -18.648 -12.855

  No H/Q in entry =           3
  In of MODEL   19
    1    H    GLN 828           H        GLN 828  28.464 -18.326 -14.033
    2    HA   GLN 828           HA       GLN 828  28.181 -20.382 -15.963
    3    HB2  GLN 828           HB2      GLN 828  29.504 -18.299 -16.318
    4    HB3  GLN 828           HB3      GLN 828  30.666 -18.867 -15.134
    5    HG2  GLN 828           HG2      GLN 828  31.500 -19.221 -17.390
    6    HG3  GLN 828           HG3      GLN 828  31.226 -20.756 -16.574
    7   HE21  GLN 828          HE21      GLN 828  28.601 -18.840 -17.926
    8   HE22  GLN 828          HE22      GLN 828  28.259 -19.919 -19.210

  No H/Q in entry =           8
  In of MODEL   19
    1    H    SER 829           H        SER 829  29.343 -22.402 -16.151
    2    HA   SER 829           HA       SER 829  29.989 -23.544 -13.562
    3    HB2  SER 829           HB2      SER 829  30.070 -24.906 -16.255
    4    HB3  SER 829           HB3      SER 829  29.848 -25.642 -14.667
    5    HG   SER 829           HG       SER 829  28.083 -24.458 -16.360

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ILE 830           H        ILE 830  32.020 -23.107 -12.870
    2    HA   ILE 830           HA       ILE 830  34.237 -23.812 -14.596
    3    HB   ILE 830           HB       ILE 830  35.529 -21.837 -14.140
    4   HG12  ILE 830          HG12      ILE 830  34.632 -21.181 -11.918
    5   HG13  ILE 830          HG13      ILE 830  34.719 -19.821 -13.010
    6   HG22  ILE 830          HG21      ILE 830  34.326 -20.100 -15.419
    7   HG21  ILE 830          HG22      ILE 830  32.875 -21.115 -15.280
    8   HG23  ILE 830          HG23      ILE 830  34.288 -21.714 -16.143
    9   HD11  ILE 830          HD11      ILE 830  32.289 -20.070 -13.447
   10   HD13  ILE 830          HD12      ILE 830  32.679 -19.649 -11.798
   11   HD12  ILE 830          HD13      ILE 830  32.235 -21.312 -12.196

  No H/Q in entry =          11
  In of MODEL   19
    1    H    SER 831           H        SER 831  36.138 -24.192 -13.438
    2    HA   SER 831           HA       SER 831  35.825 -24.349 -10.543
    3    HB2  SER 831           HB2      SER 831  36.876 -26.371 -12.478
    4    HB3  SER 831           HB3      SER 831  37.240 -26.403 -10.755
    5    HG   SER 831           HG       SER 831  35.404 -27.709 -11.528

  No H/Q in entry =           5
  In of MODEL   19
    1    H    VAL 832           H        VAL 832  37.262 -22.835  -9.823
    2    HA   VAL 832           HA       VAL 832  39.590 -22.132 -11.296
    3    HB   VAL 832           HB       VAL 832  38.902 -21.614  -8.389
    4   HG12  VAL 832          HG11      VAL 832  40.973 -20.266 -10.151
    5   HG11  VAL 832          HG12      VAL 832  41.317 -21.363  -8.817
    6   HG13  VAL 832          HG13      VAL 832  40.579 -19.794  -8.495
    7   HG21  VAL 832          HG21      VAL 832  37.265 -20.654  -9.903
    8   HG23  VAL 832          HG22      VAL 832  38.540 -19.844 -10.810
    9   HG22  VAL 832          HG23      VAL 832  38.211 -19.378  -9.141

  No H/Q in entry =           9
  In of MODEL   19
    1    H    THR 833           H        THR 833  41.107 -23.620 -11.639
    2    HA   THR 833           HA       THR 833  41.487 -25.764  -9.810
    3    HB   THR 833           HB       THR 833  43.196 -26.379 -11.622
    4    HG1  THR 833           HG1      THR 833  43.056 -25.263 -13.506
    5   HG22  THR 833          HG21      THR 833  41.396 -27.228 -13.077
    6   HG21  THR 833          HG22      THR 833  40.260 -26.140 -12.278
    7   HG23  THR 833          HG23      THR 833  41.007 -27.455 -11.368

  No H/Q in entry =           7
  In of MODEL   19
    1    H    SER 834           H        SER 834  43.202 -22.910 -10.844
    2    HA   SER 834           HA       SER 834  45.032 -23.338  -8.645
    3    HB2  SER 834           HB2      SER 834  45.983 -23.025 -11.501
    4    HB3  SER 834           HB3      SER 834  47.020 -22.929 -10.082
    5    HG   SER 834           HG       SER 834  45.492 -25.108  -9.942

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ILE 835           H        ILE 835  45.887 -21.522  -7.797
    2    HA   ILE 835           HA       ILE 835  44.685 -18.935  -8.514
    3    HB   ILE 835           HB       ILE 835  45.692 -18.125  -6.496
    4   HG12  ILE 835          HG12      ILE 835  47.323 -20.702  -6.421
    5   HG13  ILE 835          HG13      ILE 835  47.916 -19.095  -6.824
    6   HG23  ILE 835          HG21      ILE 835  44.841 -19.673  -4.807
    7   HG22  ILE 835          HG22      ILE 835  44.774 -20.953  -6.019
    8   HG21  ILE 835          HG23      ILE 835  43.740 -19.534  -6.180
    9   HD11  ILE 835          HD11      ILE 835  47.469 -18.345  -4.613
   10   HD13  ILE 835          HD12      ILE 835  48.527 -19.764  -4.638
   11   HD12  ILE 835          HD13      ILE 835  46.824 -19.939  -4.195

  No H/Q in entry =          11
  In of MODEL   19
    1    H    ARG 836           H        ARG 836  47.146 -20.736  -9.502
    2    HA   ARG 836           HA       ARG 836  48.995 -18.564 -10.175
    3    HB2  ARG 836           HB2      ARG 836  49.288 -21.487 -10.837
    4    HB3  ARG 836           HB3      ARG 836  50.547 -20.272 -10.733
    5    HG2  ARG 836           HG2      ARG 836  50.225 -20.209  -8.280
    6    HG3  ARG 836           HG3      ARG 836  49.036 -21.503  -8.440
    7    HD2  ARG 836           HD2      ARG 836  50.850 -22.749  -9.704
    8    HD3  ARG 836           HD3      ARG 836  51.961 -21.563  -9.025
    9    HE   ARG 836           HE       ARG 836  50.272 -22.923  -7.115
   10   HH11  ARG 836          HH11      ARG 836  53.463 -22.800  -8.636
   11   HH12  ARG 836          HH12      ARG 836  54.172 -23.932  -7.577
   12   HH21  ARG 836          HH21      ARG 836  51.239 -24.471  -5.669
   13   HH22  ARG 836          HH22      ARG 836  52.883 -24.892  -5.821

  No H/Q in entry =          13
  In of MODEL   19
    1    HA   PRO 837           HA       PRO 837  47.091 -18.703 -14.270
    2    HB2  PRO 837           HB2      PRO 837  49.207 -17.932 -15.821
    3    HB3  PRO 837           HB3      PRO 837  48.266 -16.786 -14.864
    4    HG2  PRO 837           HG2      PRO 837  50.911 -18.042 -14.259
    5    HG3  PRO 837           HG3      PRO 837  50.378 -16.374 -13.988
    6    HD2  PRO 837           HD2      PRO 837  50.486 -18.214 -12.005
    7    HD3  PRO 837           HD3      PRO 837  49.282 -16.911 -12.034

  No H/Q in entry =           7
  In of MODEL   19
    1    H    CYS 838           H        CYS 838  47.203 -20.077 -16.217
    2    HA   CYS 838           HA       CYS 838  49.103 -22.149 -15.737
    3    HB2  CYS 838           HB2      CYS 838  47.541 -23.490 -17.398
    4    HB3  CYS 838           HB3      CYS 838  47.228 -23.429 -15.679

  No H/Q in entry =           4
  In of MODEL   19
    1    H    ALA 839           H        ALA 839  49.502 -23.485 -17.949
    2    HA   ALA 839           HA       ALA 839  50.769 -21.614 -19.730
    3    HB3  ALA 839           HB1      ALA 839  50.555 -24.634 -19.805
    4    HB1  ALA 839           HB2      ALA 839  51.871 -23.712 -19.077
    5    HB2  ALA 839           HB3      ALA 839  51.612 -23.650 -20.820

  No H/Q in entry =           5
  In of MODEL   19
    1    H    ALA 840           H        ALA 840  47.885 -21.650 -19.501
    2    HA   ALA 840           HA       ALA 840  46.846 -22.837 -21.920
    3    HB2  ALA 840           HB1      ALA 840  45.575 -22.974 -19.828
    4    HB3  ALA 840           HB2      ALA 840  44.666 -22.080 -21.057
    5    HB1  ALA 840           HB3      ALA 840  45.498 -21.222 -19.764

  No H/Q in entry =           5
  In of MODEL   19
    1    H    GLU 841           H        GLU 841  48.249 -19.925 -20.944
    2    HA   GLU 841           HA       GLU 841  46.889 -18.304 -22.909
    3    HB2  GLU 841           HB2      GLU 841  49.398 -17.731 -21.353
    4    HB3  GLU 841           HB3      GLU 841  48.535 -16.559 -22.342
    5    HG2  GLU 841           HG2      GLU 841  46.548 -17.053 -20.770
    6    HG3  GLU 841           HG3      GLU 841  47.765 -17.766 -19.715

  No H/Q in entry =           6
  In of MODEL   19
    1    H    THR 842           H        THR 842  49.378 -20.497 -22.871
    2    HA   THR 842           HA       THR 842  50.309 -19.484 -25.410
    3    HB   THR 842           HB       THR 842  52.174 -19.448 -23.923
    4    HG1  THR 842           HG1      THR 842  52.982 -20.094 -25.786
    5   HG21  THR 842          HG21      THR 842  51.427 -20.989 -22.183
    6   HG23  THR 842          HG22      THR 842  53.044 -21.434 -22.733
    7   HG22  THR 842          HG23      THR 842  51.641 -22.354 -23.278

  No H/Q in entry =           7
  In of MODEL   19
    1    H    GLN 843           H        GLN 843  49.344 -20.394 -26.904
    2    HA   GLN 843           HA       GLN 843  49.099 -23.279 -27.112
    3    HB2  GLN 843           HB2      GLN 843  46.976 -22.425 -26.043
    4    HB3  GLN 843           HB3      GLN 843  46.761 -21.364 -27.419
    5    HG2  GLN 843           HG2      GLN 843  46.765 -23.486 -28.842
    6    HG3  GLN 843           HG3      GLN 843  46.585 -24.361 -27.324
    7   HE21  GLN 843          HE21      GLN 843  45.144 -21.226 -28.087
    8   HE22  GLN 843          HE22      GLN 843  43.516 -21.760 -28.088

  No H/Q in entry =           8
  In of MODEL   20
    1    H1   GLY 689           H1       GLY 689  63.526   1.503 -26.513
    2    H2   GLY 689           H3       GLY 689  62.447   2.721 -26.047
    3    H3   GLY 689           H2       GLY 689  62.201   1.874 -27.493
    4    HA2  GLY 689           HA2      GLY 689  63.102   4.067 -27.908
    5    HA3  GLY 689           HA3      GLY 689  64.177   2.780 -28.442

  No H/Q in entry =           5
  In of MODEL   20
    1    H    SER 690           H        SER 690  64.912   5.461 -27.813
    2    HA   SER 690           HA       SER 690  66.455   6.671 -26.802
    3    HB2  SER 690           HB2      SER 690  66.145   4.859 -24.392
    4    HB3  SER 690           HB3      SER 690  66.882   6.466 -24.406
    5    HG   SER 690           HG       SER 690  64.469   6.615 -25.513

  No H/Q in entry =           5
  In of MODEL   20
    1    H    HIS 691           H        HIS 691  68.004   6.258 -28.126
    2    HA   HIS 691           HA       HIS 691  69.507   3.784 -27.978
    3    HB2  HIS 691           HB2      HIS 691  68.717   4.544 -30.134
    4    HB3  HIS 691           HB3      HIS 691  69.540   6.076 -29.940
    5    HD1  HIS 691           HD1      HIS 691  71.398   6.126 -31.548
    6    HD2  HIS 691           HD2      HIS 691  70.978   2.362 -29.847
    7    HE1  HIS 691           HE1      HIS 691  73.228   4.727 -32.544
    8    HE2  HIS 691           HE2      HIS 691  73.123   2.579 -31.265

  No H/Q in entry =           8
  In of MODEL   20
    1    H    MET 692           H        MET 692  69.859   7.071 -27.002
    2    HA   MET 692           HA       MET 692  72.745   6.728 -26.811
    3    HB2  MET 692           HB2      MET 692  71.088   9.219 -26.455
    4    HB3  MET 692           HB3      MET 692  72.818   9.123 -26.222
    5    HG2  MET 692           HG2      MET 692  71.591   8.363 -28.828
    6    HG3  MET 692           HG3      MET 692  71.895  10.047 -28.443
    7    HE3  MET 692           HE1      MET 692  74.297   6.697 -27.813
    8    HE2  MET 692           HE2      MET 692  75.135   6.835 -29.348
    9    HE1  MET 692           HE3      MET 692  73.393   6.561 -29.320

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ASN 693           H        ASN 693  70.105   7.889 -24.719
    2    HA   ASN 693           HA       ASN 693  71.866   7.599 -22.443
    3    HB2  ASN 693           HB2      ASN 693  70.098   9.426 -22.689
    4    HB3  ASN 693           HB3      ASN 693  68.889   8.185 -22.419
    5   HD21  ASN 693          HD21      ASN 693  69.481  10.548 -20.870
    6   HD22  ASN 693          HD22      ASN 693  69.835  10.021 -19.265

  No H/Q in entry =           6
  In of MODEL   20
    1    HA   PRO 694           HA       PRO 694  70.447   3.370 -21.988
    2    HB2  PRO 694           HB2      PRO 694  72.101   2.641 -19.994
    3    HB3  PRO 694           HB3      PRO 694  72.672   2.836 -21.656
    4    HG2  PRO 694           HG2      PRO 694  72.948   4.684 -19.325
    5    HG3  PRO 694           HG3      PRO 694  74.117   4.310 -20.600
    6    HD2  PRO 694           HD2      PRO 694  72.535   6.571 -20.539
    7    HD3  PRO 694           HD3      PRO 694  73.240   5.879 -22.014

  No H/Q in entry =           7
  In of MODEL   20
    1    H    LEU 695           H        LEU 695  70.378   5.850 -19.587
    2    HA   LEU 695           HA       LEU 695  68.921   4.159 -17.733
    3    HB2  LEU 695           HB2      LEU 695  69.749   7.053 -17.439
    4    HB3  LEU 695           HB3      LEU 695  69.022   6.068 -16.188
    5    HG   LEU 695           HG       LEU 695  71.760   5.678 -17.395
    6   HD12  LEU 695          HD11      LEU 695  70.911   6.579 -14.656
    7   HD11  LEU 695          HD12      LEU 695  71.637   7.579 -15.910
    8   HD13  LEU 695          HD13      LEU 695  72.569   6.274 -15.177
    9   HD22  LEU 695          HD21      LEU 695  70.777   3.524 -16.818
   10   HD21  LEU 695          HD22      LEU 695  70.370   4.125 -15.210
   11   HD23  LEU 695          HD23      LEU 695  72.058   3.940 -15.680

  No H/Q in entry =          11
  In of MODEL   20
    1    H    THR 696           H        THR 696  67.112   3.818 -18.882
    2    HA   THR 696           HA       THR 696  65.544   6.056 -19.860
    3    HB   THR 696           HB       THR 696  64.174   4.190 -20.826
    4    HG1  THR 696           HG1      THR 696  65.192   2.110 -20.711
    5   HG23  THR 696          HG21      THR 696  65.869   3.555 -22.473
    6   HG22  THR 696          HG22      THR 696  67.131   4.115 -21.369
    7   HG21  THR 696          HG23      THR 696  65.998   5.276 -22.074

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLN 697           H        GLN 697  65.635   3.627 -17.443
    2    HA   GLN 697           HA       GLN 697  64.448   2.991 -15.724
    3    HB2  GLN 697           HB2      GLN 697  64.455   5.480 -15.149
    4    HB3  GLN 697           HB3      GLN 697  62.890   5.571 -15.943
    5    HG2  GLN 697           HG2      GLN 697  62.290   5.446 -13.728
    6    HG3  GLN 697           HG3      GLN 697  62.178   3.766 -14.234
    7   HE21  GLN 697          HE21      GLN 697  65.209   3.538 -14.185
    8   HE22  GLN 697          HE22      GLN 697  65.589   3.422 -12.516

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ALA 698           H        ALA 698  63.675   1.410 -17.221
    2    HA   ALA 698           HA       ALA 698  60.845   1.699 -18.025
    3    HB1  ALA 698           HB1      ALA 698  61.252  -0.204 -19.446
    4    HB3  ALA 698           HB2      ALA 698  62.881  -0.391 -18.794
    5    HB2  ALA 698           HB3      ALA 698  62.483   1.017 -19.778

  No H/Q in entry =           5
  In of MODEL   20
    1    H    VAL 699           H        VAL 699  59.343   0.427 -17.439
    2    HA   VAL 699           HA       VAL 699  59.412  -0.486 -14.871
    3    HB   VAL 699           HB       VAL 699  57.250  -1.508 -15.456
    4   HG13  VAL 699          HG11      VAL 699  57.334   0.767 -14.660
    5   HG12  VAL 699          HG12      VAL 699  56.103   0.659 -15.924
    6   HG11  VAL 699          HG13      VAL 699  57.687   1.352 -16.285
    7   HG21  VAL 699          HG21      VAL 699  57.639  -2.086 -17.786
    8   HG23  VAL 699          HG22      VAL 699  57.761  -0.380 -18.212
    9   HG22  VAL 699          HG23      VAL 699  56.225  -1.042 -17.649

  No H/Q in entry =           9
  In of MODEL   20
    1    HA   PRO 700           HA       PRO 700  61.337  -4.441 -15.548
    2    HB2  PRO 700           HB2      PRO 700  61.193  -5.348 -13.024
    3    HB3  PRO 700           HB3      PRO 700  62.321  -4.065 -13.482
    4    HG2  PRO 700           HG2      PRO 700  59.663  -3.856 -12.127
    5    HG3  PRO 700           HG3      PRO 700  61.174  -2.989 -11.789
    6    HD2  PRO 700           HD2      PRO 700  59.111  -1.914 -13.222
    7    HD3  PRO 700           HD3      PRO 700  60.809  -1.450 -13.440

  No H/Q in entry =           7
  In of MODEL   20
    1    H    LYS 701           H        LYS 701  60.828  -6.648 -15.400
    2    HA   LYS 701           HA       LYS 701  57.973  -7.057 -15.650
    3    HB2  LYS 701           HB2      LYS 701  60.286  -8.855 -16.419
    4    HB3  LYS 701           HB3      LYS 701  58.603  -9.309 -16.572
    5    HG2  LYS 701           HG2      LYS 701  59.299  -8.656 -18.740
    6    HG3  LYS 701           HG3      LYS 701  58.336  -7.322 -18.107
    7    HD2  LYS 701           HD2      LYS 701  60.343  -6.078 -17.579
    8    HD3  LYS 701           HD3      LYS 701  61.346  -7.429 -18.104
    9    HE2  LYS 701           HE2      LYS 701  59.435  -5.891 -19.872
   10    HE3  LYS 701           HE3      LYS 701  61.177  -5.651 -19.804
   11    HZ3  LYS 701           HZ1      LYS 701  60.568  -7.031 -21.656
   12    HZ2  LYS 701           HZ2      LYS 701  59.824  -8.159 -20.666
   13    HZ1  LYS 701           HZ3      LYS 701  61.482  -7.927 -20.578

  No H/Q in entry =          13
  In of MODEL   20
    1    H    CYS 702           H        CYS 702  57.291  -7.097 -13.567
    2    HA   CYS 702           HA       CYS 702  58.339  -9.296 -11.938
    3    HB2  CYS 702           HB2      CYS 702  56.720  -6.936 -10.826
    4    HB3  CYS 702           HB3      CYS 702  57.433  -8.272 -10.034

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLN 703           H        GLN 703  56.624 -10.151 -10.454
    2    HA   GLN 703           HA       GLN 703  54.238 -10.571 -12.046
    3    HB2  GLN 703           HB2      GLN 703  55.113 -11.847  -9.456
    4    HB3  GLN 703           HB3      GLN 703  53.671 -12.282 -10.354
    5    HG2  GLN 703           HG2      GLN 703  56.517 -12.615 -11.290
    6    HG3  GLN 703           HG3      GLN 703  55.444 -13.894 -10.735
    7   HE21  GLN 703          HE21      GLN 703  56.269 -11.777 -13.312
    8   HE22  GLN 703          HE22      GLN 703  55.295 -12.514 -14.531

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ARG 704           H        ARG 704  52.131 -10.529 -10.690
    2    HA   ARG 704           HA       ARG 704  51.872  -7.805  -9.885
    3    HB2  ARG 704           HB2      ARG 704  49.900 -10.059  -9.924
    4    HB3  ARG 704           HB3      ARG 704  49.473  -8.410  -9.492
    5    HG2  ARG 704           HG2      ARG 704  49.946  -7.622 -11.662
    6    HG3  ARG 704           HG3      ARG 704  50.750  -9.123 -12.120
    7    HD2  ARG 704           HD2      ARG 704  48.623 -10.311 -11.846
    8    HD3  ARG 704           HD3      ARG 704  47.836  -8.790 -11.449
    9    HE   ARG 704           HE       ARG 704  48.057  -8.085 -13.661
   10   HH11  ARG 704          HH11      ARG 704  49.511 -11.320 -13.313
   11   HH12  ARG 704          HH12      ARG 704  49.241 -11.735 -14.949
   12   HH21  ARG 704          HH21      ARG 704  47.732  -8.732 -15.915
   13   HH22  ARG 704          HH22      ARG 704  48.256 -10.281 -16.417

  No H/Q in entry =          13
  In of MODEL   20
    1    H    TRP 705           H        TRP 705  52.714 -10.465  -8.053
    2    HA   TRP 705           HA       TRP 705  51.805  -9.234  -5.540
    3    HB2  TRP 705           HB2      TRP 705  52.605 -11.405  -4.545
    4    HB3  TRP 705           HB3      TRP 705  51.239 -11.546  -5.640
    5    HD1  TRP 705           HD1      TRP 705  54.854 -12.579  -5.212
    6    HE1  TRP 705           HE1      TRP 705  55.452 -14.292  -7.003
    7    HE3  TRP 705           HE3      TRP 705  50.655 -12.232  -8.092
    8    HZ2  TRP 705           HZ2      TRP 705  54.268 -15.421  -9.332
    9    HZ3  TRP 705           HZ3      TRP 705  50.463 -13.643 -10.074
   10    HH2  TRP 705           HH2      TRP 705  52.232 -15.214 -10.691

  No H/Q in entry =          10
  In of MODEL   20
    1    H    GLU 706           H        GLU 706  54.159  -8.768  -7.596
    2    HA   GLU 706           HA       GLU 706  56.187  -8.303  -5.558
    3    HB2  GLU 706           HB2      GLU 706  56.535  -9.013  -8.481
    4    HB3  GLU 706           HB3      GLU 706  57.844  -8.487  -7.413
    5    HG2  GLU 706           HG2      GLU 706  57.500 -10.478  -6.085
    6    HG3  GLU 706           HG3      GLU 706  56.148 -10.947  -7.120

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LYS 707           H        LYS 707  57.297  -6.401  -5.675
    2    HA   LYS 707           HA       LYS 707  56.022  -4.272  -7.256
    3    HB2  LYS 707           HB2      LYS 707  56.676  -4.103  -4.303
    4    HB3  LYS 707           HB3      LYS 707  56.085  -2.791  -5.305
    5    HG2  LYS 707           HG2      LYS 707  53.994  -4.000  -5.654
    6    HG3  LYS 707           HG3      LYS 707  54.588  -5.318  -4.644
    7    HD2  LYS 707           HD2      LYS 707  53.119  -3.933  -3.332
    8    HD3  LYS 707           HD3      LYS 707  54.771  -3.699  -2.758
    9    HE2  LYS 707           HE2      LYS 707  53.569  -1.582  -2.890
   10    HE3  LYS 707           HE3      LYS 707  54.911  -1.612  -4.029
   11    HZ3  LYS 707           HZ1      LYS 707  53.321  -2.110  -5.806
   12    HZ2  LYS 707           HZ2      LYS 707  52.903  -0.689  -5.003
   13    HZ1  LYS 707           HZ3      LYS 707  52.057  -2.097  -4.690

  No H/Q in entry =          13
  In of MODEL   20
    1    H    LEU 708           H        LEU 708  57.321  -2.445  -7.510
    2    HA   LEU 708           HA       LEU 708  60.183  -2.998  -7.504
    3    HB2  LEU 708           HB2      LEU 708  59.221  -2.251  -9.600
    4    HB3  LEU 708           HB3      LEU 708  58.495  -0.867  -8.816
    5    HG   LEU 708           HG       LEU 708  60.759   0.046  -8.392
    6   HD12  LEU 708          HD11      LEU 708  62.667  -0.890  -9.627
    7   HD11  LEU 708          HD12      LEU 708  61.683  -2.305 -10.026
    8   HD13  LEU 708          HD13      LEU 708  62.073  -1.943  -8.351
    9   HD21  LEU 708          HD21      LEU 708  60.126  -0.567 -11.275
   10   HD23  LEU 708          HD22      LEU 708  61.212   0.703 -10.713
   11   HD22  LEU 708          HD23      LEU 708  59.492   0.781 -10.330

  No H/Q in entry =          11
  In of MODEL   20
    1    H    GLN 709           H        GLN 709  61.261  -2.307  -5.767
    2    HA   GLN 709           HA       GLN 709  60.918   0.440  -4.944
    3    HB2  GLN 709           HB2      GLN 709  60.600   0.062  -2.628
    4    HB3  GLN 709           HB3      GLN 709  59.475  -1.049  -3.384
    5    HG2  GLN 709           HG2      GLN 709  61.147  -2.869  -3.051
    6    HG3  GLN 709           HG3      GLN 709  62.160  -1.700  -2.197
    7   HE21  GLN 709          HE21      GLN 709  62.077  -2.878  -0.278
    8   HE22  GLN 709          HE22      GLN 709  60.652  -2.913   0.689

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ASN 710           H        ASN 710  62.852   1.262  -4.177
    2    HA   ASN 710           HA       ASN 710  65.115   1.399  -3.726
    3    HB2  ASN 710           HB2      ASN 710  64.394  -0.402  -2.023
    4    HB3  ASN 710           HB3      ASN 710  65.020  -1.584  -3.159
    5   HD21  ASN 710          HD21      ASN 710  65.751   0.926  -0.995
    6   HD22  ASN 710          HD22      ASN 710  67.451   0.649  -0.843

  No H/Q in entry =           6
  In of MODEL   20
    1    H    SER 711           H        SER 711  63.954   0.659  -6.306
    2    HA   SER 711           HA       SER 711  64.580   0.393  -8.413
    3    HB2  SER 711           HB2      SER 711  67.366   0.215  -7.283
    4    HB3  SER 711           HB3      SER 711  66.976   0.492  -8.994
    5    HG   SER 711           HG       SER 711  65.671   2.329  -7.943

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ARG 712           H        ARG 712  64.232  -1.963  -6.418
    2    HA   ARG 712           HA       ARG 712  65.110  -4.046  -8.301
    3    HB2  ARG 712           HB2      ARG 712  65.579  -5.533  -6.422
    4    HB3  ARG 712           HB3      ARG 712  66.602  -4.111  -6.335
    5    HG2  ARG 712           HG2      ARG 712  65.162  -3.167  -4.626
    6    HG3  ARG 712           HG3      ARG 712  64.075  -4.547  -4.760
    7    HD2  ARG 712           HD2      ARG 712  65.456  -4.852  -2.830
    8    HD3  ARG 712           HD3      ARG 712  65.955  -6.009  -4.058
    9    HE   ARG 712           HE       ARG 712  67.602  -3.878  -4.430
   10   HH11  ARG 712          HH11      ARG 712  66.814  -5.961  -1.694
   11   HH12  ARG 712          HH12      ARG 712  68.313  -5.812  -0.927
   12   HH21  ARG 712          HH21      ARG 712  69.742  -3.658  -3.360
   13   HH22  ARG 712          HH22      ARG 712  70.008  -4.495  -1.911

  No H/Q in entry =          13
  In of MODEL   20
    1    H    CYS 713           H        CYS 713  63.821  -6.139  -7.858
    2    HA   CYS 713           HA       CYS 713  61.058  -5.363  -7.330
    3    HB2  CYS 713           HB2      CYS 713  61.594  -6.426  -9.608
    4    HB3  CYS 713           HB3      CYS 713  61.973  -7.909  -8.726

  No H/Q in entry =           4
  In of MODEL   20
    1    H    VAL 714           H        VAL 714  60.115  -6.086  -5.582
    2    HA   VAL 714           HA       VAL 714  61.154  -8.443  -4.176
    3    HB   VAL 714           HB       VAL 714  60.754  -7.301  -1.988
    4   HG13  VAL 714          HG11      VAL 714  62.747  -5.865  -1.987
    5   HG12  VAL 714          HG12      VAL 714  62.736  -5.873  -3.749
    6   HG11  VAL 714          HG13      VAL 714  63.030  -7.370  -2.866
    7   HG23  VAL 714          HG21      VAL 714  60.524  -4.846  -1.932
    8   HG22  VAL 714          HG22      VAL 714  59.152  -5.632  -2.719
    9   HG21  VAL 714          HG23      VAL 714  60.390  -4.845  -3.691

  No H/Q in entry =           9
  In of MODEL   20
    1    H    CYS 715           H        CYS 715  59.376  -8.914  -2.305
    2    HA   CYS 715           HA       CYS 715  56.916  -9.061  -3.814
    3    HB2  CYS 715           HB2      CYS 715  57.794 -10.380  -1.255
    4    HB3  CYS 715           HB3      CYS 715  56.135 -10.448  -1.817

  No H/Q in entry =           4
  In of MODEL   20
    1    H    LYS 716           H        LYS 716  54.965  -8.561  -2.982
    2    HA   LYS 716           HA       LYS 716  54.684  -6.135  -1.466
    3    HB2  LYS 716           HB2      LYS 716  53.372  -6.797  -3.493
    4    HB3  LYS 716           HB3      LYS 716  52.757  -8.176  -2.632
    5    HG2  LYS 716           HG2      LYS 716  51.549  -6.634  -1.123
    6    HG3  LYS 716           HG3      LYS 716  52.119  -5.281  -2.111
    7    HD2  LYS 716           HD2      LYS 716  51.090  -6.334  -4.100
    8    HD3  LYS 716           HD3      LYS 716  50.469  -7.621  -3.075
    9    HE2  LYS 716           HE2      LYS 716  48.703  -6.078  -3.465
   10    HE3  LYS 716           HE3      LYS 716  49.227  -5.883  -1.795
   11    HZ3  LYS 716           HZ1      LYS 716  50.454  -3.911  -2.429
   12    HZ2  LYS 716           HZ2      LYS 716  48.848  -3.769  -2.876
   13    HZ1  LYS 716           HZ3      LYS 716  50.002  -4.101  -4.051

  No H/Q in entry =          13
  In of MODEL   20
    1    H    MET 717           H        MET 717  53.189  -6.271   0.572
    2    HA   MET 717           HA       MET 717  53.501  -8.846   1.905
    3    HB2  MET 717           HB2      MET 717  53.212  -6.060   2.887
    4    HB3  MET 717           HB3      MET 717  52.690  -7.380   3.915
    5    HG2  MET 717           HG2      MET 717  54.929  -6.724   4.433
    6    HG3  MET 717           HG3      MET 717  54.906  -8.381   3.799
    7    HE2  MET 717           HE1      MET 717  55.882  -4.674   3.273
    8    HE1  MET 717           HE2      MET 717  54.692  -4.964   2.017
    9    HE3  MET 717           HE3      MET 717  56.381  -4.654   1.573

  No H/Q in entry =           9
  In of MODEL   20
    1    HA   PRO 718           HA       PRO 718  49.429 -10.094   1.413
    2    HB2  PRO 718           HB2      PRO 718  48.855 -11.351   3.771
    3    HB3  PRO 718           HB3      PRO 718  49.902 -12.039   2.522
    4    HG2  PRO 718           HG2      PRO 718  50.631 -10.600   5.037
    5    HG3  PRO 718           HG3      PRO 718  51.365 -12.048   4.322
    6    HD2  PRO 718           HD2      PRO 718  52.472  -9.604   4.106
    7    HD3  PRO 718           HD3      PRO 718  52.607 -10.815   2.816

  No H/Q in entry =           7
  In of MODEL   20
    1    H    TYR 719           H        TYR 719  50.044  -8.228   4.229
    2    HA   TYR 719           HA       TYR 719  47.273  -7.641   4.722
    3    HB2  TYR 719           HB2      TYR 719  48.269  -5.996   6.402
    4    HB3  TYR 719           HB3      TYR 719  48.543  -7.707   6.684
    5    HD1  TYR 719           HD1      TYR 719  50.162  -4.560   5.475
    6    HD2  TYR 719           HD2      TYR 719  50.731  -8.580   6.760
    7    HE1  TYR 719           HE1      TYR 719  52.546  -4.152   5.670
    8    HE2  TYR 719           HE2      TYR 719  53.126  -8.181   6.955
    9    HH   TYR 719           HH       TYR 719  54.449  -5.062   6.879

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLU 720           H        GLU 720  49.460  -6.552   2.499
    2    HA   GLU 720           HA       GLU 720  48.315  -3.861   2.364
    3    HB2  GLU 720           HB2      GLU 720  50.870  -4.382   2.432
    4    HB3  GLU 720           HB3      GLU 720  50.674  -4.973   0.799
    5    HG2  GLU 720           HG2      GLU 720  49.880  -2.165   1.477
    6    HG3  GLU 720           HG3      GLU 720  51.573  -2.565   1.253

  No H/Q in entry =           6
  In of MODEL   20
    1    H    CYS 721           H        CYS 721  47.325  -6.589   1.662
    2    HA   CYS 721           HA       CYS 721  46.993  -7.180  -1.006
    3    HB2  CYS 721           HB2      CYS 721  46.352  -8.806   0.474
    4    HB3  CYS 721           HB3      CYS 721  45.386  -7.742   1.464

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLY 722           H        GLY 722  45.483  -6.772  -2.566
    2    HA3  GLY 722           HA2      GLY 722  43.510  -4.673  -2.055
    3    HA2  GLY 722           HA3      GLY 722  44.506  -4.686  -3.515

  No H/Q in entry =           3
  In of MODEL   20
    1    HA   PRO 723           HA       PRO 723  40.669  -6.852  -4.843
    2    HB2  PRO 723           HB2      PRO 723  41.930  -6.310  -7.471
    3    HB3  PRO 723           HB3      PRO 723  40.289  -5.946  -6.914
    4    HG2  PRO 723           HG2      PRO 723  42.051  -3.996  -7.200
    5    HG3  PRO 723           HG3      PRO 723  40.950  -4.018  -5.810
    6    HD2  PRO 723           HD2      PRO 723  43.832  -4.828  -5.950
    7    HD3  PRO 723           HD3      PRO 723  42.996  -3.841  -4.730

  No H/Q in entry =           7
  In of MODEL   20
    1    H    SER 724           H        SER 724  40.642  -9.018  -4.839
    2    HA   SER 724           HA       SER 724  42.252 -10.671  -6.540
    3    HB2  SER 724           HB2      SER 724  43.323 -11.775  -4.533
    4    HB3  SER 724           HB3      SER 724  43.977 -10.208  -5.021
    5    HG   SER 724           HG       SER 724  42.735  -9.255  -3.382

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU 725           H        LEU 725  41.675 -12.794  -6.437
    2    HA   LEU 725           HA       LEU 725  38.944 -13.355  -5.826
    3    HB2  LEU 725           HB2      LEU 725  40.956 -14.341  -7.442
    4    HB3  LEU 725           HB3      LEU 725  40.515 -15.640  -6.348
    5    HG   LEU 725           HG       LEU 725  39.303 -15.855  -8.231
    6   HD12  LEU 725          HD11      LEU 725  37.468 -14.614  -6.239
    7   HD11  LEU 725          HD12      LEU 725  37.990 -16.309  -6.267
    8   HD13  LEU 725          HD13      LEU 725  36.964 -15.656  -7.564
    9   HD22  LEU 725          HD21      LEU 725  39.328 -13.932  -9.402
   10   HD21  LEU 725          HD22      LEU 725  38.569 -13.007  -8.088
   11   HD23  LEU 725          HD23      LEU 725  37.628 -14.161  -9.021

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ASP 726           H        ASP 726  38.104 -14.441  -4.151
    2    HA   ASP 726           HA       ASP 726  39.646 -15.037  -1.796
    3    HB2  ASP 726           HB2      ASP 726  36.895 -16.114  -2.414
    4    HB3  ASP 726           HB3      ASP 726  37.627 -15.882  -0.838

  No H/Q in entry =           4
  In of MODEL   20
    1    H    VAL 727           H        VAL 727  40.467 -16.990  -1.180
    2    HA   VAL 727           HA       VAL 727  39.710 -19.377  -2.673
    3    HB   VAL 727           HB       VAL 727  42.120 -20.130  -2.746
    4   HG11  VAL 727          HG11      VAL 727  41.381 -17.754  -4.444
    5   HG13  VAL 727          HG12      VAL 727  40.974 -19.440  -4.773
    6   HG12  VAL 727          HG13      VAL 727  42.655 -18.914  -4.818
    7   HG23  VAL 727          HG21      VAL 727  43.873 -18.389  -2.769
    8   HG22  VAL 727          HG22      VAL 727  43.096 -18.535  -1.196
    9   HG21  VAL 727          HG23      VAL 727  42.671 -17.198  -2.267

  No H/Q in entry =           9
  In of MODEL   20
    1    H    CYS 728           H        CYS 728  40.190 -21.355  -1.582
    2    HA   CYS 728           HA       CYS 728  40.369 -20.984   1.306
    3    HB2  CYS 728           HB2      CYS 728  39.459 -23.339  -0.331
    4    HB3  CYS 728           HB3      CYS 728  39.405 -23.219   1.426

  No H/Q in entry =           4
  In of MODEL   20
    1    H    ALA 729           H        ALA 729  42.163 -21.617   2.322
    2    HA   ALA 729           HA       ALA 729  43.909 -23.389   0.819
    3    HB1  ALA 729           HB1      ALA 729  44.755 -20.948   2.318
    4    HB3  ALA 729           HB2      ALA 729  44.659 -21.114   0.558
    5    HB2  ALA 729           HB3      ALA 729  45.810 -22.090   1.479

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLN 730           H        GLN 730  45.377 -24.443   2.029
    2    HA   GLN 730           HA       GLN 730  44.577 -24.925   4.799
    3    HB2  GLN 730           HB2      GLN 730  44.536 -26.906   3.270
    4    HB3  GLN 730           HB3      GLN 730  46.237 -26.620   2.964
    5    HG2  GLN 730           HG2      GLN 730  46.814 -27.000   5.229
    6    HG3  GLN 730           HG3      GLN 730  45.136 -27.189   5.698
    7   HE21  GLN 730          HE21      GLN 730  45.359 -29.260   6.428
    8   HE22  GLN 730          HE22      GLN 730  45.709 -30.596   5.403

  No H/Q in entry =           8
  In of MODEL   20
    1    H    ASP 731           H        ASP 731  45.901 -24.270   6.255
    2    HA   ASP 731           HA       ASP 731  48.440 -23.066   5.634
    3    HB2  ASP 731           HB2      ASP 731  46.935 -22.257   7.479
    4    HB3  ASP 731           HB3      ASP 731  47.263 -23.752   8.344

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLU 732           H        GLU 732  50.436 -24.108   5.701
    2    HA   GLU 732           HA       GLU 732  50.325 -26.945   6.179
    3    HB2  GLU 732           HB2      GLU 732  52.465 -25.188   5.042
    4    HB3  GLU 732           HB3      GLU 732  52.707 -26.905   5.342
    5    HG2  GLU 732           HG2      GLU 732  50.609 -25.706   3.546
    6    HG3  GLU 732           HG3      GLU 732  52.118 -26.450   3.018

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ARG 733           H        ARG 733  50.988 -24.375   8.180
    2    HA   ARG 733           HA       ARG 733  52.942 -25.886   9.716
    3    HB2  ARG 733           HB2      ARG 733  53.364 -23.463   9.308
    4    HB3  ARG 733           HB3      ARG 733  51.852 -23.081  10.111
    5    HG2  ARG 733           HG2      ARG 733  53.707 -22.677  11.598
    6    HG3  ARG 733           HG3      ARG 733  52.746 -24.030  12.198
    7    HD2  ARG 733           HD2      ARG 733  55.093 -24.563  12.398
    8    HD3  ARG 733           HD3      ARG 733  54.343 -25.586  11.171
    9    HE   ARG 733           HE       ARG 733  55.816 -23.163  10.420
   10   HH11  ARG 733          HH11      ARG 733  55.361 -26.705  10.105
   11   HH12  ARG 733          HH12      ARG 733  56.625 -26.874   8.982
   12   HH21  ARG 733          HH21      ARG 733  57.576 -23.484   8.841
   13   HH22  ARG 733          HH22      ARG 733  57.900 -25.033   8.247

  No H/Q in entry =          13
  In of MODEL   20
    1    H    SER 734           H        SER 734  49.795 -24.365   9.897
    2    HA   SER 734           HA       SER 734  49.203 -25.541  12.463
    3    HB2  SER 734           HB2      SER 734  47.393 -24.030  10.618
    4    HB3  SER 734           HB3      SER 734  47.169 -24.310  12.346
    5    HG   SER 734           HG       SER 734  49.420 -23.211  12.365

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LYS 735           H        LYS 735  48.536 -26.223   9.098
    2    HA   LYS 735           HA       LYS 735  47.245 -27.643   7.983
    3    HB2  LYS 735           HB2      LYS 735  47.487 -29.418  10.431
    4    HB3  LYS 735           HB3      LYS 735  47.011 -29.943   8.825
    5    HG2  LYS 735           HG2      LYS 735  49.722 -28.854   9.596
    6    HG3  LYS 735           HG3      LYS 735  49.330 -30.546   9.327
    7    HD2  LYS 735           HD2      LYS 735  49.127 -28.375   7.223
    8    HD3  LYS 735           HD3      LYS 735  50.509 -29.439   7.417
    9    HE2  LYS 735           HE2      LYS 735  48.973 -31.383   7.008
   10    HE3  LYS 735           HE3      LYS 735  47.685 -30.227   6.669
   11    HZ2  LYS 735           HZ1      LYS 735  50.228 -30.519   5.154
   12    HZ1  LYS 735           HZ2      LYS 735  49.100 -29.344   4.811
   13    HZ3  LYS 735           HZ3      LYS 735  48.712 -30.983   4.609

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ARG 736           H        ARG 736  45.727 -26.043   8.108
    2    HA   ARG 736           HA       ARG 736  43.203 -27.024   9.082
    3    HB2  ARG 736           HB2      ARG 736  42.587 -25.032  10.227
    4    HB3  ARG 736           HB3      ARG 736  44.081 -25.623  10.946
    5    HG2  ARG 736           HG2      ARG 736  45.349 -23.966   9.786
    6    HG3  ARG 736           HG3      ARG 736  43.917 -23.430   8.910
    7    HD2  ARG 736           HD2      ARG 736  44.394 -23.273  11.864
    8    HD3  ARG 736           HD3      ARG 736  44.396 -21.962  10.664
    9    HE   ARG 736           HE       ARG 736  41.994 -23.549  11.278
   10   HH11  ARG 736          HH11      ARG 736  43.493 -20.354  10.761
   11   HH12  ARG 736          HH12      ARG 736  42.072 -19.494  10.963
   12   HH21  ARG 736          HH21      ARG 736  40.013 -22.332  11.600
   13   HH22  ARG 736          HH22      ARG 736  40.043 -20.641  11.476

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ILE 737           H        ILE 737  41.479 -25.930   7.997
    2    HA   ILE 737           HA       ILE 737  42.341 -24.809   5.434
    3    HB   ILE 737           HB       ILE 737  39.560 -25.595   6.306
    4   HG12  ILE 737          HG12      ILE 737  41.111 -27.543   6.413
    5   HG13  ILE 737          HG13      ILE 737  39.868 -27.730   5.189
    6   HG23  ILE 737          HG21      ILE 737  39.097 -25.639   3.904
    7   HG22  ILE 737          HG22      ILE 737  40.770 -25.193   3.570
    8   HG21  ILE 737          HG23      ILE 737  39.711 -24.062   4.410
    9   HD12  ILE 737          HD11      ILE 737  42.731 -26.939   4.731
   10   HD11  ILE 737          HD12      ILE 737  41.466 -27.045   3.504
   11   HD13  ILE 737          HD13      ILE 737  41.979 -28.503   4.360

  No H/Q in entry =          11
  In of MODEL   20
    1    H    LEU 738           H        LEU 738  42.262 -22.652   5.234
    2    HA   LEU 738           HA       LEU 738  40.208 -21.254   6.717
    3    HB2  LEU 738           HB2      LEU 738  41.635 -19.448   7.418
    4    HB3  LEU 738           HB3      LEU 738  42.317 -20.943   8.012
    5    HG   LEU 738           HG       LEU 738  43.342 -19.331   5.661
    6   HD13  LEU 738          HD11      LEU 738  43.696 -18.185   7.766
    7   HD12  LEU 738          HD12      LEU 738  45.222 -18.803   7.127
    8   HD11  LEU 738          HD13      LEU 738  44.419 -19.639   8.455
    9   HD22  LEU 738          HD21      LEU 738  43.766 -21.668   5.443
   10   HD21  LEU 738          HD22      LEU 738  44.485 -21.725   7.057
   11   HD23  LEU 738          HD23      LEU 738  45.273 -20.800   5.751

  No H/Q in entry =          11
  In of MODEL   20
    1    HA   PRO 739           HA       PRO 739  39.438 -19.153   2.916
    2    HB2  PRO 739           HB2      PRO 739  38.178 -16.970   3.917
    3    HB3  PRO 739           HB3      PRO 739  37.415 -18.574   3.960
    4    HG2  PRO 739           HG2      PRO 739  38.865 -17.130   6.136
    5    HG3  PRO 739           HG3      PRO 739  37.324 -18.014   6.195
    6    HD2  PRO 739           HD2      PRO 739  39.705 -19.158   6.979
    7    HD3  PRO 739           HD3      PRO 739  38.369 -20.081   6.234

  No H/Q in entry =           7
  In of MODEL   20
    1    H    LEU 740           H        LEU 740  41.014 -18.178   1.815
    2    HA   LEU 740           HA       LEU 740  42.366 -15.837   2.973
    3    HB2  LEU 740           HB2      LEU 740  43.493 -17.982   1.173
    4    HB3  LEU 740           HB3      LEU 740  44.292 -16.462   1.474
    5    HG   LEU 740           HG       LEU 740  43.782 -18.649   3.499
    6   HD13  LEU 740          HD11      LEU 740  46.210 -18.876   3.446
    7   HD12  LEU 740          HD12      LEU 740  46.303 -17.590   2.237
    8   HD11  LEU 740          HD13      LEU 740  45.530 -19.112   1.831
    9   HD22  LEU 740          HD21      LEU 740  45.123 -17.293   5.015
   10   HD21  LEU 740          HD22      LEU 740  43.680 -16.403   4.526
   11   HD23  LEU 740          HD23      LEU 740  45.250 -16.035   3.787

  No H/Q in entry =          11
  In of MODEL   20
    1    H    THR 741           H        THR 741  43.572 -14.876   0.867
    2    HA   THR 741           HA       THR 741  41.665 -14.801  -1.327
    3    HB   THR 741           HB       THR 741  43.232 -12.359  -0.581
    4    HG1  THR 741           HG1      THR 741  40.657 -12.895   0.565
    5   HG23  THR 741          HG21      THR 741  41.299 -11.273  -1.608
    6   HG22  THR 741          HG22      THR 741  40.505 -12.856  -1.739
    7   HG21  THR 741          HG23      THR 741  41.994 -12.540  -2.632

  No H/Q in entry =           7
  In of MODEL   20
    1    H    VAL 742           H        VAL 742  42.816 -14.362  -3.359
    2    HA   VAL 742           HA       VAL 742  45.275 -15.655  -3.360
    3    HB   VAL 742           HB       VAL 742  45.512 -15.236  -5.669
    4   HG13  VAL 742          HG11      VAL 742  43.512 -16.247  -6.539
    5   HG12  VAL 742          HG12      VAL 742  42.662 -15.798  -5.060
    6   HG11  VAL 742          HG13      VAL 742  43.970 -16.985  -4.994
    7   HG21  VAL 742          HG21      VAL 742  44.834 -12.993  -5.851
    8   HG23  VAL 742          HG22      VAL 742  43.128 -13.495  -5.596
    9   HG22  VAL 742          HG23      VAL 742  44.071 -14.098  -6.990

  No H/Q in entry =           9
  In of MODEL   20
    1    H    CYS 743           H        CYS 743  44.635 -12.285  -3.021
    2    HA   CYS 743           HA       CYS 743  47.137 -11.244  -3.762
    3    HB2  CYS 743           HB2      CYS 743  46.580  -9.445  -2.085
    4    HB3  CYS 743           HB3      CYS 743  45.279  -9.771  -3.232

  No H/Q in entry =           4
  In of MODEL   20
    1    H    LYS 744           H        LYS 744  45.886 -12.226  -0.721
    2    HA   LYS 744           HA       LYS 744  48.024 -11.919   0.966
    3    HB2  LYS 744           HB2      LYS 744  45.555 -12.205   1.279
    4    HB3  LYS 744           HB3      LYS 744  45.793 -13.907   1.082
    5    HG2  LYS 744           HG2      LYS 744  47.108 -14.081   3.065
    6    HG3  LYS 744           HG3      LYS 744  47.142 -12.323   3.251
    7    HD2  LYS 744           HD2      LYS 744  44.625 -13.989   3.301
    8    HD3  LYS 744           HD3      LYS 744  45.493 -13.451   4.740
    9    HE2  LYS 744           HE2      LYS 744  45.101 -11.117   4.125
   10    HE3  LYS 744           HE3      LYS 744  44.315 -11.611   2.628
   11    HZ1  LYS 744           HZ1      LYS 744  43.333 -12.222   5.360
   12    HZ3  LYS 744           HZ2      LYS 744  42.553 -12.626   3.935
   13    HZ2  LYS 744           HZ3      LYS 744  42.743 -11.011   4.360

  No H/Q in entry =          13
  In of MODEL   20
    1    H    MET 745           H        MET 745  46.612 -14.844  -0.418
    2    HA   MET 745           HA       MET 745  48.501 -16.707   0.339
    3    HB2  MET 745           HB2      MET 745  46.596 -17.686  -0.387
    4    HB3  MET 745           HB3      MET 745  46.351 -16.550  -1.699
    5    HG2  MET 745           HG2      MET 745  46.809 -18.551  -2.766
    6    HG3  MET 745           HG3      MET 745  48.296 -17.649  -2.801
    7    HE3  MET 745           HE1      MET 745  46.653 -19.989  -0.008
    8    HE2  MET 745           HE2      MET 745  47.531 -21.476  -0.409
    9    HE1  MET 745           HE3      MET 745  46.470 -20.734  -1.592

  No H/Q in entry =           9
  In of MODEL   20
    1    H    HIS 746           H        HIS 746  48.342 -14.862  -2.766
    2    HA   HIS 746           HA       HIS 746  50.538 -16.154  -4.046
    3    HB2  HIS 746           HB2      HIS 746  49.012 -13.710  -4.476
    4    HB3  HIS 746           HB3      HIS 746  50.680 -13.591  -5.067
    5    HD1  HIS 746           HD1      HIS 746  51.145 -15.927  -6.663
    6    HD2  HIS 746           HD2      HIS 746  47.313 -14.371  -6.330
    7    HE1  HIS 746           HE1      HIS 746  49.954 -16.648  -8.732
    8    HE2  HIS 746           HE2      HIS 746  47.611 -15.850  -8.463

  No H/Q in entry =           8
  In of MODEL   20
    1    H    VAL 747           H        VAL 747  50.314 -13.203  -2.239
    2    HA   VAL 747           HA       VAL 747  52.973 -12.484  -2.393
    3    HB   VAL 747           HB       VAL 747  50.597 -11.674  -0.817
    4   HG12  VAL 747          HG11      VAL 747  53.400 -10.714  -0.283
    5   HG11  VAL 747          HG12      VAL 747  52.424 -11.692   0.816
    6   HG13  VAL 747          HG13      VAL 747  51.923 -10.053   0.419
    7   HG21  VAL 747          HG21      VAL 747  52.548 -10.236  -2.567
    8   HG23  VAL 747          HG22      VAL 747  51.111  -9.524  -1.818
    9   HG22  VAL 747          HG23      VAL 747  50.941 -10.796  -3.026

  No H/Q in entry =           9
  In of MODEL   20
    1    H    LEU 748           H        LEU 748  51.189 -14.140   0.244
    2    HA   LEU 748           HA       LEU 748  53.525 -14.372   1.777
    3    HB2  LEU 748           HB2      LEU 748  52.275 -16.014   3.191
    4    HB3  LEU 748           HB3      LEU 748  51.435 -14.502   2.954
    5    HG   LEU 748           HG       LEU 748  50.029 -15.710   1.238
    6   HD13  LEU 748          HD11      LEU 748  49.837 -18.129   1.429
    7   HD12  LEU 748          HD12      LEU 748  51.217 -18.149   2.524
    8   HD11  LEU 748          HD13      LEU 748  51.432 -17.648   0.846
    9   HD23  LEU 748          HD21      LEU 748  49.884 -16.594   4.111
   10   HD22  LEU 748          HD22      LEU 748  48.573 -16.703   2.936
   11   HD21  LEU 748          HD23      LEU 748  49.187 -15.126   3.422

  No H/Q in entry =          11
  In of MODEL   20
    1    H    HIS 749           H        HIS 749  52.299 -16.195  -0.807
    2    HA   HIS 749           HA       HIS 749  53.749 -18.584  -0.386
    3    HB2  HIS 749           HB2      HIS 749  51.749 -18.058  -1.996
    4    HB3  HIS 749           HB3      HIS 749  53.022 -17.601  -3.120
    5    HD1  HIS 749           HD1      HIS 749  54.461 -19.535  -4.108
    6    HD2  HIS 749           HD2      HIS 749  51.529 -20.728  -1.428
    7    HE1  HIS 749           HE1      HIS 749  54.332 -22.025  -4.325
    8    HE2  HIS 749           HE2      HIS 749  52.787 -22.726  -2.468

  No H/Q in entry =           8
  In of MODEL   20
    1    H    CYS 750           H        CYS 750  54.495 -15.506  -1.998
    2    HA   CYS 750           HA       CYS 750  57.051 -16.591  -2.814
    3    HB2  CYS 750           HB2      CYS 750  57.509 -14.496  -3.928
    4    HB3  CYS 750           HB3      CYS 750  55.867 -14.975  -4.321

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLN 751           H        GLN 751  55.733 -14.857  -0.137
    2    HA   GLN 751           HA       GLN 751  58.116 -13.713   0.845
    3    HB2  GLN 751           HB2      GLN 751  55.580 -14.610   2.210
    4    HB3  GLN 751           HB3      GLN 751  56.910 -13.851   3.062
    5    HG2  GLN 751           HG2      GLN 751  55.440 -12.540   0.791
    6    HG3  GLN 751           HG3      GLN 751  54.994 -12.334   2.481
    7   HE21  GLN 751          HE21      GLN 751  55.755 -10.212   0.756
    8   HE22  GLN 751          HE22      GLN 751  57.190  -9.524   1.382

  No H/Q in entry =           8
  In of MODEL   20
    1    H    GLY 752           H        GLY 752  56.754 -16.901   0.961
    2    HA3  GLY 752           HA2      GLY 752  58.585 -18.627   1.213
    3    HA2  GLY 752           HA3      GLY 752  58.999 -17.762   2.681

  No H/Q in entry =           3
  In of MODEL   20
    1    H    ARG 753           H        ARG 753  55.683 -17.794   2.169
    2    HA   ARG 753           HA       ARG 753  55.317 -19.737   4.287
    3    HB2  ARG 753           HB2      ARG 753  53.392 -17.905   2.856
    4    HB3  ARG 753           HB3      ARG 753  52.976 -18.952   4.205
    5    HG2  ARG 753           HG2      ARG 753  55.052 -16.795   4.366
    6    HG3  ARG 753           HG3      ARG 753  53.365 -16.515   4.755
    7    HD2  ARG 753           HD2      ARG 753  55.102 -18.594   6.104
    8    HD3  ARG 753           HD3      ARG 753  54.695 -17.017   6.785
    9    HE   ARG 753           HE       ARG 753  52.287 -18.068   6.220
   10   HH11  ARG 753          HH11      ARG 753  54.987 -19.174   8.247
   11   HH12  ARG 753          HH12      ARG 753  54.010 -20.154   9.236
   12   HH21  ARG 753          HH21      ARG 753  50.966 -19.469   7.560
   13   HH22  ARG 753          HH22      ARG 753  51.702 -20.341   8.824

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ASN 754           H        ASN 754  54.051 -21.594   4.016
    2    HA   ASN 754           HA       ASN 754  53.704 -22.412   1.218
    3    HB2  ASN 754           HB2      ASN 754  54.306 -24.179   3.607
    4    HB3  ASN 754           HB3      ASN 754  54.100 -24.711   1.943
    5   HD21  ASN 754          HD21      ASN 754  56.224 -23.303   4.241
    6   HD22  ASN 754          HD22      ASN 754  57.623 -23.236   3.250

  No H/Q in entry =           6
  In of MODEL   20
    1    H    TYR 755           H        TYR 755  51.698 -22.789   0.641
    2    HA   TYR 755           HA       TYR 755  49.785 -23.689   2.610
    3    HB2  TYR 755           HB2      TYR 755  49.503 -21.181   0.969
    4    HB3  TYR 755           HB3      TYR 755  48.102 -22.110   1.491
    5    HD1  TYR 755           HD1      TYR 755  47.175 -21.687   3.617
    6    HD2  TYR 755           HD2      TYR 755  51.126 -20.369   2.802
    7    HE1  TYR 755           HE1      TYR 755  47.238 -20.521   5.775
    8    HE2  TYR 755           HE2      TYR 755  51.176 -19.197   4.960
    9    HH   TYR 755           HH       TYR 755  48.918 -19.822   7.352

  No H/Q in entry =           9
  In of MODEL   20
    1    H    THR 756           H        THR 756  48.188 -24.870   1.793
    2    HA   THR 756           HA       THR 756  48.568 -25.788  -0.964
    3    HB   THR 756           HB       THR 756  47.150 -27.123   1.360
    4    HG1  THR 756           HG1      THR 756  49.060 -27.519   2.097
    5   HG22  THR 756          HG21      THR 756  47.437 -29.157   0.023
    6   HG21  THR 756          HG22      THR 756  48.194 -28.179  -1.256
    7   HG23  THR 756          HG23      THR 756  46.502 -27.913  -0.817

  No H/Q in entry =           7
  In of MODEL   20
    1    H    LEU 757           H        LEU 757  46.561 -25.901  -2.300
    2    HA   LEU 757           HA       LEU 757  44.500 -24.325  -1.044
    3    HB2  LEU 757           HB2      LEU 757  44.977 -24.802  -3.962
    4    HB3  LEU 757           HB3      LEU 757  43.535 -24.022  -3.336
    5    HG   LEU 757           HG       LEU 757  45.427 -22.568  -2.123
    6   HD13  LEU 757          HD11      LEU 757  47.184 -21.983  -3.683
    7   HD12  LEU 757          HD12      LEU 757  46.658 -23.276  -4.756
    8   HD11  LEU 757          HD13      LEU 757  47.287 -23.663  -3.152
    9   HD21  LEU 757          HD21      LEU 757  43.539 -21.745  -3.287
   10   HD23  LEU 757          HD22      LEU 757  44.292 -22.068  -4.862
   11   HD22  LEU 757          HD23      LEU 757  44.978 -20.855  -3.759

  No H/Q in entry =          11
  In of MODEL   20
    1    H    THR 758           H        THR 758  42.377 -24.765  -1.119
    2    HA   THR 758           HA       THR 758  41.739 -27.579  -1.478
    3    HB   THR 758           HB       THR 758  40.507 -27.444   0.762
    4    HG1  THR 758           HG1      THR 758  41.998 -25.055   0.753
    5   HG22  THR 758          HG21      THR 758  43.529 -27.202   0.834
    6   HG21  THR 758          HG22      THR 758  42.648 -28.668   0.432
    7   HG23  THR 758          HG23      THR 758  42.526 -27.990   2.052

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLY 759           H        GLY 759  39.226 -27.838  -1.116
    2    HA3  GLY 759           HA2      GLY 759  38.099 -25.867  -2.912
    3    HA2  GLY 759           HA3      GLY 759  37.432 -27.444  -2.536

  No H/Q in entry =           3
  In of MODEL   20
    1    H    ARG 760           H        ARG 760  35.803 -25.477  -2.677
    2    HA   ARG 760           HA       ARG 760  35.218 -23.767  -0.545
    3    HB2  ARG 760           HB2      ARG 760  33.124 -23.408  -1.569
    4    HB3  ARG 760           HB3      ARG 760  34.200 -23.825  -2.889
    5    HG2  ARG 760           HG2      ARG 760  32.180 -25.660  -1.585
    6    HG3  ARG 760           HG3      ARG 760  32.004 -24.878  -3.152
    7    HD2  ARG 760           HD2      ARG 760  33.868 -26.212  -4.027
    8    HD3  ARG 760           HD3      ARG 760  34.127 -26.912  -2.428
    9    HE   ARG 760           HE       ARG 760  31.502 -27.282  -3.556
   10   HH11  ARG 760          HH11      ARG 760  34.686 -28.834  -2.877
   11   HH12  ARG 760          HH12      ARG 760  34.136 -30.353  -3.352
   12   HH21  ARG 760          HH21      ARG 760  30.833 -29.399  -4.158
   13   HH22  ARG 760          HH22      ARG 760  31.921 -30.705  -4.073

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ASP 761           H        ASP 761  35.003 -27.128  -0.601
    2    HA   ASP 761           HA       ASP 761  32.697 -27.446   1.055
    3    HB2  ASP 761           HB2      ASP 761  33.246 -29.822   0.864
    4    HB3  ASP 761           HB3      ASP 761  33.184 -29.030  -0.712

  No H/Q in entry =           4
  In of MODEL   20
    1    H    SER 762           H        SER 762  36.094 -27.058   1.423
    2    HA   SER 762           HA       SER 762  36.113 -28.349   4.054
    3    HB2  SER 762           HB2      SER 762  38.410 -27.179   2.478
    4    HB3  SER 762           HB3      SER 762  38.498 -28.266   3.864
    5    HG   SER 762           HG       SER 762  36.957 -29.330   1.890

  No H/Q in entry =           5
  In of MODEL   20
    1    H    CYS 763           H        CYS 763  35.761 -25.320   2.673
    2    HA   CYS 763           HA       CYS 763  36.696 -23.829   5.075
    3    HB2  CYS 763           HB2      CYS 763  37.242 -22.065   3.452
    4    HB3  CYS 763           HB3      CYS 763  38.174 -23.532   3.152

  No H/Q in entry =           4
  In of MODEL   20
    1    H    THR 764           H        THR 764  35.703 -21.451   4.756
    2    HA   THR 764           HA       THR 764  33.137 -21.591   3.435
    3    HB   THR 764           HB       THR 764  33.077 -21.248   6.007
    4    HG1  THR 764           HG1      THR 764  31.284 -20.725   4.820
    5   HG21  THR 764          HG21      THR 764  34.050 -18.551   5.142
    6   HG23  THR 764          HG22      THR 764  34.917 -19.663   6.213
    7   HG22  THR 764          HG23      THR 764  33.413 -18.892   6.753

  No H/Q in entry =           7
  In of MODEL   20
    1    H    LEU 765           H        LEU 765  32.967 -20.127   1.827
    2    HA   LEU 765           HA       LEU 765  34.996 -18.075   1.713
    3    HB2  LEU 765           HB2      LEU 765  35.070 -20.266   0.144
    4    HB3  LEU 765           HB3      LEU 765  34.042 -19.212  -0.811
    5    HG   LEU 765           HG       LEU 765  35.796 -17.525  -0.917
    6   HD13  LEU 765          HD11      LEU 765  36.824 -17.837   1.225
    7   HD12  LEU 765          HD12      LEU 765  38.061 -18.117  -0.014
    8   HD11  LEU 765          HD13      LEU 765  37.271 -19.477   0.804
    9   HD22  LEU 765          HD21      LEU 765  35.740 -19.291  -2.599
   10   HD21  LEU 765          HD22      LEU 765  36.781 -20.292  -1.584
   11   HD23  LEU 765          HD23      LEU 765  37.396 -18.779  -2.266

  No H/Q in entry =          11
  In of MODEL   20
    1    HA   PRO 766           HA       PRO 766  31.394 -15.614   1.639
    2    HB2  PRO 766           HB2      PRO 766  32.500 -13.256   0.741
    3    HB3  PRO 766           HB3      PRO 766  32.593 -13.843   2.404
    4    HG2  PRO 766           HG2      PRO 766  34.620 -14.009   0.220
    5    HG3  PRO 766           HG3      PRO 766  34.860 -13.703   1.949
    6    HD2  PRO 766           HD2      PRO 766  35.336 -16.099   0.786
    7    HD3  PRO 766           HD3      PRO 766  34.796 -15.966   2.466

  No H/Q in entry =           7
  In of MODEL   20
    1    H    ALA 767           H        ALA 767  33.325 -14.789  -1.269
    2    HA   ALA 767           HA       ALA 767  30.772 -14.468  -2.713
    3    HB1  ALA 767           HB1      ALA 767  32.348 -12.536  -2.635
    4    HB3  ALA 767           HB2      ALA 767  31.944 -13.101  -4.271
    5    HB2  ALA 767           HB3      ALA 767  33.487 -13.549  -3.530

  No H/Q in entry =           5
  In of MODEL   20
    1    H    SER 768           H        SER 768  31.686 -16.862  -2.189
    2    HA   SER 768           HA       SER 768  32.242 -17.949  -4.795
    3    HB2  SER 768           HB2      SER 768  31.496 -19.209  -2.187
    4    HB3  SER 768           HB3      SER 768  31.839 -20.031  -3.720
    5    HG   SER 768           HG       SER 768  33.763 -19.998  -2.760

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA 769           H        ALA 769  29.592 -17.499  -2.576
    2    HA   ALA 769           HA       ALA 769  27.689 -18.683  -4.417
    3    HB3  ALA 769           HB1      ALA 769  27.452 -19.193  -2.040
    4    HB2  ALA 769           HB2      ALA 769  26.076 -18.253  -2.614
    5    HB1  ALA 769           HB3      ALA 769  27.348 -17.471  -1.669

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLU 770           H        GLU 770  25.684 -17.303  -4.710
    2    HA   GLU 770           HA       GLU 770  26.557 -14.756  -5.694
    3    HB2  GLU 770           HB2      GLU 770  24.186 -14.537  -6.460
    4    HB3  GLU 770           HB3      GLU 770  25.029 -15.946  -7.086
    5    HG2  GLU 770           HG2      GLU 770  23.904 -17.372  -5.503
    6    HG3  GLU 770           HG3      GLU 770  23.139 -15.977  -4.752

  No H/Q in entry =           6
  In of MODEL   20
    1    H    LYS 771           H        LYS 771  26.547 -13.000  -4.772
    2    HA   LYS 771           HA       LYS 771  25.369 -12.670  -2.159
    3    HB2  LYS 771           HB2      LYS 771  27.507 -11.424  -3.765
    4    HB3  LYS 771           HB3      LYS 771  26.726 -10.446  -2.550
    5    HG2  LYS 771           HG2      LYS 771  28.905 -11.702  -2.097
    6    HG3  LYS 771           HG3      LYS 771  27.691 -11.632  -0.808
    7    HD2  LYS 771           HD2      LYS 771  27.851 -13.907  -2.717
    8    HD3  LYS 771           HD3      LYS 771  29.018 -13.828  -1.387
    9    HE2  LYS 771           HE2      LYS 771  25.992 -14.149  -1.231
   10    HE3  LYS 771           HE3      LYS 771  27.237 -15.247  -0.703
   11    HZ3  LYS 771           HZ1      LYS 771  26.272 -14.114   1.143
   12    HZ2  LYS 771           HZ2      LYS 771  26.703 -12.604   0.544
   13    HZ1  LYS 771           HZ3      LYS 771  27.892 -13.715   1.014

  No H/Q in entry =          13
  In of MODEL   20
    1    H    ALA 772           H        ALA 772  24.970 -10.172  -1.925
    2    HA   ALA 772           HA       ALA 772  23.286  -9.086  -4.028
    3    HB1  ALA 772           HB1      ALA 772  21.408  -8.706  -2.470
    4    HB3  ALA 772           HB2      ALA 772  22.271  -9.609  -1.223
    5    HB2  ALA 772           HB3      ALA 772  21.724 -10.427  -2.687

  No H/Q in entry =           5
  In of MODEL   20
    1    H    CYS 773           H        CYS 773  22.439  -6.819  -3.076
    2    HA   CYS 773           HA       CYS 773  24.731  -5.319  -2.530
    3    HB2  CYS 773           HB2      CYS 773  21.825  -4.561  -2.159
    4    HB3  CYS 773           HB3      CYS 773  23.174  -3.428  -2.128

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLY 774           H        GLY 774  25.298  -4.117  -0.656
    2    HA3  GLY 774           HA2      GLY 774  25.247  -3.831   1.716
    3    HA2  GLY 774           HA3      GLY 774  24.447  -5.404   1.850

  No H/Q in entry =           3
  In of MODEL   20
    1    H    ALA 775           H        ALA 775  26.211  -6.276  -0.382
    2    HA   ALA 775           HA       ALA 775  28.825  -6.511   0.827
    3    HB3  ALA 775           HB1      ALA 775  27.560  -8.502   1.570
    4    HB2  ALA 775           HB2      ALA 775  28.762  -8.964   0.369
    5    HB1  ALA 775           HB3      ALA 775  27.067  -8.816  -0.090

  No H/Q in entry =           5
  In of MODEL   20
    1    H    CYS 776           H        CYS 776  29.569  -8.381  -1.202
    2    HA   CYS 776           HA       CYS 776  29.971  -8.761  -3.372
    3    HB2  CYS 776           HB2      CYS 776  28.209  -6.382  -4.043
    4    HB3  CYS 776           HB3      CYS 776  28.931  -7.457  -5.236

  No H/Q in entry =           4
  In of MODEL   20
    1    HA   PRO 777           HA       PRO 777  33.615  -6.224  -3.459
    2    HB2  PRO 777           HB2      PRO 777  35.174  -7.989  -4.709
    3    HB3  PRO 777           HB3      PRO 777  34.573  -8.328  -3.082
    4    HG2  PRO 777           HG2      PRO 777  33.565  -9.326  -5.713
    5    HG3  PRO 777           HG3      PRO 777  33.852 -10.226  -4.217
    6    HD2  PRO 777           HD2      PRO 777  31.393  -9.307  -4.995
    7    HD3  PRO 777           HD3      PRO 777  31.855  -9.602  -3.308

  No H/Q in entry =           7
  In of MODEL   20
    1    H    LEU 778           H        LEU 778  35.415  -6.365  -5.562
    2    HA   LEU 778           HA       LEU 778  34.641  -4.489  -7.365
    3    HB2  LEU 778           HB2      LEU 778  36.536  -5.199  -8.838
    4    HB3  LEU 778           HB3      LEU 778  36.935  -4.895  -7.164
    5    HG   LEU 778           HG       LEU 778  36.458  -7.732  -8.029
    6   HD12  LEU 778          HD11      LEU 778  38.823  -7.948  -8.569
    7   HD11  LEU 778          HD12      LEU 778  39.017  -6.186  -8.495
    8   HD13  LEU 778          HD13      LEU 778  37.979  -6.923  -9.724
    9   HD21  LEU 778          HD21      LEU 778  38.306  -6.428  -6.027
   10   HD23  LEU 778          HD22      LEU 778  38.218  -8.154  -6.358
   11   HD22  LEU 778          HD23      LEU 778  36.831  -7.329  -5.659

  No H/Q in entry =          11
  In of MODEL   20
    1    H    TRP 779           H        TRP 779  34.315  -7.972  -7.961
    2    HA   TRP 779           HA       TRP 779  33.206  -7.409 -10.578
    3    HB2  TRP 779           HB2      TRP 779  32.951  -9.959 -10.703
    4    HB3  TRP 779           HB3      TRP 779  34.585  -9.312 -10.649
    5    HD1  TRP 779           HD1      TRP 779  32.033 -11.106  -8.372
    6    HE1  TRP 779           HE1      TRP 779  33.358 -12.312  -6.503
    7    HE3  TRP 779           HE3      TRP 779  36.686  -9.410  -9.485
    8    HZ2  TRP 779           HZ2      TRP 779  36.103 -12.491  -5.642
    9    HZ3  TRP 779           HZ3      TRP 779  38.582 -10.124  -8.115
   10    HH2  TRP 779           HH2      TRP 779  38.287 -11.613  -6.244

  No H/Q in entry =          10
  In of MODEL   20
    1    H    GLY 780           H        GLY 780  31.924  -7.184  -7.653
    2    HA3  GLY 780           HA2      GLY 780  29.277  -8.073  -8.583
    3    HA2  GLY 780           HA3      GLY 780  29.780  -8.178  -6.896

  No H/Q in entry =           3
  In of MODEL   20
    1    H    LYS 781           H        LYS 781  28.521  -6.177  -9.319
    2    HA   LYS 781           HA       LYS 781  29.155  -3.740  -7.806
    3    HB2  LYS 781           HB2      LYS 781  29.609  -4.102 -10.315
    4    HB3  LYS 781           HB3      LYS 781  27.871  -3.879 -10.485
    5    HG2  LYS 781           HG2      LYS 781  28.942  -1.800 -10.935
    6    HG3  LYS 781           HG3      LYS 781  28.126  -1.665  -9.373
    7    HD2  LYS 781           HD2      LYS 781  30.189  -2.015  -8.197
    8    HD3  LYS 781           HD3      LYS 781  31.036  -2.349  -9.712
    9    HE2  LYS 781           HE2      LYS 781  30.613  -0.047 -10.421
   10    HE3  LYS 781           HE3      LYS 781  29.777   0.248  -8.891
   11    HZ3  LYS 781           HZ1      LYS 781  31.799  -0.187  -7.711
   12    HZ2  LYS 781           HZ2      LYS 781  32.077   1.023  -8.858
   13    HZ1  LYS 781           HZ3      LYS 781  32.629  -0.540  -9.144

  No H/Q in entry =          13
  In of MODEL   20
    1    H    CYS 782           H        CYS 782  27.606  -3.088  -6.487
    2    HA   CYS 782           HA       CYS 782  24.840  -3.705  -7.101
    3    HB2  CYS 782           HB2      CYS 782  25.539  -3.745  -4.693
    4    HB3  CYS 782           HB3      CYS 782  25.949  -2.039  -4.798

  No H/Q in entry =           4
  In of MODEL   20
    1    H    ASP 783           H        ASP 783  24.143  -2.622  -8.735
    2    HA   ASP 783           HA       ASP 783  24.512   0.282  -8.841
    3    HB2  ASP 783           HB2      ASP 783  26.325  -0.633 -10.173
    4    HB3  ASP 783           HB3      ASP 783  25.193  -1.630 -11.076

  No H/Q in entry =           4
  In of MODEL   20
    1    H    ALA 784           H        ALA 784  23.039  -2.546 -10.378
    2    HA   ALA 784           HA       ALA 784  20.783  -1.024 -11.284
    3    HB1  ALA 784           HB1      ALA 784  19.963  -3.232 -12.034
    4    HB2  ALA 784           HB2      ALA 784  21.298  -4.008 -11.184
    5    HB3  ALA 784           HB3      ALA 784  21.623  -2.958 -12.560

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLU 785           H        GLU 785  18.719  -2.812 -10.666
    2    HA   GLU 785           HA       GLU 785  17.689  -1.986  -8.280
    3    HB2  GLU 785           HB2      GLU 785  17.215  -4.438  -9.945
    4    HB3  GLU 785           HB3      GLU 785  16.328  -4.192  -8.450
    5    HG2  GLU 785           HG2      GLU 785  15.171  -3.470 -10.590
    6    HG3  GLU 785           HG3      GLU 785  15.224  -2.287  -9.290

  No H/Q in entry =           6
  In of MODEL   20
    1    H    SER 786           H        SER 786  18.115  -2.327  -6.256
    2    HA   SER 786           HA       SER 786  20.397  -3.837  -5.524
    3    HB2  SER 786           HB2      SER 786  18.524  -2.125  -3.920
    4    HB3  SER 786           HB3      SER 786  20.048  -2.792  -3.318
    5    HG   SER 786           HG       SER 786  20.939  -1.810  -5.284

  No H/Q in entry =           5
  In of MODEL   20
    1    H    SER 787           H        SER 787  18.010  -5.468  -6.231
    2    HA   SER 787           HA       SER 787  17.347  -6.821  -3.776
    3    HB2  SER 787           HB2      SER 787  15.790  -6.790  -5.760
    4    HB3  SER 787           HB3      SER 787  16.965  -7.759  -6.644
    5    HG   SER 787           HG       SER 787  16.700  -9.355  -4.912

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LYS 788           H        LYS 788  19.661  -7.029  -6.350
    2    HA   LYS 788           HA       LYS 788  21.274  -8.949  -4.884
    3    HB2  LYS 788           HB2      LYS 788  21.709 -10.259  -6.886
    4    HB3  LYS 788           HB3      LYS 788  19.965 -10.228  -6.644
    5    HG2  LYS 788           HG2      LYS 788  19.666  -8.626  -8.372
    6    HG3  LYS 788           HG3      LYS 788  21.395  -8.317  -8.463
    7    HD2  LYS 788           HD2      LYS 788  21.713 -10.643  -9.244
    8    HD3  LYS 788           HD3      LYS 788  19.954 -10.831  -9.277
    9    HE2  LYS 788           HE2      LYS 788  21.547  -8.786 -10.835
   10    HE3  LYS 788           HE3      LYS 788  20.857 -10.264 -11.498
   11    HZ2  LYS 788           HZ1      LYS 788  19.457  -8.350 -11.952
   12    HZ1  LYS 788           HZ2      LYS 788  19.301  -8.010 -10.321
   13    HZ3  LYS 788           HZ3      LYS 788  18.652  -9.439 -10.957

  No H/Q in entry =          13
  In of MODEL   20
    1    H    CYS 789           H        CYS 789  23.552  -8.872  -6.085
    2    HA   CYS 789           HA       CYS 789  23.830  -6.205  -7.219
    3    HB2  CYS 789           HB2      CYS 789  26.269  -6.460  -6.848
    4    HB3  CYS 789           HB3      CYS 789  25.383  -6.635  -5.343

  No H/Q in entry =           4
  In of MODEL   20
    1    H    VAL 790           H        VAL 790  25.329  -6.140  -9.141
    2    HA   VAL 790           HA       VAL 790  24.616  -8.392 -10.868
    3    HB   VAL 790           HB       VAL 790  25.298  -5.505 -11.473
    4   HG12  VAL 790          HG11      VAL 790  24.890  -6.006 -13.865
    5   HG11  VAL 790          HG12      VAL 790  24.825  -7.729 -13.478
    6   HG13  VAL 790          HG13      VAL 790  26.319  -6.815 -13.240
    7   HG21  VAL 790          HG21      VAL 790  23.035  -5.857 -10.718
    8   HG23  VAL 790          HG22      VAL 790  22.799  -7.103 -11.948
    9   HG22  VAL 790          HG23      VAL 790  23.041  -5.424 -12.429

  No H/Q in entry =           9
  In of MODEL   20
    1    H    CYS 791           H        CYS 791  26.221  -9.385 -12.020
    2    HA   CYS 791           HA       CYS 791  28.852  -9.017 -10.835
    3    HB2  CYS 791           HB2      CYS 791  27.938 -11.253 -12.656
    4    HB3  CYS 791           HB3      CYS 791  29.301 -11.243 -11.545

  No H/Q in entry =           4
  In of MODEL   20
    1    H    ARG 792           H        ARG 792  30.225  -7.899 -11.921
    2    HA   ARG 792           HA       ARG 792  29.709  -7.034 -14.629
    3    HB2  ARG 792           HB2      ARG 792  31.325  -6.162 -12.384
    4    HB3  ARG 792           HB3      ARG 792  32.219  -6.118 -13.890
    5    HG2  ARG 792           HG2      ARG 792  31.164  -3.965 -13.361
    6    HG3  ARG 792           HG3      ARG 792  30.568  -4.658 -14.869
    7    HD2  ARG 792           HD2      ARG 792  28.508  -5.225 -13.916
    8    HD3  ARG 792           HD3      ARG 792  29.104  -4.991 -12.276
    9    HE   ARG 792           HE       ARG 792  29.423  -2.592 -13.045
   10   HH11  ARG 792          HH11      ARG 792  26.854  -4.532 -14.488
   11   HH12  ARG 792          HH12      ARG 792  25.679  -3.322 -14.466
   12   HH21  ARG 792          HH21      ARG 792  27.828  -0.865 -13.006
   13   HH22  ARG 792          HH22      ARG 792  26.252  -1.112 -13.561

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLU 793           H        GLU 793  30.811  -7.592 -16.391
    2    HA   GLU 793           HA       GLU 793  32.180 -10.056 -16.434
    3    HB2  GLU 793           HB2      GLU 793  32.003  -7.900 -18.531
    4    HB3  GLU 793           HB3      GLU 793  32.638  -9.515 -18.802
    5    HG2  GLU 793           HG2      GLU 793  30.454 -10.466 -18.252
    6    HG3  GLU 793           HG3      GLU 793  29.822  -8.840 -17.994

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ALA 794           H        ALA 794  34.346 -10.189 -17.655
    2    HA   ALA 794           HA       ALA 794  36.310  -9.325 -15.903
    3    HB2  ALA 794           HB1      ALA 794  36.448 -11.348 -17.249
    4    HB3  ALA 794           HB2      ALA 794  37.860 -10.317 -17.485
    5    HB1  ALA 794           HB3      ALA 794  36.588 -10.371 -18.709

  No H/Q in entry =           5
  In of MODEL   20
    1    H    SER 795           H        SER 795  35.243  -8.192 -19.044
    2    HA   SER 795           HA       SER 795  37.368  -6.384 -19.412
    3    HB2  SER 795           HB2      SER 795  34.765  -6.516 -20.891
    4    HB3  SER 795           HB3      SER 795  36.325  -5.961 -21.499
    5    HG   SER 795           HG       SER 795  37.047  -8.183 -20.954

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLU 796           H        GLU 796  34.675  -6.243 -17.455
    2    HA   GLU 796           HA       GLU 796  34.159  -3.387 -17.929
    3    HB2  GLU 796           HB2      GLU 796  32.347  -5.253 -18.164
    4    HB3  GLU 796           HB3      GLU 796  32.390  -5.302 -16.415
    5    HG2  GLU 796           HG2      GLU 796  31.589  -3.074 -16.251
    6    HG3  GLU 796           HG3      GLU 796  31.796  -2.808 -17.984

  No H/Q in entry =           6
  In of MODEL   20
    1    H    CYS 797           H        CYS 797  36.260  -4.870 -16.424
    2    HA   CYS 797           HA       CYS 797  35.842  -3.779 -13.734
    3    HB2  CYS 797           HB2      CYS 797  35.858  -6.244 -13.898
    4    HB3  CYS 797           HB3      CYS 797  37.447  -6.170 -14.631

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLU 798           H        GLU 798  37.587  -2.605 -12.924
    2    HA   GLU 798           HA       GLU 798  39.473  -1.795 -14.990
    3    HB2  GLU 798           HB2      GLU 798  39.627   0.341 -13.826
    4    HB3  GLU 798           HB3      GLU 798  37.991  -0.036 -14.323
    5    HG2  GLU 798           HG2      GLU 798  39.067  -0.324 -11.518
    6    HG3  GLU 798           HG3      GLU 798  38.133   1.028 -12.158

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU 799           H        GLU 799  39.383  -3.343 -11.957
    2    HA   GLU 799           HA       GLU 799  42.057  -2.572 -11.145
    3    HB2  GLU 799           HB2      GLU 799  40.370  -4.858 -10.190
    4    HB3  GLU 799           HB3      GLU 799  41.851  -4.285  -9.455
    5    HG2  GLU 799           HG2      GLU 799  39.254  -2.854  -9.672
    6    HG3  GLU 799           HG3      GLU 799  40.018  -3.616  -8.254

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLU 800           H        GLU 800  40.484  -5.373 -12.471
    2    HA   GLU 800           HA       GLU 800  41.100  -7.147 -13.630
    3    HB2  GLU 800           HB2      GLU 800  43.926  -6.055 -13.655
    4    HB3  GLU 800           HB3      GLU 800  43.377  -7.463 -14.551
    5    HG2  GLU 800           HG2      GLU 800  41.781  -5.983 -15.753
    6    HG3  GLU 800           HG3      GLU 800  42.526  -4.613 -14.933

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLY 801           H        GLY 801  42.450  -6.358 -10.601
    2    HA3  GLY 801           HA2      GLY 801  43.483  -7.565  -8.945
    3    HA2  GLY 801           HA3      GLY 801  42.491  -8.890  -9.510

  No H/Q in entry =           3
  In of MODEL   20
    1    H    PHE 802           H        PHE 802  43.965 -10.552  -9.312
    2    HA   PHE 802           HA       PHE 802  46.507 -10.423 -10.713
    3    HB2  PHE 802           HB2      PHE 802  45.201 -12.490  -8.927
    4    HB3  PHE 802           HB3      PHE 802  46.727 -12.769  -9.741
    5    HD1  PHE 802           HD1      PHE 802  48.682 -11.519  -9.118
    6    HD2  PHE 802           HD2      PHE 802  45.050 -11.122  -6.994
    7    HE1  PHE 802           HE1      PHE 802  49.874 -10.485  -7.323
    8    HE2  PHE 802           HE2      PHE 802  46.204 -10.098  -5.158
    9    HZ   PHE 802           HZ       PHE 802  48.661  -9.750  -5.269

  No H/Q in entry =           9
  In of MODEL   20
    1    H    SER 803           H        SER 803  46.738 -12.987 -11.521
    2    HA   SER 803           HA       SER 803  44.454 -13.621 -13.083
    3    HB2  SER 803           HB2      SER 803  47.324 -13.506 -14.047
    4    HB3  SER 803           HB3      SER 803  45.972 -14.187 -14.961
    5    HG   SER 803           HG       SER 803  45.405 -11.758 -13.973

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ILE 804           H        ILE 804  44.091 -15.776 -13.028
    2    HA   ILE 804           HA       ILE 804  45.943 -17.466 -11.501
    3    HB   ILE 804           HB       ILE 804  44.140 -18.343 -10.105
    4   HG12  ILE 804          HG12      ILE 804  42.227 -18.017 -11.742
    5   HG13  ILE 804          HG13      ILE 804  41.850 -17.564 -10.090
    6   HG23  ILE 804          HG21      ILE 804  43.612 -16.406  -8.705
    7   HG22  ILE 804          HG22      ILE 804  44.093 -15.340 -10.016
    8   HG21  ILE 804          HG23      ILE 804  45.301 -16.378  -9.241
    9   HD11  ILE 804          HD11      ILE 804  42.159 -15.194 -10.705
   10   HD13  ILE 804          HD12      ILE 804  40.874 -15.995 -11.598
   11   HD12  ILE 804          HD13      ILE 804  42.415 -15.684 -12.383

  No H/Q in entry =          11
  In of MODEL   20
    1    H    CYS 805           H        CYS 805  45.126 -19.859 -11.660
    2    HA   CYS 805           HA       CYS 805  44.273 -20.233 -14.433
    3    HB2  CYS 805           HB2      CYS 805  46.497 -21.206 -13.712
    4    HB3  CYS 805           HB3      CYS 805  45.597 -22.280 -12.640

  No H/Q in entry =           4
  In of MODEL   20
    1    H    VAL 806           H        VAL 806  42.232 -21.059 -14.730
    2    HA   VAL 806           HA       VAL 806  41.024 -22.421 -12.433
    3    HB   VAL 806           HB       VAL 806  39.550 -20.599 -14.310
    4   HG11  VAL 806          HG11      VAL 806  38.731 -21.903 -11.735
    5   HG13  VAL 806          HG12      VAL 806  38.115 -22.219 -13.352
    6   HG12  VAL 806          HG13      VAL 806  37.808 -20.656 -12.571
    7   HG22  VAL 806          HG21      VAL 806  41.044 -19.190 -13.084
    8   HG21  VAL 806          HG22      VAL 806  40.574 -19.940 -11.556
    9   HG23  VAL 806          HG23      VAL 806  39.411 -18.959 -12.458

  No H/Q in entry =           9
  In of MODEL   20
    1    H    GLU 807           H        GLU 807  40.063 -24.292 -12.938
    2    HA   GLU 807           HA       GLU 807  40.078 -25.167 -15.678
    3    HB2  GLU 807           HB2      GLU 807  40.776 -26.669 -13.823
    4    HB3  GLU 807           HB3      GLU 807  39.150 -26.567 -13.166
    5    HG2  GLU 807           HG2      GLU 807  38.264 -27.636 -15.146
    6    HG3  GLU 807           HG3      GLU 807  39.872 -27.672 -15.863

  No H/Q in entry =           6
  In of MODEL   20
    1    H    VAL 808           H        VAL 808  38.540 -24.917 -16.942
    2    HA   VAL 808           HA       VAL 808  35.803 -24.641 -16.017
    3    HB   VAL 808           HB       VAL 808  36.786 -22.380 -16.204
    4   HG11  VAL 808          HG11      VAL 808  37.291 -23.027 -19.086
    5   HG13  VAL 808          HG12      VAL 808  38.497 -22.708 -17.840
    6   HG12  VAL 808          HG13      VAL 808  37.414 -21.420 -18.369
    7   HG21  VAL 808          HG21      VAL 808  34.764 -22.988 -18.326
    8   HG23  VAL 808          HG22      VAL 808  35.155 -21.381 -17.703
    9   HG22  VAL 808          HG23      VAL 808  34.436 -22.596 -16.627

  No H/Q in entry =           9
  In of MODEL   20
    1    H    ASN 809           H        ASN 809  34.444 -25.726 -17.343
    2    HA   ASN 809           HA       ASN 809  33.656 -26.913 -19.111
    3    HB2  ASN 809           HB2      ASN 809  35.709 -25.244 -20.413
    4    HB3  ASN 809           HB3      ASN 809  34.938 -26.492 -21.408
    5   HD21  ASN 809          HD21      ASN 809  34.877 -23.363 -20.137
    6   HD22  ASN 809          HD22      ASN 809  33.307 -22.865 -20.631

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLY 810           H        GLY 810  36.182 -27.635 -17.486
    2    HA3  GLY 810           HA2      GLY 810  36.888 -29.912 -17.335
    3    HA2  GLY 810           HA3      GLY 810  36.792 -29.983 -19.107

  No H/Q in entry =           3
  In of MODEL   20
    1    H    LYS 811           H        LYS 811  38.113 -27.292 -19.211
    2    HA   LYS 811           HA       LYS 811  40.840 -28.358 -18.903
    3    HB2  LYS 811           HB2      LYS 811  41.425 -26.870 -20.795
    4    HB3  LYS 811           HB3      LYS 811  40.325 -28.171 -21.220
    5    HG2  LYS 811           HG2      LYS 811  38.435 -26.588 -21.112
    6    HG3  LYS 811           HG3      LYS 811  39.568 -25.288 -20.740
    7    HD2  LYS 811           HD2      LYS 811  39.632 -26.989 -23.206
    8    HD3  LYS 811           HD3      LYS 811  38.898 -25.386 -23.129
    9    HE2  LYS 811           HE2      LYS 811  41.073 -24.406 -22.525
   10    HE3  LYS 811           HE3      LYS 811  41.814 -26.002 -22.565
   11    HZ3  LYS 811           HZ1      LYS 811  41.323 -26.130 -24.908
   12    HZ2  LYS 811           HZ2      LYS 811  42.266 -24.783 -24.567
   13    HZ1  LYS 811           HZ3      LYS 811  40.618 -24.596 -24.886

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLU 812           H        GLU 812  42.530 -26.775 -18.505
    2    HA   GLU 812           HA       GLU 812  41.613 -24.776 -16.621
    3    HB2  GLU 812           HB2      GLU 812  44.362 -25.750 -17.371
    4    HB3  GLU 812           HB3      GLU 812  44.049 -24.485 -16.193
    5    HG2  GLU 812           HG2      GLU 812  42.846 -26.055 -14.796
    6    HG3  GLU 812           HG3      GLU 812  43.081 -27.327 -15.994

  No H/Q in entry =           6
  In of MODEL   20
    1    H    GLN 813           H        GLN 813  41.453 -22.711 -17.031
    2    HA   GLN 813           HA       GLN 813  43.051 -21.635 -19.202
    3    HB2  GLN 813           HB2      GLN 813  40.877 -21.889 -20.102
    4    HB3  GLN 813           HB3      GLN 813  40.112 -21.180 -18.686
    5    HG2  GLN 813           HG2      GLN 813  40.927 -19.058 -19.231
    6    HG3  GLN 813           HG3      GLN 813  41.960 -19.687 -20.530
    7   HE21  GLN 813          HE21      GLN 813  38.744 -18.820 -19.560
    8   HE22  GLN 813          HE22      GLN 813  38.027 -18.929 -21.113

  No H/Q in entry =           8
  In of MODEL   20
    1    H    THR 814           H        THR 814  44.029 -19.783 -18.775
    2    HA   THR 814           HA       THR 814  44.201 -18.843 -16.087
    3    HB   THR 814           HB       THR 814  45.218 -17.600 -18.625
    4    HG1  THR 814           HG1      THR 814  47.166 -18.769 -18.010
    5   HG22  THR 814          HG21      THR 814  46.173 -17.350 -15.764
    6   HG21  THR 814          HG22      THR 814  45.311 -16.113 -16.672
    7   HG23  THR 814          HG23      THR 814  46.936 -16.597 -17.165

  No H/Q in entry =           7
  In of MODEL   20
    1    H    MET 815           H        MET 815  42.892 -17.375 -15.210
    2    HA   MET 815           HA       MET 815  41.418 -15.609 -17.044
    3    HB2  MET 815           HB2      MET 815  40.470 -16.505 -14.328
    4    HB3  MET 815           HB3      MET 815  39.570 -15.594 -15.526
    5    HG2  MET 815           HG2      MET 815  39.915 -17.709 -17.006
    6    HG3  MET 815           HG3      MET 815  40.320 -18.425 -15.456
    7    HE2  MET 815           HE1      MET 815  38.467 -20.189 -15.986
    8    HE1  MET 815           HE2      MET 815  38.014 -19.301 -17.425
    9    HE3  MET 815           HE3      MET 815  36.769 -19.783 -16.257

  No H/Q in entry =           9
  In of MODEL   20
    1    H    SER 816           H        SER 816  40.972 -13.544 -16.195
    2    HA   SER 816           HA       SER 816  42.990 -12.579 -14.326
    3    HB2  SER 816           HB2      SER 816  40.675 -11.095 -15.626
    4    HB3  SER 816           HB3      SER 816  42.116 -10.376 -14.905
    5    HG   SER 816           HG       SER 816  42.442 -12.229 -16.989

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLU 817           H        GLU 817  42.154 -11.336 -12.328
    2    HA   GLU 817           HA       GLU 817  40.587 -12.979 -10.783
    3    HB2  GLU 817           HB2      GLU 817  41.875 -10.547 -10.405
    4    HB3  GLU 817           HB3      GLU 817  40.173 -10.288  -9.970
    5    HG2  GLU 817           HG2      GLU 817  40.823 -11.107  -7.961
    6    HG3  GLU 817           HG3      GLU 817  40.528 -12.562  -8.808

  No H/Q in entry =           6
  In of MODEL   20
    1    H    CYS 818           H        CYS 818  39.665  -9.969 -12.370
    2    HA   CYS 818           HA       CYS 818  36.999  -9.827 -11.536
    3    HB2  CYS 818           HB2      CYS 818  38.069  -8.896 -14.180
    4    HB3  CYS 818           HB3      CYS 818  36.681  -8.268 -13.308

  No H/Q in entry =           4
  In of MODEL   20
    1    H    GLU 819           H        GLU 819  38.485 -11.882 -13.793
    2    HA   GLU 819           HA       GLU 819  36.145 -12.369 -15.437
    3    HB2  GLU 819           HB2      GLU 819  38.512 -12.297 -16.262
    4    HB3  GLU 819           HB3      GLU 819  38.786 -13.758 -15.332
    5    HG2  GLU 819           HG2      GLU 819  37.211 -14.955 -16.723
    6    HG3  GLU 819           HG3      GLU 819  36.884 -13.468 -17.628

  No H/Q in entry =           6
  In of MODEL   20
    1    H    ALA 820           H        ALA 820  38.349 -14.327 -13.402
    2    HA   ALA 820           HA       ALA 820  36.766 -16.594 -13.280
    3    HB3  ALA 820           HB1      ALA 820  38.747 -15.553 -11.266
    4    HB1  ALA 820           HB2      ALA 820  39.096 -16.599 -12.647
    5    HB2  ALA 820           HB3      ALA 820  38.117 -17.199 -11.306

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLY 821           H        GLY 821  36.916 -13.689 -11.304
    2    HA3  GLY 821           HA2      GLY 821  35.159 -14.464  -9.246
    3    HA2  GLY 821           HA3      GLY 821  35.593 -12.815  -9.687

  No H/Q in entry =           3
  In of MODEL   20
    1    H    ALA 822           H        ALA 822  34.655 -12.697 -12.305
    2    HA   ALA 822           HA       ALA 822  31.945 -12.139 -11.960
    3    HB1  ALA 822           HB1      ALA 822  33.397 -12.726 -14.541
    4    HB3  ALA 822           HB2      ALA 822  33.306 -11.154 -13.748
    5    HB2  ALA 822           HB3      ALA 822  31.841 -11.906 -14.385

  No H/Q in entry =           5
  In of MODEL   20
    1    H    LEU 823           H        LEU 823  33.579 -14.898 -13.470
    2    HA   LEU 823           HA       LEU 823  31.269 -16.279 -14.106
    3    HB2  LEU 823           HB2      LEU 823  34.097 -17.133 -13.745
    4    HB3  LEU 823           HB3      LEU 823  32.862 -18.345 -13.854
    5    HG   LEU 823           HG       LEU 823  32.127 -17.371 -16.025
    6   HD11  LEU 823          HD11      LEU 823  34.651 -15.741 -15.860
    7   HD13  LEU 823          HD12      LEU 823  32.991 -15.146 -15.867
    8   HD12  LEU 823          HD13      LEU 823  33.636 -15.960 -17.289
    9   HD21  LEU 823          HD21      LEU 823  33.460 -19.314 -15.835
   10   HD23  LEU 823          HD22      LEU 823  34.947 -18.340 -15.869
   11   HD22  LEU 823          HD23      LEU 823  33.877 -18.412 -17.294

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ARG 824           H        ARG 824  33.142 -16.353 -11.113
    2    HA   ARG 824           HA       ARG 824  31.611 -18.476 -10.035
    3    HB2  ARG 824           HB2      ARG 824  33.944 -17.586  -9.347
    4    HB3  ARG 824           HB3      ARG 824  33.053 -16.415  -8.392
    5    HG2  ARG 824           HG2      ARG 824  32.039 -18.145  -7.092
    6    HG3  ARG 824           HG3      ARG 824  32.738 -19.406  -8.103
    7    HD2  ARG 824           HD2      ARG 824  34.163 -19.313  -6.246
    8    HD3  ARG 824           HD3      ARG 824  34.985 -18.419  -7.495
    9    HE   ARG 824           HE       ARG 824  33.428 -16.593  -6.132
   10   HH11  ARG 824          HH11      ARG 824  36.279 -18.572  -5.415
   11   HH12  ARG 824          HH12      ARG 824  36.973 -17.501  -4.302
   12   HH21  ARG 824          HH21      ARG 824  34.298 -15.122  -4.612
   13   HH22  ARG 824          HH22      ARG 824  35.733 -15.364  -3.772

  No H/Q in entry =          13
  In of MODEL   20
    1    H    CYS 825           H        CYS 825  31.266 -15.017 -10.102
    2    HA   CYS 825           HA       CYS 825  29.214 -14.763  -8.166
    3    HB2  CYS 825           HB2      CYS 825  30.676 -12.893  -8.997
    4    HB3  CYS 825           HB3      CYS 825  29.824 -12.973 -10.527

  No H/Q in entry =           4
  In of MODEL   20
    1    H    ARG 826           H        ARG 826  29.141 -14.981 -11.750
    2    HA   ARG 826           HA       ARG 826  26.309 -14.877 -11.984
    3    HB2  ARG 826           HB2      ARG 826  26.673 -15.906 -14.271
    4    HB3  ARG 826           HB3      ARG 826  27.474 -14.355 -13.988
    5    HG2  ARG 826           HG2      ARG 826  29.544 -15.435 -13.733
    6    HG3  ARG 826           HG3      ARG 826  28.794 -17.034 -13.742
    7    HD2  ARG 826           HD2      ARG 826  28.632 -15.130 -16.063
    8    HD3  ARG 826           HD3      ARG 826  29.942 -16.296 -15.882
    9    HE   ARG 826           HE       ARG 826  27.802 -17.873 -15.671
   10   HH11  ARG 826          HH11      ARG 826  28.468 -15.344 -18.065
   11   HH12  ARG 826          HH12      ARG 826  27.658 -16.143 -19.317
   12   HH21  ARG 826          HH21      ARG 826  26.740 -18.967 -17.384
   13   HH22  ARG 826          HH22      ARG 826  26.643 -18.286 -18.928

  No H/Q in entry =          13
  In of MODEL   20
    1    H    GLY 827           H        GLY 827  28.395 -17.436 -11.153
    2    HA3  GLY 827           HA2      GLY 827  27.540 -19.426 -10.194
    3    HA2  GLY 827           HA3      GLY 827  26.067 -19.208 -11.136

  No H/Q in entry =           3
  In of MODEL   20
    1    H    GLN 828           H        GLN 828  29.092 -18.731 -12.641
    2    HA   GLN 828           HA       GLN 828  28.745 -20.948 -14.442
    3    HB2  GLN 828           HB2      GLN 828  29.810 -18.800 -15.070
    4    HB3  GLN 828           HB3      GLN 828  31.118 -19.182 -13.955
    5    HG2  GLN 828           HG2      GLN 828  31.672 -19.684 -16.284
    6    HG3  GLN 828           HG3      GLN 828  31.697 -21.135 -15.261
    7   HE21  GLN 828          HE21      GLN 828  30.119 -19.428 -17.803
    8   HE22  GLN 828          HE22      GLN 828  29.106 -20.720 -18.312

  No H/Q in entry =           8
  In of MODEL   20
    1    H    SER 829           H        SER 829  29.748 -22.885 -14.320
    2    HA   SER 829           HA       SER 829  30.794 -23.577 -11.745
    3    HB2  SER 829           HB2      SER 829  30.458 -25.267 -14.231
    4    HB3  SER 829           HB3      SER 829  30.752 -25.866 -12.596
    5    HG   SER 829           HG       SER 829  28.499 -25.755 -13.485

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ILE 830           H        ILE 830  32.804 -23.064 -11.308
    2    HA   ILE 830           HA       ILE 830  34.896 -23.661 -13.257
    3    HB   ILE 830           HB       ILE 830  36.143 -21.683 -12.740
    4   HG12  ILE 830          HG12      ILE 830  35.368 -21.328 -10.372
    5   HG13  ILE 830          HG13      ILE 830  35.435 -19.828 -11.235
    6   HG23  ILE 830          HG21      ILE 830  34.694 -21.461 -14.594
    7   HG22  ILE 830          HG22      ILE 830  34.775 -19.916 -13.750
    8   HG21  ILE 830          HG23      ILE 830  33.364 -20.961 -13.551
    9   HD13  ILE 830          HD11      ILE 830  33.511 -19.865  -9.893
   10   HD12  ILE 830          HD12      ILE 830  32.999 -21.423 -10.545
   11   HD11  ILE 830          HD13      ILE 830  32.989 -19.987 -11.573

  No H/Q in entry =          11
  In of MODEL   20
    1    H    SER 831           H        SER 831  36.821 -24.305 -12.394
    2    HA   SER 831           HA       SER 831  36.851 -24.675  -9.502
    3    HB2  SER 831           HB2      SER 831  37.760 -26.483 -11.709
    4    HB3  SER 831           HB3      SER 831  38.173 -26.703 -10.011
    5    HG   SER 831           HG       SER 831  36.032 -27.529 -11.297

  No H/Q in entry =           5
  In of MODEL   20
    1    H    VAL 832           H        VAL 832  38.219 -23.041  -8.932
    2    HA   VAL 832           HA       VAL 832  40.489 -22.224 -10.421
    3    HB   VAL 832           HB       VAL 832  39.994 -21.925  -7.436
    4   HG13  VAL 832          HG11      VAL 832  41.529 -19.999  -7.577
    5   HG12  VAL 832          HG12      VAL 832  41.819 -20.360  -9.275
    6   HG11  VAL 832          HG13      VAL 832  42.326 -21.506  -8.035
    7   HG22  VAL 832          HG21      VAL 832  39.111 -19.689  -7.972
    8   HG21  VAL 832          HG22      VAL 832  38.156 -20.965  -8.724
    9   HG23  VAL 832          HG23      VAL 832  39.300 -20.035  -9.691

  No H/Q in entry =           9
  In of MODEL   20
    1    H    THR 833           H        THR 833  42.207 -23.471 -10.837
    2    HA   THR 833           HA       THR 833  42.666 -25.752  -9.179
    3    HB   THR 833           HB       THR 833  44.451 -26.267 -10.885
    4    HG1  THR 833           HG1      THR 833  44.481 -25.004 -12.744
    5   HG21  THR 833          HG21      THR 833  42.174 -27.166 -11.067
    6   HG23  THR 833          HG22      THR 833  42.853 -26.810 -12.655
    7   HG22  THR 833          HG23      THR 833  41.676 -25.713 -11.932

  No H/Q in entry =           7
  In of MODEL   20
    1    H    SER 834           H        SER 834  44.251 -22.747  -9.993
    2    HA   SER 834           HA       SER 834  45.667 -22.828  -7.518
    3    HB2  SER 834           HB2      SER 834  47.192 -24.132  -9.004
    4    HB3  SER 834           HB3      SER 834  47.232 -22.765 -10.117
    5    HG   SER 834           HG       SER 834  48.477 -23.132  -7.687

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ILE 835           H        ILE 835  46.635 -20.853  -7.090
    2    HA   ILE 835           HA       ILE 835  45.347 -18.472  -8.081
    3    HB   ILE 835           HB       ILE 835  46.906 -17.310  -6.588
    4   HG12  ILE 835          HG12      ILE 835  48.269 -20.030  -6.318
    5   HG13  ILE 835          HG13      ILE 835  48.913 -18.649  -7.194
    6   HG22  ILE 835          HG21      ILE 835  46.043 -19.870  -5.257
    7   HG21  ILE 835          HG22      ILE 835  44.938 -18.588  -5.710
    8   HG23  ILE 835          HG23      ILE 835  46.207 -18.263  -4.528
    9   HD13  ILE 835          HD11      ILE 835  50.032 -18.913  -5.126
   10   HD12  ILE 835          HD12      ILE 835  48.496 -18.938  -4.266
   11   HD11  ILE 835          HD13      ILE 835  49.039 -17.447  -5.051

  No H/Q in entry =          11
  In of MODEL   20
    1    H    ARG 836           H        ARG 836  48.020 -20.422  -8.966
    2    HA   ARG 836           HA       ARG 836  49.643 -18.433 -10.148
    3    HB2  ARG 836           HB2      ARG 836  49.577 -21.429 -10.326
    4    HB3  ARG 836           HB3      ARG 836  50.728 -20.452 -11.226
    5    HG2  ARG 836           HG2      ARG 836  51.743 -19.665  -9.224
    6    HG3  ARG 836           HG3      ARG 836  50.471 -20.377  -8.227
    7    HD2  ARG 836           HD2      ARG 836  51.136 -22.558  -8.794
    8    HD3  ARG 836           HD3      ARG 836  52.234 -21.982 -10.048
    9    HE   ARG 836           HE       ARG 836  53.546 -20.974  -8.208
   10   HH11  ARG 836          HH11      ARG 836  51.385 -23.637  -7.225
   11   HH12  ARG 836          HH12      ARG 836  52.511 -24.368  -6.204
   12   HH21  ARG 836          HH21      ARG 836  55.120 -22.013  -6.776
   13   HH22  ARG 836          HH22      ARG 836  54.714 -23.437  -5.942

  No H/Q in entry =          13
  In of MODEL   20
    1    HA   PRO 837           HA       PRO 837  47.179 -18.229 -13.867
    2    HB2  PRO 837           HB2      PRO 837  48.954 -16.702 -15.300
    3    HB3  PRO 837           HB3      PRO 837  47.826 -16.015 -14.128
    4    HG2  PRO 837           HG2      PRO 837  50.735 -16.604 -13.845
    5    HG3  PRO 837           HG3      PRO 837  49.789 -15.259 -13.189
    6    HD2  PRO 837           HD2      PRO 837  50.566 -17.419 -11.723
    7    HD3  PRO 837           HD3      PRO 837  49.115 -16.458 -11.366

  No H/Q in entry =           7
  In of MODEL   20
    1    H    CYS 838           H        CYS 838  47.225 -19.667 -15.600
    2    HA   CYS 838           HA       CYS 838  49.678 -21.078 -15.701
    3    HB2  CYS 838           HB2      CYS 838  48.246 -22.753 -17.151
    4    HB3  CYS 838           HB3      CYS 838  48.059 -22.731 -15.414

  No H/Q in entry =           4
  In of MODEL   20
    1    H    ALA 839           H        ALA 839  49.905 -22.094 -18.230
    2    HA   ALA 839           HA       ALA 839  50.268 -19.696 -19.808
    3    HB2  ALA 839           HB1      ALA 839  52.071 -21.360 -19.658
    4    HB3  ALA 839           HB2      ALA 839  51.514 -21.143 -21.316
    5    HB1  ALA 839           HB3      ALA 839  51.012 -22.564 -20.399

  No H/Q in entry =           5
  In of MODEL   20
    1    H    ALA 840           H        ALA 840  47.689 -21.151 -19.144
    2    HA   ALA 840           HA       ALA 840  46.674 -22.018 -21.660
    3    HB1  ALA 840           HB1      ALA 840  44.623 -22.404 -20.447
    4    HB2  ALA 840           HB2      ALA 840  45.285 -21.525 -19.058
    5    HB3  ALA 840           HB3      ALA 840  46.000 -23.054 -19.541

  No H/Q in entry =           5
  In of MODEL   20
    1    H    GLU 841           H        GLU 841  47.331 -19.981 -22.542
    2    HA   GLU 841           HA       GLU 841  45.120 -18.055 -22.549
    3    HB2  GLU 841           HB2      GLU 841  48.083 -17.550 -22.999
    4    HB3  GLU 841           HB3      GLU 841  46.819 -16.348 -23.208
    5    HG2  GLU 841           HG2      GLU 841  46.286 -16.518 -20.817
    6    HG3  GLU 841           HG3      GLU 841  47.592 -17.687 -20.625

  No H/Q in entry =           6
  In of MODEL   20
    1    H    THR 842           H        THR 842  45.355 -20.438 -23.880
    2    HA   THR 842           HA       THR 842  46.682 -20.507 -26.280
    3    HB   THR 842           HB       THR 842  44.955 -22.410 -26.650
    4    HG1  THR 842           HG1      THR 842  43.620 -21.386 -24.880
    5   HG21  THR 842          HG21      THR 842  47.322 -22.694 -25.970
    6   HG23  THR 842          HG22      THR 842  46.267 -23.822 -25.119
    7   HG22  THR 842          HG23      THR 842  46.863 -22.380 -24.296

  No H/Q in entry =           7
  In of MODEL   20
    1    H    GLN 843           H        GLN 843  46.344 -18.816 -27.538
    2    HA   GLN 843           HA       GLN 843  44.007 -18.938 -29.236
    3    HB2  GLN 843           HB2      GLN 843  45.126 -16.401 -28.011
    4    HB3  GLN 843           HB3      GLN 843  44.141 -16.395 -29.458
    5    HG2  GLN 843           HG2      GLN 843  43.275 -17.338 -26.732
    6    HG3  GLN 843           HG3      GLN 843  42.850 -15.803 -27.481
    7   HE21  GLN 843          HE21      GLN 843  41.077 -17.841 -26.553
    8   HE22  GLN 843          HE22      GLN 843  40.141 -18.377 -27.896

  No H/Q in entry =           8
  In of MODEL   21
    1    H1   GLY 689           H3       GLY 689  66.113  18.533  -7.550
    2    H2   GLY 689           H2       GLY 689  66.519  18.361  -5.912
    3    H3   GLY 689           H1       GLY 689  67.714  18.403  -7.122
    4    HA2  GLY 689           HA2      GLY 689  65.696  16.294  -6.788
    5    HA3  GLY 689           HA3      GLY 689  67.436  16.150  -6.522

  No H/Q in entry =           5
  In of MODEL   21
    1    H    SER 690           H        SER 690  68.005  14.748  -8.108
    2    HA   SER 690           HA       SER 690  66.987  15.171 -10.761
    3    HB2  SER 690           HB2      SER 690  69.088  16.571 -10.564
    4    HB3  SER 690           HB3      SER 690  69.964  15.089 -10.196
    5    HG   SER 690           HG       SER 690  68.562  15.691 -12.594

  No H/Q in entry =           5
  In of MODEL   21
    1    H    HIS 691           H        HIS 691  66.798  13.260 -11.796
    2    HA   HIS 691           HA       HIS 691  66.611  11.054 -12.142
    3    HB2  HIS 691           HB2      HIS 691  69.187  10.828 -10.542
    4    HB3  HIS 691           HB3      HIS 691  68.436   9.498 -11.411
    5    HD1  HIS 691           HD1      HIS 691  71.109  11.739 -11.776
    6    HD2  HIS 691           HD2      HIS 691  68.122  10.417 -14.326
    7    HE1  HIS 691           HE1      HIS 691  72.003  12.082 -14.080
    8    HE2  HIS 691           HE2      HIS 691  70.323  10.965 -15.555

  No H/Q in entry =           8
  In of MODEL   21
    1    H    MET 692           H        MET 692  64.742  11.010 -11.038
    2    HA   MET 692           HA       MET 692  64.589  10.638  -8.207
    3    HB2  MET 692           HB2      MET 692  62.862  11.798  -9.491
    4    HB3  MET 692           HB3      MET 692  62.489  10.305 -10.339
    5    HG2  MET 692           HG2      MET 692  61.811   9.286  -8.204
    6    HG3  MET 692           HG3      MET 692  62.128  10.821  -7.394
    7    HE2  MET 692           HE1      MET 692  61.102  12.883  -9.696
    8    HE1  MET 692           HE2      MET 692  60.859  13.067  -7.964
    9    HE3  MET 692           HE3      MET 692  59.485  13.191  -9.065

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ASN 693           H        ASN 693  63.836   8.546 -10.976
    2    HA   ASN 693           HA       ASN 693  64.170   6.253  -9.172
    3    HB2  ASN 693           HB2      ASN 693  62.402   6.324 -11.647
    4    HB3  ASN 693           HB3      ASN 693  62.535   5.014 -10.486
    5   HD21  ASN 693          HD21      ASN 693  61.018   7.971 -11.276
    6   HD22  ASN 693          HD22      ASN 693  59.969   8.065  -9.911

  No H/Q in entry =           6
  In of MODEL   21
    1    HA   PRO 694           HA       PRO 694  67.554   5.449 -12.010
    2    HB2  PRO 694           HB2      PRO 694  67.281   2.663 -11.022
    3    HB3  PRO 694           HB3      PRO 694  68.703   3.709 -11.023
    4    HG2  PRO 694           HG2      PRO 694  67.390   3.171  -8.760
    5    HG3  PRO 694           HG3      PRO 694  68.084   4.776  -9.062
    6    HD2  PRO 694           HD2      PRO 694  65.235   3.880  -9.240
    7    HD3  PRO 694           HD3      PRO 694  65.917   5.411  -8.645

  No H/Q in entry =           7
  In of MODEL   21
    1    H    LEU 695           H        LEU 695  67.312   5.086 -14.108
    2    HA   LEU 695           HA       LEU 695  64.962   3.769 -15.066
    3    HB2  LEU 695           HB2      LEU 695  67.273   4.953 -16.582
    4    HB3  LEU 695           HB3      LEU 695  65.784   4.375 -17.299
    5    HG   LEU 695           HG       LEU 695  66.083   6.735 -15.442
    6   HD13  LEU 695          HD11      LEU 695  66.892   7.144 -17.675
    7   HD12  LEU 695          HD12      LEU 695  65.386   8.021 -17.389
    8   HD11  LEU 695          HD13      LEU 695  65.380   6.547 -18.356
    9   HD21  LEU 695          HD21      LEU 695  63.611   5.603 -16.753
   10   HD23  LEU 695          HD22      LEU 695  63.703   7.136 -15.887
   11   HD22  LEU 695          HD23      LEU 695  63.955   5.625 -15.020

  No H/Q in entry =          11
  In of MODEL   21
    1    H    THR 696           H        THR 696  64.792   1.745 -15.285
    2    HA   THR 696           HA       THR 696  66.938  -0.063 -15.229
    3    HB   THR 696           HB       THR 696  64.977  -1.675 -15.765
    4    HG1  THR 696           HG1      THR 696  63.371  -0.510 -16.515
    5   HG23  THR 696          HG21      THR 696  64.141  -1.499 -13.464
    6   HG22  THR 696          HG22      THR 696  64.850   0.109 -13.330
    7   HG21  THR 696          HG23      THR 696  65.895  -1.302 -13.498

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLN 697           H        GLN 697  66.869  -1.932 -16.983
    2    HA   GLN 697           HA       GLN 697  67.834  -0.736 -19.371
    3    HB2  GLN 697           HB2      GLN 697  67.403  -3.633 -18.604
    4    HB3  GLN 697           HB3      GLN 697  68.008  -3.161 -20.176
    5    HG2  GLN 697           HG2      GLN 697  69.813  -3.863 -18.680
    6    HG3  GLN 697           HG3      GLN 697  69.988  -2.184 -19.160
    7   HE21  GLN 697          HE21      GLN 697  69.267  -4.349 -16.546
    8   HE22  GLN 697          HE22      GLN 697  69.454  -3.194 -15.278

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ALA 698           H        ALA 698  64.921  -2.249 -18.457
    2    HA   ALA 698           HA       ALA 698  63.682  -1.347 -20.941
    3    HB1  ALA 698           HB1      ALA 698  64.136  -3.736 -21.267
    4    HB3  ALA 698           HB2      ALA 698  62.404  -3.457 -21.096
    5    HB2  ALA 698           HB3      ALA 698  63.328  -4.110 -19.744

  No H/Q in entry =           5
  In of MODEL   21
    1    H    VAL 699           H        VAL 699  61.121  -1.759 -20.515
    2    HA   VAL 699           HA       VAL 699  60.569  -0.308 -18.112
    3    HB   VAL 699           HB       VAL 699  58.563  -1.648 -19.978
    4   HG11  VAL 699          HG11      VAL 699  57.676  -1.025 -17.770
    5   HG13  VAL 699          HG12      VAL 699  56.951  -0.066 -19.066
    6   HG12  VAL 699          HG13      VAL 699  58.200   0.638 -18.040
    7   HG21  VAL 699          HG21      VAL 699  59.620   1.178 -20.034
    8   HG23  VAL 699          HG22      VAL 699  58.319   0.547 -21.043
    9   HG22  VAL 699          HG23      VAL 699  59.957  -0.089 -21.215

  No H/Q in entry =           9
  In of MODEL   21
    1    HA   PRO 700           HA       PRO 700  60.804  -4.057 -15.848
    2    HB2  PRO 700           HB2      PRO 700  60.337  -3.078 -13.381
    3    HB3  PRO 700           HB3      PRO 700  61.852  -2.813 -14.250
    4    HG2  PRO 700           HG2      PRO 700  59.524  -0.975 -13.904
    5    HG3  PRO 700           HG3      PRO 700  61.256  -0.609 -13.863
    6    HD2  PRO 700           HD2      PRO 700  59.642  -0.161 -16.029
    7    HD3  PRO 700           HD3      PRO 700  61.394  -0.442 -16.138

  No H/Q in entry =           7
  In of MODEL   21
    1    H    LYS 701           H        LYS 701  59.589  -5.601 -14.957
    2    HA   LYS 701           HA       LYS 701  56.751  -5.093 -14.482
    3    HB2  LYS 701           HB2      LYS 701  58.065  -7.357 -15.964
    4    HB3  LYS 701           HB3      LYS 701  56.511  -7.579 -15.195
    5    HG2  LYS 701           HG2      LYS 701  57.122  -5.547 -17.339
    6    HG3  LYS 701           HG3      LYS 701  56.357  -7.109 -17.614
    7    HD2  LYS 701           HD2      LYS 701  55.263  -4.890 -15.883
    8    HD3  LYS 701           HD3      LYS 701  54.714  -5.282 -17.508
    9    HE2  LYS 701           HE2      LYS 701  53.970  -7.499 -16.705
   10    HE3  LYS 701           HE3      LYS 701  54.543  -7.103 -15.091
   11    HZ3  LYS 701           HZ1      LYS 701  52.174  -6.755 -15.242
   12    HZ2  LYS 701           HZ2      LYS 701  52.357  -5.727 -16.554
   13    HZ1  LYS 701           HZ3      LYS 701  52.913  -5.259 -15.043

  No H/Q in entry =          13
  In of MODEL   21
    1    H    CYS 702           H        CYS 702  56.087  -5.746 -12.566
    2    HA   CYS 702           HA       CYS 702  57.734  -7.713 -11.129
    3    HB2  CYS 702           HB2      CYS 702  55.915  -5.678  -9.770
    4    HB3  CYS 702           HB3      CYS 702  57.160  -6.678  -9.080

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLN 703           H        GLN 703  56.301  -9.110  -9.707
    2    HA   GLN 703           HA       GLN 703  53.962  -9.745 -11.183
    3    HB2  GLN 703           HB2      GLN 703  55.187 -10.852  -8.691
    4    HB3  GLN 703           HB3      GLN 703  53.607 -11.383  -9.252
    5    HG2  GLN 703           HG2      GLN 703  56.176 -11.537 -10.793
    6    HG3  GLN 703           HG3      GLN 703  55.348 -12.889 -10.008
    7   HE21  GLN 703          HE21      GLN 703  55.998 -12.571 -12.781
    8   HE22  GLN 703          HE22      GLN 703  54.516 -12.617 -13.669

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ARG 704           H        ARG 704  51.946 -10.206  -9.816
    2    HA   ARG 704           HA       ARG 704  51.166  -7.552  -9.026
    3    HB2  ARG 704           HB2      ARG 704  49.538 -10.067  -9.368
    4    HB3  ARG 704           HB3      ARG 704  48.841  -8.500  -8.959
    5    HG2  ARG 704           HG2      ARG 704  49.549  -7.546 -10.991
    6    HG3  ARG 704           HG3      ARG 704  50.546  -8.949 -11.394
    7    HD2  ARG 704           HD2      ARG 704  48.474 -10.272 -11.528
    8    HD3  ARG 704           HD3      ARG 704  47.527  -8.804 -11.279
    9    HE   ARG 704           HE       ARG 704  49.155  -8.192 -13.358
   10   HH11  ARG 704          HH11      ARG 704  46.645 -10.554 -12.798
   11   HH12  ARG 704          HH12      ARG 704  46.525 -11.086 -14.408
   12   HH21  ARG 704          HH21      ARG 704  48.922  -8.753 -15.611
   13   HH22  ARG 704          HH22      ARG 704  47.808  -9.931 -16.110

  No H/Q in entry =          13
  In of MODEL   21
    1    H    TRP 705           H        TRP 705  52.192 -10.292  -7.371
    2    HA   TRP 705           HA       TRP 705  51.145  -9.311  -4.832
    3    HB2  TRP 705           HB2      TRP 705  52.316 -11.361  -3.877
    4    HB3  TRP 705           HB3      TRP 705  51.020 -11.717  -5.000
    5    HD1  TRP 705           HD1      TRP 705  54.801 -12.139  -4.533
    6    HE1  TRP 705           HE1      TRP 705  55.692 -13.637  -6.390
    7    HE3  TRP 705           HE3      TRP 705  50.598 -12.437  -7.453
    8    HZ2  TRP 705           HZ2      TRP 705  54.739 -14.856  -8.772
    9    HZ3  TRP 705           HZ3      TRP 705  50.674 -13.802  -9.486
   10    HH2  TRP 705           HH2      TRP 705  52.706 -14.990 -10.133

  No H/Q in entry =          10
  In of MODEL   21
    1    H    GLU 706           H        GLU 706  53.332  -8.339  -6.813
    2    HA   GLU 706           HA       GLU 706  55.378  -7.759  -4.818
    3    HB2  GLU 706           HB2      GLU 706  55.661  -8.249  -7.777
    4    HB3  GLU 706           HB3      GLU 706  56.957  -7.592  -6.766
    5    HG2  GLU 706           HG2      GLU 706  56.892  -9.698  -5.485
    6    HG3  GLU 706           HG3      GLU 706  55.647 -10.295  -6.586

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LYS 707           H        LYS 707  56.517  -5.779  -5.299
    2    HA   LYS 707           HA       LYS 707  54.942  -3.710  -6.639
    3    HB2  LYS 707           HB2      LYS 707  55.264  -2.221  -4.696
    4    HB3  LYS 707           HB3      LYS 707  54.284  -3.615  -4.254
    5    HG2  LYS 707           HG2      LYS 707  56.342  -4.661  -3.338
    6    HG3  LYS 707           HG3      LYS 707  57.199  -3.167  -3.669
    7    HD2  LYS 707           HD2      LYS 707  54.859  -3.497  -1.780
    8    HD3  LYS 707           HD3      LYS 707  56.556  -3.367  -1.327
    9    HE2  LYS 707           HE2      LYS 707  55.768  -1.232  -0.932
   10    HE3  LYS 707           HE3      LYS 707  56.436  -1.067  -2.552
   11    HZ1  LYS 707           HZ1      LYS 707  53.599  -1.490  -1.848
   12    HZ3  LYS 707           HZ2      LYS 707  54.163  -1.262  -3.444
   13    HZ2  LYS 707           HZ3      LYS 707  54.271  -0.020  -2.317

  No H/Q in entry =          13
  In of MODEL   21
    1    H    LEU 708           H        LEU 708  56.397  -1.749  -7.000
    2    HA   LEU 708           HA       LEU 708  59.117  -2.705  -7.140
    3    HB2  LEU 708           HB2      LEU 708  57.903  -2.410  -9.293
    4    HB3  LEU 708           HB3      LEU 708  57.747  -0.708  -8.929
    5    HG   LEU 708           HG       LEU 708  60.440  -1.942  -8.995
    6   HD13  LEU 708          HD11      LEU 708  59.385  -2.684 -11.058
    7   HD12  LEU 708          HD12      LEU 708  60.565  -1.426 -11.420
    8   HD11  LEU 708          HD13      LEU 708  58.842  -1.041 -11.406
    9   HD21  LEU 708          HD21      LEU 708  59.401   0.786  -9.753
   10   HD23  LEU 708          HD22      LEU 708  61.088   0.279  -9.837
   11   HD22  LEU 708          HD23      LEU 708  60.269   0.366  -8.274

  No H/Q in entry =          11
  In of MODEL   21
    1    H    GLN 709           H        GLN 709  60.587  -1.661  -6.104
    2    HA   GLN 709           HA       GLN 709  60.322   1.168  -5.561
    3    HB2  GLN 709           HB2      GLN 709  60.889   0.998  -3.221
    4    HB3  GLN 709           HB3      GLN 709  59.504  -0.050  -3.472
    5    HG2  GLN 709           HG2      GLN 709  61.008  -2.014  -3.501
    6    HG3  GLN 709           HG3      GLN 709  62.363  -0.938  -3.333
    7   HE21  GLN 709          HE21      GLN 709  62.895  -0.074  -1.380
    8   HE22  GLN 709          HE22      GLN 709  62.151  -0.592   0.082

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ASN 710           H        ASN 710  62.343   2.113  -5.541
    2    HA   ASN 710           HA       ASN 710  64.639   2.332  -5.778
    3    HB2  ASN 710           HB2      ASN 710  64.377   0.867  -3.572
    4    HB3  ASN 710           HB3      ASN 710  64.813  -0.437  -4.625
    5   HD21  ASN 710          HD21      ASN 710  66.517  -0.707  -3.157
    6   HD22  ASN 710          HD22      ASN 710  67.944   0.247  -3.344

  No H/Q in entry =           6
  In of MODEL   21
    1    H    SER 711           H        SER 711  63.114   1.301  -7.900
    2    HA   SER 711           HA       SER 711  63.191   0.539  -9.950
    3    HB2  SER 711           HB2      SER 711  65.314   0.399 -11.179
    4    HB3  SER 711           HB3      SER 711  65.309   1.779 -10.077
    5    HG   SER 711           HG       SER 711  66.374   0.112  -8.608

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ARG 712           H        ARG 712  63.376  -1.462  -7.536
    2    HA   ARG 712           HA       ARG 712  63.676  -3.815  -9.250
    3    HB2  ARG 712           HB2      ARG 712  64.553  -5.056  -7.337
    4    HB3  ARG 712           HB3      ARG 712  65.595  -3.716  -7.784
    5    HG2  ARG 712           HG2      ARG 712  64.703  -2.399  -5.924
    6    HG3  ARG 712           HG3      ARG 712  63.641  -3.745  -5.507
    7    HD2  ARG 712           HD2      ARG 712  65.665  -3.656  -4.095
    8    HD3  ARG 712           HD3      ARG 712  65.534  -5.150  -5.021
    9    HE   ARG 712           HE       ARG 712  67.064  -3.853  -6.651
   10   HH11  ARG 712          HH11      ARG 712  67.279  -3.581  -3.110
   11   HH12  ARG 712          HH12      ARG 712  68.969  -3.485  -3.088
   12   HH21  ARG 712          HH21      ARG 712  69.424  -3.689  -6.595
   13   HH22  ARG 712          HH22      ARG 712  70.201  -3.525  -5.091

  No H/Q in entry =          13
  In of MODEL   21
    1    H    CYS 713           H        CYS 713  62.536  -5.736  -8.289
    2    HA   CYS 713           HA       CYS 713  59.953  -4.801  -7.323
    3    HB2  CYS 713           HB2      CYS 713  60.676  -7.397  -8.684
    4    HB3  CYS 713           HB3      CYS 713  59.054  -6.857  -8.266

  No H/Q in entry =           4
  In of MODEL   21
    1    H    VAL 714           H        VAL 714  59.324  -5.340  -5.391
    2    HA   VAL 714           HA       VAL 714  60.575  -7.600  -4.010
    3    HB   VAL 714           HB       VAL 714  60.351  -6.328  -1.851
    4   HG13  VAL 714          HG11      VAL 714  62.521  -6.352  -2.953
    5   HG12  VAL 714          HG12      VAL 714  62.252  -4.793  -2.167
    6   HG11  VAL 714          HG13      VAL 714  62.066  -4.946  -3.914
    7   HG21  VAL 714          HG21      VAL 714  59.698  -3.985  -3.646
    8   HG23  VAL 714          HG22      VAL 714  60.003  -3.883  -1.915
    9   HG22  VAL 714          HG23      VAL 714  58.596  -4.766  -2.513

  No H/Q in entry =           9
  In of MODEL   21
    1    H    CYS 715           H        CYS 715  58.967  -8.068  -1.987
    2    HA   CYS 715           HA       CYS 715  56.425  -8.492  -3.312
    3    HB2  CYS 715           HB2      CYS 715  57.605  -9.556  -0.775
    4    HB3  CYS 715           HB3      CYS 715  55.891  -9.722  -1.107

  No H/Q in entry =           4
  In of MODEL   21
    1    H    LYS 716           H        LYS 716  54.444  -7.955  -2.531
    2    HA   LYS 716           HA       LYS 716  54.292  -5.542  -0.977
    3    HB2  LYS 716           HB2      LYS 716  52.147  -7.342  -2.154
    4    HB3  LYS 716           HB3      LYS 716  51.837  -5.816  -1.343
    5    HG2  LYS 716           HG2      LYS 716  53.011  -4.614  -3.051
    6    HG3  LYS 716           HG3      LYS 716  53.481  -6.111  -3.853
    7    HD2  LYS 716           HD2      LYS 716  51.625  -5.098  -5.044
    8    HD3  LYS 716           HD3      LYS 716  51.070  -6.578  -4.265
    9    HE2  LYS 716           HE2      LYS 716  50.092  -5.264  -2.454
   10    HE3  LYS 716           HE3      LYS 716  50.680  -3.778  -3.207
   11    HZ2  LYS 716           HZ1      LYS 716  48.312  -4.268  -3.643
   12    HZ1  LYS 716           HZ2      LYS 716  48.770  -5.655  -4.472
   13    HZ3  LYS 716           HZ3      LYS 716  49.217  -4.147  -5.052

  No H/Q in entry =          13
  In of MODEL   21
    1    H    MET 717           H        MET 717  53.048  -5.480   0.949
    2    HA   MET 717           HA       MET 717  53.328  -7.910   2.538
    3    HB2  MET 717           HB2      MET 717  52.648  -5.061   3.259
    4    HB3  MET 717           HB3      MET 717  52.751  -6.353   4.437
    5    HG2  MET 717           HG2      MET 717  55.007  -5.432   2.676
    6    HG3  MET 717           HG3      MET 717  54.763  -4.935   4.349
    7    HE1  MET 717           HE1      MET 717  55.146  -6.498   6.430
    8    HE3  MET 717           HE2      MET 717  55.456  -8.226   6.319
    9    HE2  MET 717           HE3      MET 717  53.889  -7.584   5.838

  No H/Q in entry =           9
  In of MODEL   21
    1    HA   PRO 718           HA       PRO 718  49.124  -9.211   2.426
    2    HB2  PRO 718           HB2      PRO 718  48.418  -9.364   5.112
    3    HB3  PRO 718           HB3      PRO 718  49.254 -10.620   4.194
    4    HG2  PRO 718           HG2      PRO 718  50.388  -8.521   6.001
    5    HG3  PRO 718           HG3      PRO 718  50.853 -10.224   5.834
    6    HD2  PRO 718           HD2      PRO 718  52.330  -8.312   4.738
    7    HD3  PRO 718           HD3      PRO 718  52.040  -9.824   3.860

  No H/Q in entry =           7
  In of MODEL   21
    1    H    TYR 719           H        TYR 719  49.742  -6.246   4.075
    2    HA   TYR 719           HA       TYR 719  46.896  -5.652   4.239
    3    HB2  TYR 719           HB2      TYR 719  47.531  -3.579   5.417
    4    HB3  TYR 719           HB3      TYR 719  48.153  -5.028   6.190
    5    HD1  TYR 719           HD1      TYR 719  48.977  -1.868   4.644
    6    HD2  TYR 719           HD2      TYR 719  50.583  -5.571   5.977
    7    HE1  TYR 719           HE1      TYR 719  51.220  -0.874   4.677
    8    HE2  TYR 719           HE2      TYR 719  52.816  -4.583   6.034
    9    HH   TYR 719           HH       TYR 719  53.355  -1.242   5.746

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLU 720           H        GLU 720  49.331  -5.364   2.051
    2    HA   GLU 720           HA       GLU 720  48.221  -3.039   0.692
    3    HB2  GLU 720           HB2      GLU 720  50.490  -4.924   0.157
    4    HB3  GLU 720           HB3      GLU 720  50.048  -3.637  -0.971
    5    HG2  GLU 720           HG2      GLU 720  50.626  -2.010   0.793
    6    HG3  GLU 720           HG3      GLU 720  51.090  -3.348   1.846

  No H/Q in entry =           6
  In of MODEL   21
    1    H    CYS 721           H        CYS 721  47.394  -6.081   1.184
    2    HA   CYS 721           HA       CYS 721  46.762  -6.793  -1.573
    3    HB2  CYS 721           HB2      CYS 721  48.077  -8.506  -0.527
    4    HB3  CYS 721           HB3      CYS 721  47.034  -8.522   0.913

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLY 722           H        GLY 722  44.689  -7.468  -2.095
    2    HA3  GLY 722           HA2      GLY 722  42.590  -7.625  -0.202
    3    HA2  GLY 722           HA3      GLY 722  42.553  -6.105  -1.085

  No H/Q in entry =           3
  In of MODEL   21
    1    HA   PRO 723           HA       PRO 723  40.438  -7.847  -4.462
    2    HB2  PRO 723           HB2      PRO 723  41.824  -7.120  -6.691
    3    HB3  PRO 723           HB3      PRO 723  40.818  -6.014  -5.751
    4    HG2  PRO 723           HG2      PRO 723  43.783  -6.397  -5.683
    5    HG3  PRO 723           HG3      PRO 723  42.849  -4.892  -5.661
    6    HD2  PRO 723           HD2      PRO 723  43.898  -5.938  -3.419
    7    HD3  PRO 723           HD3      PRO 723  42.333  -5.097  -3.426

  No H/Q in entry =           7
  In of MODEL   21
    1    H    SER 724           H        SER 724  40.481 -10.074  -4.363
    2    HA   SER 724           HA       SER 724  41.741 -11.424  -6.446
    3    HB2  SER 724           HB2      SER 724  42.944 -13.028  -4.877
    4    HB3  SER 724           HB3      SER 724  43.741 -11.492  -5.225
    5    HG   SER 724           HG       SER 724  42.450 -10.859  -3.224

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU 725           H        LEU 725  41.219 -13.708  -6.428
    2    HA   LEU 725           HA       LEU 725  38.551 -14.170  -5.609
    3    HB2  LEU 725           HB2      LEU 725  40.697 -15.785  -6.875
    4    HB3  LEU 725           HB3      LEU 725  39.196 -16.550  -6.381
    5    HG   LEU 725           HG       LEU 725  39.343 -14.235  -8.311
    6   HD11  LEU 725          HD11      LEU 725  39.128 -17.206  -8.855
    7   HD13  LEU 725          HD12      LEU 725  40.528 -16.192  -9.221
    8   HD12  LEU 725          HD13      LEU 725  39.003 -15.927 -10.062
    9   HD21  LEU 725          HD21      LEU 725  37.175 -16.213  -7.643
   10   HD23  LEU 725          HD22      LEU 725  37.104 -14.996  -8.915
   11   HD22  LEU 725          HD23      LEU 725  37.191 -14.494  -7.229

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ASP 726           H        ASP 726  37.787 -15.057  -3.865
    2    HA   ASP 726           HA       ASP 726  39.453 -15.729  -1.672
    3    HB2  ASP 726           HB2      ASP 726  36.497 -16.232  -2.103
    4    HB3  ASP 726           HB3      ASP 726  37.347 -16.388  -0.573

  No H/Q in entry =           4
  In of MODEL   21
    1    H    VAL 727           H        VAL 727  40.216 -17.641  -1.079
    2    HA   VAL 727           HA       VAL 727  39.240 -20.116  -2.287
    3    HB   VAL 727           HB       VAL 727  41.582 -20.882  -2.786
    4   HG12  VAL 727          HG11      VAL 727  40.733 -18.432  -4.338
    5   HG11  VAL 727          HG12      VAL 727  40.198 -20.085  -4.630
    6   HG13  VAL 727          HG13      VAL 727  41.879 -19.647  -4.901
    7   HG23  VAL 727          HG21      VAL 727  42.315 -17.982  -2.360
    8   HG22  VAL 727          HG22      VAL 727  43.399 -19.237  -2.972
    9   HG21  VAL 727          HG23      VAL 727  42.787 -19.324  -1.323

  No H/Q in entry =           9
  In of MODEL   21
    1    H    CYS 728           H        CYS 728  39.819 -21.996  -1.037
    2    HA   CYS 728           HA       CYS 728  40.554 -21.348   1.730
    3    HB2  CYS 728           HB2      CYS 728  39.469 -23.932   0.596
    4    HB3  CYS 728           HB3      CYS 728  39.654 -23.522   2.295

  No H/Q in entry =           4
  In of MODEL   21
    1    H    ALA 729           H        ALA 729  42.491 -22.113   2.662
    2    HA   ALA 729           HA       ALA 729  43.960 -24.048   1.022
    3    HB1  ALA 729           HB1      ALA 729  45.154 -21.673   2.443
    4    HB3  ALA 729           HB2      ALA 729  44.907 -21.794   0.699
    5    HB2  ALA 729           HB3      ALA 729  46.034 -22.883   1.510

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLN 730           H        GLN 730  45.737 -25.014   2.359
    2    HA   GLN 730           HA       GLN 730  44.800 -25.424   5.090
    3    HB2  GLN 730           HB2      GLN 730  44.765 -27.536   3.966
    4    HB3  GLN 730           HB3      GLN 730  46.299 -27.212   3.194
    5    HG2  GLN 730           HG2      GLN 730  47.477 -27.412   5.284
    6    HG3  GLN 730           HG3      GLN 730  45.960 -27.614   6.150
    7   HE21  GLN 730          HE21      GLN 730  45.128 -29.577   6.323
    8   HE22  GLN 730          HE22      GLN 730  45.790 -30.992   5.570

  No H/Q in entry =           8
  In of MODEL   21
    1    H    ASP 731           H        ASP 731  46.089 -24.655   6.602
    2    HA   ASP 731           HA       ASP 731  48.635 -23.401   6.094
    3    HB2  ASP 731           HB2      ASP 731  47.077 -22.725   7.955
    4    HB3  ASP 731           HB3      ASP 731  47.441 -24.253   8.742

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLU 732           H        GLU 732  50.686 -24.329   6.253
    2    HA   GLU 732           HA       GLU 732  50.794 -27.152   6.394
    3    HB2  GLU 732           HB2      GLU 732  52.894 -25.078   6.014
    4    HB3  GLU 732           HB3      GLU 732  53.366 -26.739   6.345
    5    HG2  GLU 732           HG2      GLU 732  51.638 -25.782   4.081
    6    HG3  GLU 732           HG3      GLU 732  53.304 -26.362   3.974

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ARG 733           H        ARG 733  51.063 -24.865   8.908
    2    HA   ARG 733           HA       ARG 733  52.481 -26.809  10.554
    3    HB2  ARG 733           HB2      ARG 733  53.311 -24.545  10.713
    4    HB3  ARG 733           HB3      ARG 733  51.695 -23.932  11.041
    5    HG2  ARG 733           HG2      ARG 733  53.013 -23.969  13.069
    6    HG3  ARG 733           HG3      ARG 733  51.691 -25.129  13.177
    7    HD2  ARG 733           HD2      ARG 733  53.266 -26.933  12.586
    8    HD3  ARG 733           HD3      ARG 733  54.578 -25.751  12.555
    9    HE   ARG 733           HE       ARG 733  53.103 -25.760  15.002
   10   HH11  ARG 733          HH11      ARG 733  55.747 -27.399  13.312
   11   HH12  ARG 733          HH12      ARG 733  56.542 -27.869  14.738
   12   HH21  ARG 733          HH21      ARG 733  54.143 -26.431  16.908
   13   HH22  ARG 733          HH22      ARG 733  55.611 -27.307  16.862

  No H/Q in entry =          13
  In of MODEL   21
    1    H    SER 734           H        SER 734  49.543 -24.898  10.465
    2    HA   SER 734           HA       SER 734  48.447 -26.211  12.760
    3    HB2  SER 734           HB2      SER 734  47.072 -24.401  10.782
    4    HB3  SER 734           HB3      SER 734  46.586 -24.731  12.447
    5    HG   SER 734           HG       SER 734  48.858 -23.888  12.880

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LYS 735           H        LYS 735  48.292 -26.734   9.254
    2    HA   LYS 735           HA       LYS 735  47.287 -28.078   7.952
    3    HB2  LYS 735           HB2      LYS 735  47.232 -29.808  10.399
    4    HB3  LYS 735           HB3      LYS 735  46.646 -30.366   8.847
    5    HG2  LYS 735           HG2      LYS 735  49.438 -29.404   9.431
    6    HG3  LYS 735           HG3      LYS 735  48.948 -31.085   9.158
    7    HD2  LYS 735           HD2      LYS 735  48.004 -30.192   6.908
    8    HD3  LYS 735           HD3      LYS 735  49.004 -28.795   7.220
    9    HE2  LYS 735           HE2      LYS 735  50.992 -30.067   7.198
   10    HE3  LYS 735           HE3      LYS 735  50.099 -31.592   7.115
   11    HZ3  LYS 735           HZ1      LYS 735  50.876 -31.044   4.925
   12    HZ2  LYS 735           HZ2      LYS 735  50.265 -29.491   4.983
   13    HZ1  LYS 735           HZ3      LYS 735  49.217 -30.808   4.942

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ARG 736           H        ARG 736  45.640 -26.241   9.544
    2    HA   ARG 736           HA       ARG 736  43.058 -27.506   9.213
    3    HB2  ARG 736           HB2      ARG 736  42.132 -25.504  10.276
    4    HB3  ARG 736           HB3      ARG 736  43.359 -26.278  11.268
    5    HG2  ARG 736           HG2      ARG 736  44.961 -24.628  10.704
    6    HG3  ARG 736           HG3      ARG 736  43.886 -23.920   9.501
    7    HD2  ARG 736           HD2      ARG 736  43.938 -22.649  11.497
    8    HD3  ARG 736           HD3      ARG 736  42.324 -23.297  11.239
    9    HE   ARG 736           HE       ARG 736  44.253 -24.448  13.160
   10   HH11  ARG 736          HH11      ARG 736  40.920 -23.531  12.343
   11   HH12  ARG 736          HH12      ARG 736  40.323 -23.817  13.908
   12   HH21  ARG 736          HH21      ARG 736  43.433 -24.859  15.270
   13   HH22  ARG 736          HH22      ARG 736  41.779 -24.603  15.625

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ILE 737           H        ILE 737  41.450 -26.562   7.841
    2    HA   ILE 737           HA       ILE 737  42.509 -25.230   5.540
    3    HB   ILE 737           HB       ILE 737  39.623 -25.747   6.236
    4   HG12  ILE 737          HG12      ILE 737  40.917 -27.888   6.310
    5   HG13  ILE 737          HG13      ILE 737  39.722 -27.854   5.024
    6   HG21  ILE 737          HG21      ILE 737  40.094 -24.168   4.414
    7   HG23  ILE 737          HG22      ILE 737  39.279 -25.616   3.822
    8   HG22  ILE 737          HG23      ILE 737  41.020 -25.415   3.581
    9   HD13  ILE 737          HD11      ILE 737  41.450 -27.371   3.424
   10   HD12  ILE 737          HD12      ILE 737  41.794 -28.873   4.290
   11   HD11  ILE 737          HD13      ILE 737  42.675 -27.388   4.695

  No H/Q in entry =          11
  In of MODEL   21
    1    H    LEU 738           H        LEU 738  42.382 -23.123   5.202
    2    HA   LEU 738           HA       LEU 738  40.646 -21.514   6.892
    3    HB2  LEU 738           HB2      LEU 738  42.313 -19.668   6.733
    4    HB3  LEU 738           HB3      LEU 738  42.564 -20.950   7.879
    5    HG   LEU 738           HG       LEU 738  44.371 -19.868   6.559
    6   HD12  LEU 738          HD11      LEU 738  45.674 -22.034   6.623
    7   HD11  LEU 738          HD12      LEU 738  44.105 -22.817   6.955
    8   HD13  LEU 738          HD13      LEU 738  44.762 -21.631   8.095
    9   HD22  LEU 738          HD21      LEU 738  45.147 -20.902   4.552
   10   HD21  LEU 738          HD22      LEU 738  43.438 -20.430   4.321
   11   HD23  LEU 738          HD23      LEU 738  43.865 -22.091   4.650

  No H/Q in entry =          11
  In of MODEL   21
    1    HA   PRO 739           HA       PRO 739  39.371 -19.405   3.231
    2    HB2  PRO 739           HB2      PRO 739  38.372 -17.187   4.329
    3    HB3  PRO 739           HB3      PRO 739  37.537 -18.742   4.489
    4    HG2  PRO 739           HG2      PRO 739  39.243 -17.287   6.483
    5    HG3  PRO 739           HG3      PRO 739  37.764 -18.227   6.754
    6    HD2  PRO 739           HD2      PRO 739  40.340 -19.235   7.191
    7    HD3  PRO 739           HD3      PRO 739  38.901 -20.210   6.829

  No H/Q in entry =           7
  In of MODEL   21
    1    H    LEU 740           H        LEU 740  40.947 -18.619   1.980
    2    HA   LEU 740           HA       LEU 740  42.352 -16.183   2.831
    3    HB2  LEU 740           HB2      LEU 740  43.467 -18.546   1.326
    4    HB3  LEU 740           HB3      LEU 740  44.238 -16.982   1.324
    5    HG   LEU 740           HG       LEU 740  43.786 -18.707   3.744
    6   HD11  LEU 740          HD11      LEU 740  45.447 -19.596   2.176
    7   HD13  LEU 740          HD12      LEU 740  46.175 -19.078   3.687
    8   HD12  LEU 740          HD13      LEU 740  46.325 -18.063   2.234
    9   HD23  LEU 740          HD21      LEU 740  45.262 -17.118   4.883
   10   HD22  LEU 740          HD22      LEU 740  43.781 -16.349   4.329
   11   HD21  LEU 740          HD23      LEU 740  45.288 -16.111   3.438

  No H/Q in entry =          11
  In of MODEL   21
    1    H    THR 741           H        THR 741  43.519 -15.467   0.622
    2    HA   THR 741           HA       THR 741  41.562 -15.507  -1.516
    3    HB   THR 741           HB       THR 741  42.947 -12.946  -1.162
    4    HG1  THR 741           HG1      THR 741  40.966 -13.386   0.776
    5   HG21  THR 741          HG21      THR 741  40.944 -13.291  -2.566
    6   HG23  THR 741          HG22      THR 741  40.667 -12.056  -1.337
    7   HG22  THR 741          HG23      THR 741  40.009 -13.675  -1.118

  No H/Q in entry =           7
  In of MODEL   21
    1    H    VAL 742           H        VAL 742  42.657 -15.318  -3.561
    2    HA   VAL 742           HA       VAL 742  45.035 -16.655  -3.952
    3    HB   VAL 742           HB       VAL 742  44.033 -14.421  -5.674
    4   HG13  VAL 742          HG11      VAL 742  46.154 -14.786  -6.385
    5   HG12  VAL 742          HG12      VAL 742  45.107 -15.592  -7.556
    6   HG11  VAL 742          HG13      VAL 742  45.988 -16.530  -6.340
    7   HG22  VAL 742          HG21      VAL 742  42.280 -15.927  -5.388
    8   HG21  VAL 742          HG22      VAL 742  43.322 -17.317  -5.679
    9   HG23  VAL 742          HG23      VAL 742  42.949 -16.184  -7.000

  No H/Q in entry =           9
  In of MODEL   21
    1    H    CYS 743           H        CYS 743  44.669 -13.147  -3.861
    2    HA   CYS 743           HA       CYS 743  47.333 -12.511  -4.260
    3    HB2  CYS 743           HB2      CYS 743  45.813 -10.743  -4.574
    4    HB3  CYS 743           HB3      CYS 743  45.026 -11.065  -3.025

  No H/Q in entry =           4
  In of MODEL   21
    1    H    LYS 744           H        LYS 744  45.536 -12.658  -1.196
    2    HA   LYS 744           HA       LYS 744  47.607 -12.172   0.532
    3    HB2  LYS 744           HB2      LYS 744  45.204 -12.316   1.060
    4    HB3  LYS 744           HB3      LYS 744  45.318 -14.058   1.005
    5    HG2  LYS 744           HG2      LYS 744  46.804 -14.121   2.889
    6    HG3  LYS 744           HG3      LYS 744  46.936 -12.363   2.901
    7    HD2  LYS 744           HD2      LYS 744  44.551 -12.194   3.408
    8    HD3  LYS 744           HD3      LYS 744  44.418 -13.953   3.404
    9    HE2  LYS 744           HE2      LYS 744  45.905 -14.100   5.305
   10    HE3  LYS 744           HE3      LYS 744  46.193 -12.364   5.261
   11    HZ3  LYS 744           HZ1      LYS 744  44.586 -12.916   6.959
   12    HZ2  LYS 744           HZ2      LYS 744  43.582 -13.674   5.839
   13    HZ1  LYS 744           HZ3      LYS 744  43.854 -12.011   5.748

  No H/Q in entry =          13
  In of MODEL   21
    1    H    MET 745           H        MET 745  46.477 -15.336  -0.605
    2    HA   MET 745           HA       MET 745  48.392 -16.975   0.617
    3    HB2  MET 745           HB2      MET 745  46.900 -18.250  -0.297
    4    HB3  MET 745           HB3      MET 745  46.517 -17.195  -1.650
    5    HG2  MET 745           HG2      MET 745  47.414 -19.116  -2.692
    6    HG3  MET 745           HG3      MET 745  48.769 -18.024  -2.616
    7    HE2  MET 745           HE1      MET 745  48.227 -21.772  -0.013
    8    HE1  MET 745           HE2      MET 745  47.144 -21.229  -1.294
    9    HE3  MET 745           HE3      MET 745  47.218 -20.348   0.233

  No H/Q in entry =           9
  In of MODEL   21
    1    H    HIS 746           H        HIS 746  48.588 -15.141  -2.381
    2    HA   HIS 746           HA       HIS 746  51.137 -16.295  -3.132
    3    HB2  HIS 746           HB2      HIS 746  49.433 -14.170  -4.179
    4    HB3  HIS 746           HB3      HIS 746  51.137 -14.074  -4.650
    5    HD1  HIS 746           HD1      HIS 746  51.956 -16.032  -6.219
    6    HD2  HIS 746           HD2      HIS 746  47.896 -16.054  -5.416
    7    HE1  HIS 746           HE1      HIS 746  50.932 -17.414  -8.038
    8    HE2  HIS 746           HE2      HIS 746  48.447 -17.236  -7.648

  No H/Q in entry =           8
  In of MODEL   21
    1    H    VAL 747           H        VAL 747  50.155 -13.187  -1.814
    2    HA   VAL 747           HA       VAL 747  52.676 -12.020  -1.553
    3    HB   VAL 747           HB       VAL 747  50.047 -11.634  -0.106
    4   HG11  VAL 747          HG11      VAL 747  51.827 -11.050   1.520
    5   HG13  VAL 747          HG12      VAL 747  50.980  -9.612   0.981
    6   HG12  VAL 747          HG13      VAL 747  52.567  -9.993   0.329
    7   HG22  VAL 747          HG21      VAL 747  50.073  -9.502  -1.333
    8   HG21  VAL 747          HG22      VAL 747  50.192 -10.904  -2.409
    9   HG23  VAL 747          HG23      VAL 747  51.631  -9.964  -2.026

  No H/Q in entry =           9
  In of MODEL   21
    1    H    LEU 748           H        LEU 748  50.734 -13.743   0.814
    2    HA   LEU 748           HA       LEU 748  52.671 -13.773   2.807
    3    HB2  LEU 748           HB2      LEU 748  50.693 -14.134   3.793
    4    HB3  LEU 748           HB3      LEU 748  49.985 -14.751   2.338
    5    HG   LEU 748           HG       LEU 748  51.587 -16.478   4.239
    6   HD12  LEU 748          HD11      LEU 748  48.603 -16.036   4.041
    7   HD11  LEU 748          HD12      LEU 748  49.621 -15.435   5.358
    8   HD13  LEU 748          HD13      LEU 748  49.417 -17.172   5.115
    9   HD21  LEU 748          HD21      LEU 748  51.230 -17.301   1.896
   10   HD23  LEU 748          HD22      LEU 748  49.485 -17.162   2.174
   11   HD22  LEU 748          HD23      LEU 748  50.442 -18.281   3.130

  No H/Q in entry =          11
  In of MODEL   21
    1    H    HIS 749           H        HIS 749  52.176 -15.838   0.086
    2    HA   HIS 749           HA       HIS 749  53.849 -17.945   1.061
    3    HB2  HIS 749           HB2      HIS 749  52.055 -17.996  -0.859
    4    HB3  HIS 749           HB3      HIS 749  53.413 -17.513  -1.867
    5    HD1  HIS 749           HD1      HIS 749  55.385 -19.261  -2.073
    6    HD2  HIS 749           HD2      HIS 749  52.009 -20.582  -0.068
    7    HE1  HIS 749           HE1      HIS 749  55.615 -21.771  -1.919
    8    HE2  HIS 749           HE2      HIS 749  53.384 -22.505  -1.061

  No H/Q in entry =           8
  In of MODEL   21
    1    H    CYS 750           H        CYS 750  54.320 -15.059  -0.990
    2    HA   CYS 750           HA       CYS 750  57.012 -15.864  -1.527
    3    HB2  CYS 750           HB2      CYS 750  57.292 -13.878  -2.819
    4    HB3  CYS 750           HB3      CYS 750  55.667 -14.453  -3.141

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLN 751           H        GLN 751  55.339 -14.055   0.864
    2    HA   GLN 751           HA       GLN 751  57.548 -12.834   2.109
    3    HB2  GLN 751           HB2      GLN 751  54.933 -13.806   3.260
    4    HB3  GLN 751           HB3      GLN 751  56.113 -12.889   4.176
    5    HG2  GLN 751           HG2      GLN 751  54.762 -11.923   1.674
    6    HG3  GLN 751           HG3      GLN 751  54.209 -11.546   3.295
    7   HE21  GLN 751          HE21      GLN 751  55.033  -9.702   1.232
    8   HE22  GLN 751          HE22      GLN 751  56.365  -8.831   1.864

  No H/Q in entry =           8
  In of MODEL   21
    1    H    GLY 752           H        GLY 752  56.603 -16.122   1.880
    2    HA3  GLY 752           HA2      GLY 752  58.286 -17.776   2.389
    3    HA2  GLY 752           HA3      GLY 752  58.728 -16.823   3.795

  No H/Q in entry =           3
  In of MODEL   21
    1    H    ARG 753           H        ARG 753  55.392 -17.605   2.909
    2    HA   ARG 753           HA       ARG 753  55.326 -19.421   5.225
    3    HB2  ARG 753           HB2      ARG 753  52.978 -17.882   4.109
    4    HB3  ARG 753           HB3      ARG 753  53.047 -18.771   5.624
    5    HG2  ARG 753           HG2      ARG 753  54.531 -16.223   4.994
    6    HG3  ARG 753           HG3      ARG 753  53.122 -16.374   6.039
    7    HD2  ARG 753           HD2      ARG 753  54.343 -17.630   7.642
    8    HD3  ARG 753           HD3      ARG 753  55.704 -17.836   6.538
    9    HE   ARG 753           HE       ARG 753  55.043 -15.108   7.170
   10   HH11  ARG 753          HH11      ARG 753  56.987 -17.888   8.209
   11   HH12  ARG 753          HH12      ARG 753  58.235 -16.932   8.873
   12   HH21  ARG 753          HH21      ARG 753  56.746 -13.825   8.092
   13   HH22  ARG 753          HH22      ARG 753  58.109 -14.574   8.773

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ASN 754           H        ASN 754  54.234 -21.400   4.934
    2    HA   ASN 754           HA       ASN 754  53.839 -22.019   2.091
    3    HB2  ASN 754           HB2      ASN 754  54.624 -23.960   4.281
    4    HB3  ASN 754           HB3      ASN 754  54.418 -24.342   2.582
    5   HD21  ASN 754          HD21      ASN 754  56.471 -22.934   4.944
    6   HD22  ASN 754          HD22      ASN 754  57.832 -22.655   3.933

  No H/Q in entry =           6
  In of MODEL   21
    1    H    TYR 755           H        TYR 755  51.954 -22.639   1.426
    2    HA   TYR 755           HA       TYR 755  50.051 -23.747   3.299
    3    HB2  TYR 755           HB2      TYR 755  49.623 -21.307   1.606
    4    HB3  TYR 755           HB3      TYR 755  48.277 -22.325   2.102
    5    HD1  TYR 755           HD1      TYR 755  51.046 -20.228   3.342
    6    HD2  TYR 755           HD2      TYR 755  47.364 -22.094   4.264
    7    HE1  TYR 755           HE1      TYR 755  50.988 -19.028   5.453
    8    HE2  TYR 755           HE2      TYR 755  47.289 -20.903   6.399
    9    HH   TYR 755           HH       TYR 755  48.961 -19.989   7.930

  No H/Q in entry =           9
  In of MODEL   21
    1    H    THR 756           H        THR 756  48.825 -25.216   2.460
    2    HA   THR 756           HA       THR 756  49.396 -26.074  -0.250
    3    HB   THR 756           HB       THR 756  48.035 -27.371   2.119
    4    HG1  THR 756           HG1      THR 756  50.046 -27.783   2.640
    5   HG22  THR 756          HG21      THR 756  48.707 -28.560  -0.572
    6   HG21  THR 756          HG22      THR 756  47.093 -28.181   0.044
    7   HG23  THR 756          HG23      THR 756  48.051 -29.448   0.820

  No H/Q in entry =           7
  In of MODEL   21
    1    H    LEU 757           H        LEU 757  47.758 -26.090  -1.825
    2    HA   LEU 757           HA       LEU 757  45.398 -24.572  -1.193
    3    HB2  LEU 757           HB2      LEU 757  46.433 -25.745  -3.767
    4    HB3  LEU 757           HB3      LEU 757  44.821 -25.082  -3.649
    5    HG   LEU 757           HG       LEU 757  46.236 -23.461  -4.656
    6   HD13  LEU 757          HD11      LEU 757  44.546 -22.574  -3.231
    7   HD12  LEU 757          HD12      LEU 757  45.988 -21.565  -3.111
    8   HD11  LEU 757          HD13      LEU 757  45.596 -22.688  -1.824
    9   HD21  LEU 757          HD21      LEU 757  48.032 -23.671  -2.228
   10   HD23  LEU 757          HD22      LEU 757  48.209 -22.498  -3.535
   11   HD22  LEU 757          HD23      LEU 757  48.422 -24.218  -3.860

  No H/Q in entry =          11
  In of MODEL   21
    1    H    THR 758           H        THR 758  43.330 -25.246  -1.185
    2    HA   THR 758           HA       THR 758  42.892 -28.108  -1.396
    3    HB   THR 758           HB       THR 758  41.310 -27.862   0.602
    4    HG1  THR 758           HG1      THR 758  41.941 -25.336   0.414
    5   HG23  THR 758          HG21      THR 758  43.114 -28.147   2.254
    6   HG22  THR 758          HG22      THR 758  44.277 -27.508   1.092
    7   HG21  THR 758          HG23      THR 758  43.457 -29.037   0.771

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLY 759           H        GLY 759  40.186 -28.170  -0.909
    2    HA3  GLY 759           HA2      GLY 759  39.272 -26.993  -3.354
    3    HA2  GLY 759           HA3      GLY 759  38.377 -28.072  -2.299

  No H/Q in entry =           3
  In of MODEL   21
    1    H    ARG 760           H        ARG 760  37.036 -26.108  -3.331
    2    HA   ARG 760           HA       ARG 760  36.954 -23.582  -2.076
    3    HB2  ARG 760           HB2      ARG 760  35.865 -24.397  -4.222
    4    HB3  ARG 760           HB3      ARG 760  34.621 -25.117  -3.202
    5    HG2  ARG 760           HG2      ARG 760  35.393 -22.281  -3.535
    6    HG3  ARG 760           HG3      ARG 760  33.935 -23.189  -4.128
    7    HD2  ARG 760           HD2      ARG 760  34.599 -22.756  -1.272
    8    HD3  ARG 760           HD3      ARG 760  33.681 -21.553  -2.201
    9    HE   ARG 760           HE       ARG 760  32.235 -23.738  -2.625
   10   HH11  ARG 760          HH11      ARG 760  33.713 -22.844   0.497
   11   HH12  ARG 760          HH12      ARG 760  32.358 -23.329   1.396
   12   HH21  ARG 760          HH21      ARG 760  30.427 -24.390  -1.345
   13   HH22  ARG 760          HH22      ARG 760  30.463 -24.212   0.357

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ASP 761           H        ASP 761  35.042 -26.420  -1.850
    2    HA   ASP 761           HA       ASP 761  33.442 -25.527   0.318
    3    HB2  ASP 761           HB2      ASP 761  32.639 -26.846  -1.518
    4    HB3  ASP 761           HB3      ASP 761  33.656 -28.198  -1.071

  No H/Q in entry =           4
  In of MODEL   21
    1    H    SER 762           H        SER 762  36.368 -25.976   0.650
    2    HA   SER 762           HA       SER 762  36.340 -27.884   2.867
    3    HB2  SER 762           HB2      SER 762  38.684 -26.350   1.717
    4    HB3  SER 762           HB3      SER 762  38.792 -27.590   2.964
    5    HG   SER 762           HG       SER 762  37.380 -28.661   1.104

  No H/Q in entry =           5
  In of MODEL   21
    1    H    CYS 763           H        CYS 763  36.363 -24.431   2.297
    2    HA   CYS 763           HA       CYS 763  36.066 -24.150   5.182
    3    HB2  CYS 763           HB2      CYS 763  37.277 -22.133   5.291
    4    HB3  CYS 763           HB3      CYS 763  38.336 -23.260   4.463

  No H/Q in entry =           4
  In of MODEL   21
    1    H    THR 764           H        THR 764  34.981 -22.120   5.740
    2    HA   THR 764           HA       THR 764  32.739 -21.720   3.966
    3    HB   THR 764           HB       THR 764  33.304 -20.440   6.650
    4    HG1  THR 764           HG1      THR 764  32.563 -23.020   5.947
    5   HG23  THR 764          HG21      THR 764  30.860 -20.244   6.761
    6   HG22  THR 764          HG22      THR 764  30.727 -21.019   5.177
    7   HG21  THR 764          HG23      THR 764  31.494 -19.436   5.325

  No H/Q in entry =           7
  In of MODEL   21
    1    H    LEU 765           H        LEU 765  33.423 -20.541   2.330
    2    HA   LEU 765           HA       LEU 765  35.489 -18.660   2.414
    3    HB2  LEU 765           HB2      LEU 765  34.399 -20.138   0.515
    4    HB3  LEU 765           HB3      LEU 765  33.456 -18.689   0.239
    5    HG   LEU 765           HG       LEU 765  35.513 -17.422  -0.164
    6   HD12  LEU 765          HD11      LEU 765  37.640 -18.684  -0.409
    7   HD11  LEU 765          HD12      LEU 765  36.843 -20.102   0.274
    8   HD13  LEU 765          HD13      LEU 765  37.060 -18.658   1.252
    9   HD22  LEU 765          HD21      LEU 765  36.109 -18.460  -2.266
   10   HD21  LEU 765          HD22      LEU 765  34.355 -18.523  -2.029
   11   HD23  LEU 765          HD23      LEU 765  35.353 -19.966  -1.760

  No H/Q in entry =          11
  In of MODEL   21
    1    HA   PRO 766           HA       PRO 766  33.057 -15.182   3.830
    2    HB2  PRO 766           HB2      PRO 766  34.926 -13.461   4.066
    3    HB3  PRO 766           HB3      PRO 766  35.198 -15.029   4.865
    4    HG2  PRO 766           HG2      PRO 766  35.982 -14.187   2.128
    5    HG3  PRO 766           HG3      PRO 766  37.146 -14.656   3.421
    6    HD2  PRO 766           HD2      PRO 766  36.268 -16.478   1.611
    7    HD3  PRO 766           HD3      PRO 766  36.408 -16.916   3.330

  No H/Q in entry =           7
  In of MODEL   21
    1    H    ALA 767           H        ALA 767  33.790 -12.524   3.194
    2    HA   ALA 767           HA       ALA 767  33.530 -12.083   0.349
    3    HB2  ALA 767           HB1      ALA 767  31.546 -10.751   0.845
    4    HB1  ALA 767           HB2      ALA 767  31.698 -11.409   2.519
    5    HB3  ALA 767           HB3      ALA 767  31.366 -12.509   1.177

  No H/Q in entry =           5
  In of MODEL   21
    1    H    SER 768           H        SER 768  33.402  -9.686   0.087
    2    HA   SER 768           HA       SER 768  35.624  -8.498   1.232
    3    HB2  SER 768           HB2      SER 768  33.405  -7.120  -0.259
    4    HB3  SER 768           HB3      SER 768  35.144  -6.783  -0.256
    5    HG   SER 768           HG       SER 768  35.526  -8.644  -1.344

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA 769           H        ALA 769  32.123  -7.569   1.462
    2    HA   ALA 769           HA       ALA 769  32.129  -6.917   4.182
    3    HB3  ALA 769           HB1      ALA 769  32.285  -4.577   2.261
    4    HB2  ALA 769           HB2      ALA 769  33.498  -5.007   3.468
    5    HB1  ALA 769           HB3      ALA 769  31.899  -4.468   3.980

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLU 770           H        GLU 770  30.035  -5.473   4.532
    2    HA   GLU 770           HA       GLU 770  28.010  -6.826   3.029
    3    HB2  GLU 770           HB2      GLU 770  26.415  -5.754   4.617
    4    HB3  GLU 770           HB3      GLU 770  27.631  -6.758   5.386
    5    HG2  GLU 770           HG2      GLU 770  28.869  -4.820   6.075
    6    HG3  GLU 770           HG3      GLU 770  27.783  -3.762   5.174

  No H/Q in entry =           6
  In of MODEL   21
    1    H    LYS 771           H        LYS 771  26.629  -6.071   1.648
    2    HA   LYS 771           HA       LYS 771  26.697  -3.291   0.742
    3    HB2  LYS 771           HB2      LYS 771  27.527  -5.626  -0.995
    4    HB3  LYS 771           HB3      LYS 771  27.372  -3.961  -1.516
    5    HG2  LYS 771           HG2      LYS 771  29.315  -4.877   0.571
    6    HG3  LYS 771           HG3      LYS 771  29.700  -4.783  -1.144
    7    HD2  LYS 771           HD2      LYS 771  29.474  -2.461  -1.171
    8    HD3  LYS 771           HD3      LYS 771  28.634  -2.436   0.385
    9    HE2  LYS 771           HE2      LYS 771  30.510  -3.051   1.539
   10    HE3  LYS 771           HE3      LYS 771  31.412  -3.488   0.105
   11    HZ2  LYS 771           HZ1      LYS 771  32.151  -1.309   0.927
   12    HZ1  LYS 771           HZ2      LYS 771  30.599  -0.676   0.802
   13    HZ3  LYS 771           HZ3      LYS 771  31.445  -1.160  -0.576

  No H/Q in entry =          13
  In of MODEL   21
    1    H    ALA 772           H        ALA 772  25.419  -3.417  -1.498
    2    HA   ALA 772           HA       ALA 772  22.755  -4.439  -1.550
    3    HB3  ALA 772           HB1      ALA 772  23.742  -2.808  -3.098
    4    HB2  ALA 772           HB2      ALA 772  23.113  -4.224  -3.944
    5    HB1  ALA 772           HB3      ALA 772  24.846  -4.049  -3.686

  No H/Q in entry =           5
  In of MODEL   21
    1    H    CYS 773           H        CYS 773  21.927  -6.467  -1.822
    2    HA   CYS 773           HA       CYS 773  21.829  -8.643  -1.780
    3    HB2  CYS 773           HB2      CYS 773  24.053  -8.311  -3.763
    4    HB3  CYS 773           HB3      CYS 773  23.424  -9.866  -3.242

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLY 774           H        GLY 774  23.721  -7.210   0.050
    2    HA3  GLY 774           HA2      GLY 774  24.694  -7.950   1.967
    3    HA2  GLY 774           HA3      GLY 774  24.672  -9.587   1.335

  No H/Q in entry =           3
  In of MODEL   21
    1    H    ALA 775           H        ALA 775  26.165  -8.512  -1.182
    2    HA   ALA 775           HA       ALA 775  28.716  -7.768  -0.124
    3    HB2  ALA 775           HB1      ALA 775  28.691 -10.149   0.461
    4    HB1  ALA 775           HB2      ALA 775  29.916  -9.792  -0.757
    5    HB3  ALA 775           HB3      ALA 775  28.400 -10.558  -1.229

  No H/Q in entry =           5
  In of MODEL   21
    1    H    CYS 776           H        CYS 776  29.718  -6.630  -1.621
    2    HA   CYS 776           HA       CYS 776  29.349  -7.297  -4.458
    3    HB2  CYS 776           HB2      CYS 776  29.585  -4.488  -3.321
    4    HB3  CYS 776           HB3      CYS 776  29.532  -4.900  -5.024

  No H/Q in entry =           4
  In of MODEL   21
    1    HA   PRO 777           HA       PRO 777  33.816  -7.133  -3.782
    2    HB2  PRO 777           HB2      PRO 777  34.468  -9.288  -5.218
    3    HB3  PRO 777           HB3      PRO 777  33.778  -9.451  -3.602
    4    HG2  PRO 777           HG2      PRO 777  32.500  -9.871  -6.251
    5    HG3  PRO 777           HG3      PRO 777  32.198 -10.693  -4.712
    6    HD2  PRO 777           HD2      PRO 777  30.671  -8.592  -5.824
    7    HD3  PRO 777           HD3      PRO 777  30.559  -9.226  -4.170

  No H/Q in entry =           7
  In of MODEL   21
    1    H    LEU 778           H        LEU 778  35.579  -7.334  -5.517
    2    HA   LEU 778           HA       LEU 778  35.441  -5.330  -7.358
    3    HB2  LEU 778           HB2      LEU 778  37.471  -6.385  -8.427
    4    HB3  LEU 778           HB3      LEU 778  37.565  -5.983  -6.728
    5    HG   LEU 778           HG       LEU 778  36.874  -8.805  -7.488
    6   HD13  LEU 778          HD11      LEU 778  39.199  -9.392  -7.588
    7   HD12  LEU 778          HD12      LEU 778  39.682  -7.700  -7.437
    8   HD11  LEU 778          HD13      LEU 778  38.821  -8.257  -8.885
    9   HD23  LEU 778          HD21      LEU 778  38.227  -9.277  -5.461
   10   HD22  LEU 778          HD22      LEU 778  36.836  -8.273  -5.120
   11   HD21  LEU 778          HD23      LEU 778  38.441  -7.544  -5.228

  No H/Q in entry =          11
  In of MODEL   21
    1    H    TRP 779           H        TRP 779  34.764  -8.754  -8.061
    2    HA   TRP 779           HA       TRP 779  34.335  -8.131 -10.860
    3    HB2  TRP 779           HB2      TRP 779  33.789 -10.618 -11.009
    4    HB3  TRP 779           HB3      TRP 779  35.436 -10.205 -10.551
    5    HD1  TRP 779           HD1      TRP 779  32.170 -11.540  -8.973
    6    HE1  TRP 779           HE1      TRP 779  32.789 -12.770  -6.805
    7    HE3  TRP 779           HE3      TRP 779  37.151 -10.514  -8.864
    8    HZ2  TRP 779           HZ2      TRP 779  35.133 -13.235  -5.246
    9    HZ3  TRP 779           HZ3      TRP 779  38.494 -11.390  -7.007
   10    HH2  TRP 779           HH2      TRP 779  37.477 -12.708  -5.242

  No H/Q in entry =          10
  In of MODEL   21
    1    H    GLY 780           H        GLY 780  32.545  -7.732  -8.194
    2    HA3  GLY 780           HA2      GLY 780  30.321  -7.226  -7.959
    3    HA2  GLY 780           HA3      GLY 780  30.105  -7.585  -9.665

  No H/Q in entry =           3
  In of MODEL   21
    1    H    LYS 781           H        LYS 781  28.427  -8.285  -7.420
    2    HA   LYS 781           HA       LYS 781  27.914 -11.002  -8.020
    3    HB2  LYS 781           HB2      LYS 781  29.067 -10.285  -5.385
    4    HB3  LYS 781           HB3      LYS 781  27.787 -11.485  -5.492
    5    HG2  LYS 781           HG2      LYS 781  29.280 -12.805  -7.034
    6    HG3  LYS 781           HG3      LYS 781  30.563 -11.641  -6.701
    7    HD2  LYS 781           HD2      LYS 781  30.776 -13.660  -5.286
    8    HD3  LYS 781           HD3      LYS 781  30.494 -12.212  -4.320
    9    HE2  LYS 781           HE2      LYS 781  28.145 -12.790  -4.065
   10    HE3  LYS 781           HE3      LYS 781  28.334 -14.172  -5.138
   11    HZ2  LYS 781           HZ1      LYS 781  28.277 -14.698  -2.736
   12    HZ1  LYS 781           HZ2      LYS 781  29.722 -13.875  -2.515
   13    HZ3  LYS 781           HZ3      LYS 781  29.676 -15.249  -3.477

  No H/Q in entry =          13
  In of MODEL   21
    1    H    CYS 782           H        CYS 782  26.018 -11.708  -6.801
    2    HA   CYS 782           HA       CYS 782  24.807  -9.671  -5.208
    3    HB2  CYS 782           HB2      CYS 782  23.369  -9.907  -7.223
    4    HB3  CYS 782           HB3      CYS 782  23.354 -11.659  -7.043

  No H/Q in entry =           4
  In of MODEL   21
    1    H    ASP 783           H        ASP 783  23.291 -11.455  -3.510
    2    HA   ASP 783           HA       ASP 783  24.556 -14.012  -3.332
    3    HB2  ASP 783           HB2      ASP 783  26.452 -12.526  -2.685
    4    HB3  ASP 783           HB3      ASP 783  25.485 -11.925  -1.350

  No H/Q in entry =           4
  In of MODEL   21
    1    H    ALA 784           H        ALA 784  23.522 -11.530  -1.106
    2    HA   ALA 784           HA       ALA 784  21.410 -13.295  -0.101
    3    HB1  ALA 784           HB1      ALA 784  23.041 -11.209   1.369
    4    HB3  ALA 784           HB2      ALA 784  23.235 -12.953   1.516
    5    HB2  ALA 784           HB3      ALA 784  21.750 -12.183   2.077

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLU 785           H        GLU 785  20.305 -11.104   1.482
    2    HA   GLU 785           HA       GLU 785  19.115  -9.567  -0.707
    3    HB2  GLU 785           HB2      GLU 785  18.101 -10.059   2.092
    4    HB3  GLU 785           HB3      GLU 785  17.238  -9.219   0.813
    5    HG2  GLU 785           HG2      GLU 785  17.286 -11.294  -0.529
    6    HG3  GLU 785           HG3      GLU 785  18.034 -12.107   0.838

  No H/Q in entry =           6
  In of MODEL   21
    1    H    SER 786           H        SER 786  18.007  -7.546   0.850
    2    HA   SER 786           HA       SER 786  18.326  -5.513   1.650
    3    HB2  SER 786           HB2      SER 786  20.950  -6.543   2.778
    4    HB3  SER 786           HB3      SER 786  20.147  -5.041   3.247
    5    HG   SER 786           HG       SER 786  18.331  -6.353   3.854

  No H/Q in entry =           5
  In of MODEL   21
    1    H    SER 787           H        SER 787  18.341  -4.435  -0.116
    2    HA   SER 787           HA       SER 787  18.907  -3.292  -1.875
    3    HB2  SER 787           HB2      SER 787  21.654  -3.266  -0.577
    4    HB3  SER 787           HB3      SER 787  21.250  -2.293  -2.004
    5    HG   SER 787           HG       SER 787  20.272  -2.220   0.613

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LYS 788           H        LYS 788  20.731  -3.439  -3.906
    2    HA   LYS 788           HA       LYS 788  20.788  -6.325  -4.383
    3    HB2  LYS 788           HB2      LYS 788  18.698  -5.360  -4.936
    4    HB3  LYS 788           HB3      LYS 788  19.478  -4.264  -6.059
    5    HG2  LYS 788           HG2      LYS 788  19.618  -7.280  -6.399
    6    HG3  LYS 788           HG3      LYS 788  18.290  -6.349  -7.082
    7    HD2  LYS 788           HD2      LYS 788  19.854  -5.101  -8.461
    8    HD3  LYS 788           HD3      LYS 788  21.214  -5.924  -7.700
    9    HE2  LYS 788           HE2      LYS 788  20.730  -6.893  -9.888
   10    HE3  LYS 788           HE3      LYS 788  20.431  -8.055  -8.602
   11    HZ3  LYS 788           HZ1      LYS 788  18.099  -7.686  -8.786
   12    HZ2  LYS 788           HZ2      LYS 788  18.699  -7.985 -10.338
   13    HZ1  LYS 788           HZ3      LYS 788  18.322  -6.419  -9.870

  No H/Q in entry =          13
  In of MODEL   21
    1    H    CYS 789           H        CYS 789  22.482  -6.980  -5.386
    2    HA   CYS 789           HA       CYS 789  24.238  -5.064  -6.705
    3    HB2  CYS 789           HB2      CYS 789  24.869  -6.177  -4.423
    4    HB3  CYS 789           HB3      CYS 789  25.192  -7.570  -5.441

  No H/Q in entry =           4
  In of MODEL   21
    1    H    VAL 790           H        VAL 790  25.937  -6.846  -7.959
    2    HA   VAL 790           HA       VAL 790  24.375  -8.539  -9.611
    3    HB   VAL 790           HB       VAL 790  23.628  -6.196 -10.251
    4   HG12  VAL 790          HG11      VAL 790  26.453  -5.967 -11.215
    5   HG11  VAL 790          HG12      VAL 790  25.716  -5.072  -9.906
    6   HG13  VAL 790          HG13      VAL 790  25.165  -4.805 -11.579
    7   HG21  VAL 790          HG21      VAL 790  23.390  -8.055 -11.798
    8   HG23  VAL 790          HG22      VAL 790  25.032  -7.787 -12.386
    9   HG22  VAL 790          HG23      VAL 790  23.780  -6.569 -12.678

  No H/Q in entry =           9
  In of MODEL   21
    1    H    CYS 791           H        CYS 791  25.858  -9.183 -11.510
    2    HA   CYS 791           HA       CYS 791  28.636  -9.317 -10.574
    3    HB2  CYS 791           HB2      CYS 791  27.449 -10.723 -12.950
    4    HB3  CYS 791           HB3      CYS 791  28.813 -11.171 -11.952

  No H/Q in entry =           4
  In of MODEL   21
    1    H    ARG 792           H        ARG 792  30.190  -8.316 -11.659
    2    HA   ARG 792           HA       ARG 792  29.501  -6.693 -13.978
    3    HB2  ARG 792           HB2      ARG 792  32.097  -6.988 -12.412
    4    HB3  ARG 792           HB3      ARG 792  31.779  -5.800 -13.665
    5    HG2  ARG 792           HG2      ARG 792  30.204  -4.657 -12.255
    6    HG3  ARG 792           HG3      ARG 792  30.311  -5.923 -11.031
    7    HD2  ARG 792           HD2      ARG 792  32.686  -5.397 -10.710
    8    HD3  ARG 792           HD3      ARG 792  32.569  -4.129 -11.925
    9    HE   ARG 792           HE       ARG 792  30.667  -3.443 -10.134
   10   HH11  ARG 792          HH11      ARG 792  34.062  -4.318  -9.652
   11   HH12  ARG 792          HH12      ARG 792  34.330  -3.161  -8.437
   12   HH21  ARG 792          HH21      ARG 792  31.027  -1.891  -8.445
   13   HH22  ARG 792          HH22      ARG 792  32.568  -1.801  -7.683

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLU 793           H        GLU 793  31.372  -6.988 -15.754
    2    HA   GLU 793           HA       GLU 793  32.110  -9.790 -15.656
    3    HB2  GLU 793           HB2      GLU 793  31.325  -8.269 -18.142
    4    HB3  GLU 793           HB3      GLU 793  31.898  -9.933 -18.088
    5    HG2  GLU 793           HG2      GLU 793  29.920 -10.348 -16.509
    6    HG3  GLU 793           HG3      GLU 793  29.306  -8.812 -17.107

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ALA 794           H        ALA 794  33.820 -10.038 -17.610
    2    HA   ALA 794           HA       ALA 794  36.168  -9.103 -16.441
    3    HB1  ALA 794           HB1      ALA 794  37.291 -10.059 -18.371
    4    HB2  ALA 794           HB2      ALA 794  35.758 -10.130 -19.240
    5    HB3  ALA 794           HB3      ALA 794  36.003 -11.127 -17.809

  No H/Q in entry =           5
  In of MODEL   21
    1    H    SER 795           H        SER 795  34.146  -7.799 -18.894
    2    HA   SER 795           HA       SER 795  35.885  -6.054 -20.082
    3    HB2  SER 795           HB2      SER 795  33.622  -4.954 -20.648
    4    HB3  SER 795           HB3      SER 795  33.987  -6.586 -21.231
    5    HG   SER 795           HG       SER 795  32.289  -5.754 -19.159

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLU 796           H        GLU 796  34.131  -5.803 -17.029
    2    HA   GLU 796           HA       GLU 796  34.707  -2.920 -16.865
    3    HB2  GLU 796           HB2      GLU 796  32.988  -4.668 -15.084
    4    HB3  GLU 796           HB3      GLU 796  33.279  -2.966 -14.817
    5    HG2  GLU 796           HG2      GLU 796  31.116  -3.182 -15.750
    6    HG3  GLU 796           HG3      GLU 796  32.149  -2.530 -17.015

  No H/Q in entry =           6
  In of MODEL   21
    1    H    CYS 797           H        CYS 797  36.562  -5.338 -16.469
    2    HA   CYS 797           HA       CYS 797  37.142  -5.040 -13.667
    3    HB2  CYS 797           HB2      CYS 797  38.207  -6.989 -15.668
    4    HB3  CYS 797           HB3      CYS 797  38.659  -6.950 -13.963

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLU 798           H        GLU 798  38.035  -3.105 -13.512
    2    HA   GLU 798           HA       GLU 798  40.695  -2.712 -14.704
    3    HB2  GLU 798           HB2      GLU 798  38.570  -0.812 -13.794
    4    HB3  GLU 798           HB3      GLU 798  40.240  -0.301 -13.651
    5    HG2  GLU 798           HG2      GLU 798  39.180   0.507 -15.715
    6    HG3  GLU 798           HG3      GLU 798  40.564  -0.529 -16.031

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU 799           H        GLU 799  39.558  -4.144 -12.255
    2    HA   GLU 799           HA       GLU 799  40.993  -2.950 -10.069
    3    HB2  GLU 799           HB2      GLU 799  38.859  -4.148  -9.745
    4    HB3  GLU 799           HB3      GLU 799  39.608  -5.629 -10.315
    5    HG2  GLU 799           HG2      GLU 799  39.421  -5.583  -7.896
    6    HG3  GLU 799           HG3      GLU 799  41.108  -5.620  -8.413

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLU 800           H        GLU 800  42.728  -4.071  -8.946
    2    HA   GLU 800           HA       GLU 800  44.664  -5.132 -10.803
    3    HB2  GLU 800           HB2      GLU 800  44.948  -4.471  -7.868
    4    HB3  GLU 800           HB3      GLU 800  46.251  -5.038  -8.891
    5    HG2  GLU 800           HG2      GLU 800  45.952  -2.992 -10.280
    6    HG3  GLU 800           HG3      GLU 800  44.781  -2.421  -9.087

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLY 801           H        GLY 801  43.249  -6.938 -10.997
    2    HA3  GLY 801           HA2      GLY 801  43.479  -8.992  -8.910
    3    HA2  GLY 801           HA3      GLY 801  42.549  -9.148 -10.395

  No H/Q in entry =           3
  In of MODEL   21
    1    H    PHE 802           H        PHE 802  44.316 -11.119  -9.293
    2    HA   PHE 802           HA       PHE 802  46.771 -11.133 -10.801
    3    HB2  PHE 802           HB2      PHE 802  45.385 -13.094  -8.994
    4    HB3  PHE 802           HB3      PHE 802  46.882 -13.490  -9.799
    5    HD1  PHE 802           HD1      PHE 802  47.716 -13.999  -7.619
    6    HD2  PHE 802           HD2      PHE 802  46.552 -10.044  -8.626
    7    HE1  PHE 802           HE1      PHE 802  48.918 -13.207  -5.771
    8    HE2  PHE 802           HE2      PHE 802  47.775  -9.200  -6.726
    9    HZ   PHE 802           HZ       PHE 802  48.994 -10.757  -5.245

  No H/Q in entry =           9
  In of MODEL   21
    1    H    SER 803           H        SER 803  47.031 -13.675 -11.563
    2    HA   SER 803           HA       SER 803  44.857 -14.222 -13.388
    3    HB2  SER 803           HB2      SER 803  47.836 -14.473 -13.878
    4    HB3  SER 803           HB3      SER 803  46.588 -15.086 -14.962
    5    HG   SER 803           HG       SER 803  46.357 -13.184 -15.727

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ILE 804           H        ILE 804  44.206 -16.320 -13.373
    2    HA   ILE 804           HA       ILE 804  45.664 -18.196 -11.671
    3    HB   ILE 804           HB       ILE 804  43.677 -18.932 -10.502
    4   HG12  ILE 804          HG12      ILE 804  41.916 -18.490 -12.197
    5   HG13  ILE 804          HG13      ILE 804  41.487 -17.847 -10.621
    6   HG23  ILE 804          HG21      ILE 804  43.171 -16.988  -9.086
    7   HG22  ILE 804          HG22      ILE 804  43.956 -15.946 -10.266
    8   HG21  ILE 804          HG23      ILE 804  44.894 -17.174  -9.414
    9   HD12  ILE 804          HD11      ILE 804  42.451 -16.268 -12.993
   10   HD11  ILE 804          HD12      ILE 804  42.103 -15.603 -11.400
   11   HD13  ILE 804          HD13      ILE 804  40.811 -16.338 -12.353

  No H/Q in entry =          11
  In of MODEL   21
    1    H    CYS 805           H        CYS 805  44.501 -20.438 -11.831
    2    HA   CYS 805           HA       CYS 805  44.080 -20.969 -14.701
    3    HB2  CYS 805           HB2      CYS 805  46.110 -21.952 -13.613
    4    HB3  CYS 805           HB3      CYS 805  45.049 -22.767 -12.471

  No H/Q in entry =           4
  In of MODEL   21
    1    H    VAL 806           H        VAL 806  42.088 -21.605 -15.231
    2    HA   VAL 806           HA       VAL 806  40.349 -22.625 -13.096
    3    HB   VAL 806           HB       VAL 806  39.469 -20.871 -15.371
    4   HG13  VAL 806          HG11      VAL 806  37.711 -22.172 -14.446
    5   HG12  VAL 806          HG12      VAL 806  37.491 -20.478 -13.984
    6   HG11  VAL 806          HG13      VAL 806  38.113 -21.645 -12.819
    7   HG21  VAL 806          HG21      VAL 806  40.994 -19.547 -14.070
    8   HG23  VAL 806          HG22      VAL 806  40.124 -19.941 -12.580
    9   HG22  VAL 806          HG23      VAL 806  39.348 -18.978 -13.844

  No H/Q in entry =           9
  In of MODEL   21
    1    H    GLU 807           H        GLU 807  39.455 -24.515 -13.607
    2    HA   GLU 807           HA       GLU 807  39.698 -25.645 -16.258
    3    HB2  GLU 807           HB2      GLU 807  40.072 -27.055 -14.273
    4    HB3  GLU 807           HB3      GLU 807  38.428 -26.740 -13.744
    5    HG2  GLU 807           HG2      GLU 807  37.616 -27.800 -15.832
    6    HG3  GLU 807           HG3      GLU 807  39.283 -28.219 -16.212

  No H/Q in entry =           6
  In of MODEL   21
    1    H    VAL 808           H        VAL 808  38.308 -25.208 -17.685
    2    HA   VAL 808           HA       VAL 808  35.463 -24.899 -17.064
    3    HB   VAL 808           HB       VAL 808  37.088 -23.186 -18.909
    4   HG13  VAL 808          HG11      VAL 808  35.159 -21.818 -19.189
    5   HG12  VAL 808          HG12      VAL 808  34.214 -22.934 -18.173
    6   HG11  VAL 808          HG13      VAL 808  34.899 -23.486 -19.719
    7   HG23  VAL 808          HG21      VAL 808  36.592 -21.317 -17.399
    8   HG22  VAL 808          HG22      VAL 808  37.673 -22.546 -16.743
    9   HG21  VAL 808          HG23      VAL 808  35.985 -22.499 -16.239

  No H/Q in entry =           9
  In of MODEL   21
    1    H    ASN 809           H        ASN 809  34.299 -26.068 -18.531
    2    HA   ASN 809           HA       ASN 809  33.746 -27.397 -20.282
    3    HB2  ASN 809           HB2      ASN 809  36.074 -25.984 -21.578
    4    HB3  ASN 809           HB3      ASN 809  35.200 -27.241 -22.413
    5   HD21  ASN 809          HD21      ASN 809  35.276 -23.973 -21.451
    6   HD22  ASN 809          HD22      ASN 809  33.788 -23.483 -22.172

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLY 810           H        GLY 810  35.908 -27.980 -18.224
    2    HA3  GLY 810           HA2      GLY 810  36.838 -30.036 -17.651
    3    HA2  GLY 810           HA3      GLY 810  36.667 -30.557 -19.322

  No H/Q in entry =           3
  In of MODEL   21
    1    H    LYS 811           H        LYS 811  37.939 -27.609 -19.625
    2    HA   LYS 811           HA       LYS 811  40.692 -28.659 -19.661
    3    HB2  LYS 811           HB2      LYS 811  39.409 -26.532 -21.375
    4    HB3  LYS 811           HB3      LYS 811  41.081 -27.064 -21.469
    5    HG2  LYS 811           HG2      LYS 811  40.379 -29.273 -22.152
    6    HG3  LYS 811           HG3      LYS 811  38.688 -28.814 -21.973
    7    HD2  LYS 811           HD2      LYS 811  39.377 -28.749 -24.320
    8    HD3  LYS 811           HD3      LYS 811  38.950 -27.142 -23.731
    9    HE2  LYS 811           HE2      LYS 811  41.286 -26.584 -23.456
   10    HE3  LYS 811           HE3      LYS 811  41.766 -28.209 -23.936
   11    HZ2  LYS 811           HZ1      LYS 811  42.003 -26.628 -25.711
   12    HZ1  LYS 811           HZ2      LYS 811  40.349 -26.245 -25.657
   13    HZ3  LYS 811           HZ3      LYS 811  40.855 -27.780 -26.121

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLU 812           H        GLU 812  42.352 -27.203 -19.006
    2    HA   GLU 812           HA       GLU 812  41.337 -25.167 -17.165
    3    HB2  GLU 812           HB2      GLU 812  44.090 -26.363 -17.370
    4    HB3  GLU 812           HB3      GLU 812  43.555 -25.208 -16.160
    5    HG2  GLU 812           HG2      GLU 812  41.920 -26.815 -15.345
    6    HG3  GLU 812           HG3      GLU 812  42.478 -27.986 -16.534

  No H/Q in entry =           6
  In of MODEL   21
    1    H    GLN 813           H        GLN 813  41.328 -23.173 -17.725
    2    HA   GLN 813           HA       GLN 813  43.364 -22.219 -19.609
    3    HB2  GLN 813           HB2      GLN 813  41.229 -22.292 -20.641
    4    HB3  GLN 813           HB3      GLN 813  40.463 -21.461 -19.291
    5    HG2  GLN 813           HG2      GLN 813  41.809 -19.469 -19.840
    6    HG3  GLN 813           HG3      GLN 813  42.449 -20.300 -21.256
    7   HE21  GLN 813          HE21      GLN 813  39.833 -21.662 -21.618
    8   HE22  GLN 813          HE22      GLN 813  38.786 -20.510 -22.321

  No H/Q in entry =           8
  In of MODEL   21
    1    H    THR 814           H        THR 814  44.321 -20.297 -19.087
    2    HA   THR 814           HA       THR 814  44.117 -19.416 -16.355
    3    HB   THR 814           HB       THR 814  45.865 -18.608 -18.659
    4    HG1  THR 814           HG1      THR 814  47.336 -19.971 -17.711
    5   HG22  THR 814          HG21      THR 814  47.323 -17.582 -16.936
    6   HG21  THR 814          HG22      THR 814  46.126 -17.981 -15.702
    7   HG23  THR 814          HG23      THR 814  45.733 -16.818 -16.967

  No H/Q in entry =           7
  In of MODEL   21
    1    H    MET 815           H        MET 815  43.036 -17.662 -15.745
    2    HA   MET 815           HA       MET 815  42.215 -15.690 -17.788
    3    HB2  MET 815           HB2      MET 815  40.470 -16.387 -15.436
    4    HB3  MET 815           HB3      MET 815  40.038 -15.499 -16.887
    5    HG2  MET 815           HG2      MET 815  40.458 -17.733 -18.105
    6    HG3  MET 815           HG3      MET 815  40.432 -18.380 -16.467
    7    HE1  MET 815           HE1      MET 815  38.633 -19.272 -18.852
    8    HE3  MET 815           HE2      MET 815  37.111 -19.540 -17.999
    9    HE2  MET 815           HE3      MET 815  38.656 -20.021 -17.257

  No H/Q in entry =           9
  In of MODEL   21
    1    H    SER 816           H        SER 816  41.485 -13.693 -16.617
    2    HA   SER 816           HA       SER 816  43.374 -13.174 -14.521
    3    HB2  SER 816           HB2      SER 816  42.455 -10.812 -14.706
    4    HB3  SER 816           HB3      SER 816  43.215 -11.454 -16.179
    5    HG   SER 816           HG       SER 816  41.110 -11.880 -16.944

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLU 817           H        GLU 817  42.724 -12.253 -12.513
    2    HA   GLU 817           HA       GLU 817  41.197 -13.747 -10.864
    3    HB2  GLU 817           HB2      GLU 817  42.782 -11.821 -10.429
    4    HB3  GLU 817           HB3      GLU 817  41.363 -10.799 -10.592
    5    HG2  GLU 817           HG2      GLU 817  41.161 -11.088  -8.397
    6    HG3  GLU 817           HG3      GLU 817  40.508 -12.671  -8.853

  No H/Q in entry =           6
  In of MODEL   21
    1    H    CYS 818           H        CYS 818  40.199 -10.569 -12.026
    2    HA   CYS 818           HA       CYS 818  37.594 -10.660 -10.951
    3    HB2  CYS 818           HB2      CYS 818  38.837  -8.562 -11.457
    4    HB3  CYS 818           HB3      CYS 818  38.674  -8.975 -13.170

  No H/Q in entry =           4
  In of MODEL   21
    1    H    GLU 819           H        GLU 819  38.972 -11.465 -14.034
    2    HA   GLU 819           HA       GLU 819  36.656 -11.674 -15.571
    3    HB2  GLU 819           HB2      GLU 819  38.918 -11.526 -16.415
    4    HB3  GLU 819           HB3      GLU 819  39.307 -13.046 -15.653
    5    HG2  GLU 819           HG2      GLU 819  38.098 -14.248 -17.198
    6    HG3  GLU 819           HG3      GLU 819  37.310 -12.791 -17.856

  No H/Q in entry =           6
  In of MODEL   21
    1    H    ALA 820           H        ALA 820  38.631 -14.314 -14.170
    2    HA   ALA 820           HA       ALA 820  36.860 -16.353 -14.556
    3    HB1  ALA 820           HB1      ALA 820  39.153 -16.698 -13.867
    4    HB2  ALA 820           HB2      ALA 820  38.050 -17.546 -12.776
    5    HB3  ALA 820           HB3      ALA 820  38.785 -16.024 -12.277

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLY 821           H        GLY 821  37.145 -14.098 -11.839
    2    HA3  GLY 821           HA2      GLY 821  35.261 -15.232 -10.078
    3    HA2  GLY 821           HA3      GLY 821  35.803 -13.560 -10.075

  No H/Q in entry =           3
  In of MODEL   21
    1    H    ALA 822           H        ALA 822  34.921 -12.867 -12.662
    2    HA   ALA 822           HA       ALA 822  32.252 -12.243 -12.094
    3    HB2  ALA 822           HB1      ALA 822  33.633 -12.005 -14.773
    4    HB1  ALA 822           HB2      ALA 822  33.830 -10.869 -13.451
    5    HB3  ALA 822           HB3      ALA 822  32.229 -11.101 -14.169

  No H/Q in entry =           5
  In of MODEL   21
    1    H    LEU 823           H        LEU 823  33.748 -14.675 -14.179
    2    HA   LEU 823           HA       LEU 823  31.306 -15.686 -15.206
    3    HB2  LEU 823           HB2      LEU 823  33.954 -17.110 -14.801
    4    HB3  LEU 823           HB3      LEU 823  32.564 -17.936 -15.449
    5    HG   LEU 823           HG       LEU 823  33.824 -17.468 -17.311
    6   HD12  LEU 823          HD11      LEU 823  31.947 -15.160 -17.192
    7   HD11  LEU 823          HD12      LEU 823  31.571 -16.805 -17.704
    8   HD13  LEU 823          HD13      LEU 823  32.688 -15.818 -18.649
    9   HD21  LEU 823          HD21      LEU 823  34.380 -14.684 -16.302
   10   HD23  LEU 823          HD22      LEU 823  34.916 -15.333 -17.848
   11   HD22  LEU 823          HD23      LEU 823  35.521 -16.019 -16.351

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ARG 824           H        ARG 824  33.077 -16.373 -12.245
    2    HA   ARG 824           HA       ARG 824  31.475 -18.441 -11.196
    3    HB2  ARG 824           HB2      ARG 824  33.165 -16.329  -9.846
    4    HB3  ARG 824           HB3      ARG 824  32.266 -17.528  -8.936
    5    HG2  ARG 824           HG2      ARG 824  33.577 -19.304  -9.897
    6    HG3  ARG 824           HG3      ARG 824  34.386 -18.169 -10.979
    7    HD2  ARG 824           HD2      ARG 824  35.748 -18.837  -8.990
    8    HD3  ARG 824           HD3      ARG 824  35.502 -17.102  -9.141
    9    HE   ARG 824           HE       ARG 824  33.496 -17.890  -7.511
   10   HH11  ARG 824          HH11      ARG 824  36.976 -18.532  -7.314
   11   HH12  ARG 824          HH12      ARG 824  37.078 -18.366  -5.614
   12   HH21  ARG 824          HH21      ARG 824  33.626 -17.629  -5.160
   13   HH22  ARG 824          HH22      ARG 824  35.094 -17.836  -4.357

  No H/Q in entry =          13
  In of MODEL   21
    1    H    CYS 825           H        CYS 825  30.852 -15.068 -11.490
    2    HA   CYS 825           HA       CYS 825  28.731 -15.241  -9.533
    3    HB2  CYS 825           HB2      CYS 825  30.205 -13.185  -9.743
    4    HB3  CYS 825           HB3      CYS 825  29.407 -12.900 -11.281

  No H/Q in entry =           4
  In of MODEL   21
    1    H    ARG 826           H        ARG 826  29.086 -14.704 -13.049
    2    HA   ARG 826           HA       ARG 826  26.326 -14.351 -13.409
    3    HB2  ARG 826           HB2      ARG 826  26.763 -14.615 -15.875
    4    HB3  ARG 826           HB3      ARG 826  27.684 -13.367 -15.049
    5    HG2  ARG 826           HG2      ARG 826  29.637 -14.632 -15.147
    6    HG3  ARG 826           HG3      ARG 826  28.781 -16.072 -15.715
    7    HD2  ARG 826           HD2      ARG 826  28.844 -13.456 -17.223
    8    HD3  ARG 826           HD3      ARG 826  29.989 -14.766 -17.509
    9    HE   ARG 826           HE       ARG 826  27.661 -16.018 -17.739
   10   HH11  ARG 826          HH11      ARG 826  28.526 -12.874 -19.194
   11   HH12  ARG 826          HH12      ARG 826  27.794 -13.239 -20.678
   12   HH21  ARG 826          HH21      ARG 826  26.658 -16.477 -19.798
   13   HH22  ARG 826          HH22      ARG 826  26.702 -15.315 -21.035

  No H/Q in entry =          13
  In of MODEL   21
    1    H    GLY 827           H        GLY 827  28.187 -17.281 -13.343
    2    HA3  GLY 827           HA2      GLY 827  26.737 -19.179 -12.635
    3    HA2  GLY 827           HA3      GLY 827  25.634 -18.664 -13.900

  No H/Q in entry =           3
  In of MODEL   21
    1    H    GLN 828           H        GLN 828  28.469 -18.138 -15.218
    2    HA   GLN 828           HA       GLN 828  28.452 -20.341 -16.955
    3    HB2  GLN 828           HB2      GLN 828  29.512 -18.157 -17.477
    4    HB3  GLN 828           HB3      GLN 828  30.732 -18.472 -16.256
    5    HG2  GLN 828           HG2      GLN 828  31.638 -18.930 -18.449
    6    HG3  GLN 828           HG3      GLN 828  31.467 -20.429 -17.527
    7   HE21  GLN 828          HE21      GLN 828  30.216 -18.577 -20.220
    8   HE22  GLN 828          HE22      GLN 828  29.289 -19.849 -20.896

  No H/Q in entry =           8
  In of MODEL   21
    1    H    SER 829           H        SER 829  29.446 -22.301 -16.779
    2    HA   SER 829           HA       SER 829  30.304 -22.953 -14.128
    3    HB2  SER 829           HB2      SER 829  29.947 -24.719 -16.556
    4    HB3  SER 829           HB3      SER 829  30.253 -25.289 -14.913
    5    HG   SER 829           HG       SER 829  28.238 -23.660 -14.670

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ILE 830           H        ILE 830  32.249 -22.546 -13.532
    2    HA   ILE 830           HA       ILE 830  34.598 -23.328 -15.127
    3    HB   ILE 830           HB       ILE 830  35.739 -21.276 -14.707
    4   HG12  ILE 830          HG12      ILE 830  34.931 -20.780 -12.410
    5   HG13  ILE 830          HG13      ILE 830  34.938 -19.356 -13.430
    6   HG23  ILE 830          HG21      ILE 830  34.376 -21.087 -16.630
    7   HG22  ILE 830          HG22      ILE 830  34.447 -19.518 -15.824
    8   HG21  ILE 830          HG23      ILE 830  33.005 -20.526 -15.673
    9   HD12  ILE 830          HD11      ILE 830  32.538 -20.981 -12.631
   10   HD11  ILE 830          HD12      ILE 830  32.514 -19.584 -13.707
   11   HD13  ILE 830          HD13      ILE 830  33.004 -19.391 -12.021

  No H/Q in entry =          11
  In of MODEL   21
    1    H    SER 831           H        SER 831  36.315 -23.912 -13.695
    2    HA   SER 831           HA       SER 831  35.640 -23.958 -10.844
    3    HB2  SER 831           HB2      SER 831  36.918 -26.059 -12.559
    4    HB3  SER 831           HB3      SER 831  36.708 -26.130 -10.813
    5    HG   SER 831           HG       SER 831  34.365 -25.582 -11.762

  No H/Q in entry =           5
  In of MODEL   21
    1    H    VAL 832           H        VAL 832  37.155 -22.482 -10.005
    2    HA   VAL 832           HA       VAL 832  39.722 -22.229 -11.201
    3    HB   VAL 832           HB       VAL 832  38.914 -20.286 -10.040
    4   HG11  VAL 832          HG11      VAL 832  38.885 -21.915  -7.502
    5   HG13  VAL 832          HG12      VAL 832  37.479 -21.291  -8.366
    6   HG12  VAL 832          HG13      VAL 832  38.606 -20.177  -7.595
    7   HG22  VAL 832          HG21      VAL 832  40.794 -19.727  -8.551
    8   HG21  VAL 832          HG22      VAL 832  41.332 -20.532 -10.028
    9   HG23  VAL 832          HG23      VAL 832  41.250 -21.430  -8.514

  No H/Q in entry =           9
  In of MODEL   21
    1    H    THR 833           H        THR 833  41.093 -23.789 -11.289
    2    HA   THR 833           HA       THR 833  41.089 -25.825  -9.264
    3    HB   THR 833           HB       THR 833  42.797 -26.867 -10.852
    4    HG1  THR 833           HG1      THR 833  42.959 -25.955 -12.863
    5   HG23  THR 833          HG21      THR 833  40.460 -27.525 -10.760
    6   HG22  THR 833          HG22      THR 833  41.039 -27.519 -12.431
    7   HG21  THR 833          HG23      THR 833  40.033 -26.196 -11.836

  No H/Q in entry =           7
  In of MODEL   21
    1    H    SER 834           H        SER 834  43.133 -23.238 -10.295
    2    HA   SER 834           HA       SER 834  44.747 -23.586  -7.919
    3    HB2  SER 834           HB2      SER 834  45.973 -23.649 -10.690
    4    HB3  SER 834           HB3      SER 834  46.880 -23.463  -9.192
    5    HG   SER 834           HG       SER 834  45.168 -25.598  -9.185

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ILE 835           H        ILE 835  45.662 -21.640  -7.241
    2    HA   ILE 835           HA       ILE 835  44.649 -19.406  -8.733
    3    HB   ILE 835           HB       ILE 835  44.838 -18.042  -6.909
    4   HG12  ILE 835          HG12      ILE 835  47.277 -18.381  -6.407
    5   HG13  ILE 835          HG13      ILE 835  46.286 -18.249  -4.968
    6   HG21  ILE 835          HG21      ILE 835  43.243 -19.740  -6.461
    7   HG23  ILE 835          HG22      ILE 835  44.025 -19.272  -4.944
    8   HG22  ILE 835          HG23      ILE 835  44.476 -20.777  -5.740
    9   HD11  ILE 835          HD11      ILE 835  46.312 -20.598  -4.762
   10   HD13  ILE 835          HD12      ILE 835  47.928 -19.854  -4.693
   11   HD12  ILE 835          HD13      ILE 835  47.400 -20.735  -6.164

  No H/Q in entry =          11
  In of MODEL   21
    1    H    ARG 836           H        ARG 836  46.990 -21.179  -9.259
    2    HA   ARG 836           HA       ARG 836  49.112 -19.263  -9.854
    3    HB2  ARG 836           HB2      ARG 836  48.901 -22.280 -10.081
    4    HB3  ARG 836           HB3      ARG 836  50.259 -21.370 -10.690
    5    HG2  ARG 836           HG2      ARG 836  49.420 -21.571  -7.802
    6    HG3  ARG 836           HG3      ARG 836  50.745 -22.456  -8.556
    7    HD2  ARG 836           HD2      ARG 836  50.521 -19.485  -8.108
    8    HD3  ARG 836           HD3      ARG 836  51.684 -20.606  -7.402
    9    HE   ARG 836           HE       ARG 836  51.842 -20.563 -10.253
   10   HH11  ARG 836          HH11      ARG 836  53.035 -18.946  -7.337
   11   HH12  ARG 836          HH12      ARG 836  54.303 -18.145  -8.141
   12   HH21  ARG 836          HH21      ARG 836  53.514 -19.478 -11.345
   13   HH22  ARG 836          HH22      ARG 836  54.580 -18.440 -10.515

  No H/Q in entry =          13
  In of MODEL   21
    1    HA   PRO 837           HA       PRO 837  47.226 -19.191 -13.929
    2    HB2  PRO 837           HB2      PRO 837  49.348 -18.088 -15.277
    3    HB3  PRO 837           HB3      PRO 837  48.201 -17.135 -14.331
    4    HG2  PRO 837           HG2      PRO 837  50.938 -18.074 -13.609
    5    HG3  PRO 837           HG3      PRO 837  50.152 -16.531 -13.247
    6    HD2  PRO 837           HD2      PRO 837  50.398 -18.524 -11.430
    7    HD3  PRO 837           HD3      PRO 837  49.039 -17.382 -11.422

  No H/Q in entry =           7
  In of MODEL   21
    1    H    CYS 838           H        CYS 838  47.236 -20.708 -15.567
    2    HA   CYS 838           HA       CYS 838  49.343 -22.645 -15.417
    3    HB2  CYS 838           HB2      CYS 838  46.605 -22.704 -16.653
    4    HB3  CYS 838           HB3      CYS 838  47.808 -23.893 -17.129

  No H/Q in entry =           4
  In of MODEL   21
    1    H    ALA 839           H        ALA 839  50.135 -23.521 -17.617
    2    HA   ALA 839           HA       ALA 839  50.731 -21.347 -19.414
    3    HB3  ALA 839           HB1      ALA 839  52.114 -23.013 -20.602
    4    HB1  ALA 839           HB2      ALA 839  51.460 -24.285 -19.572
    5    HB2  ALA 839           HB3      ALA 839  52.467 -23.017 -18.872

  No H/Q in entry =           5
  In of MODEL   21
    1    H    ALA 840           H        ALA 840  48.281 -21.344 -19.493
    2    HA   ALA 840           HA       ALA 840  47.479 -22.417 -22.069
    3    HB3  ALA 840           HB1      ALA 840  46.661 -24.096 -20.511
    4    HB1  ALA 840           HB2      ALA 840  45.308 -23.201 -21.218
    5    HB2  ALA 840           HB3      ALA 840  45.838 -22.848 -19.577

  No H/Q in entry =           5
  In of MODEL   21
    1    H    GLU 841           H        GLU 841  47.728 -20.315 -22.659
    2    HA   GLU 841           HA       GLU 841  45.734 -18.431 -21.648
    3    HB2  GLU 841           HB2      GLU 841  48.309 -17.966 -23.181
    4    HB3  GLU 841           HB3      GLU 841  47.164 -16.702 -22.734
    5    HG2  GLU 841           HG2      GLU 841  47.557 -17.132 -20.381
    6    HG3  GLU 841           HG3      GLU 841  48.631 -18.468 -20.779

  No H/Q in entry =           6
  In of MODEL   21
    1    H    THR 842           H        THR 842  46.221 -20.643 -23.948
    2    HA   THR 842           HA       THR 842  44.943 -19.236 -26.134
    3    HB   THR 842           HB       THR 842  46.823 -20.812 -26.637
    4    HG1  THR 842           HG1      THR 842  44.404 -21.917 -27.651
    5   HG23  THR 842          HG21      THR 842  46.519 -23.238 -26.415
    6   HG22  THR 842          HG22      THR 842  44.948 -22.981 -25.665
    7   HG21  THR 842          HG23      THR 842  46.409 -22.460 -24.833

  No H/Q in entry =           7
  In of MODEL   21
    1    H    GLN 843           H        GLN 843  42.880 -19.864 -26.914
    2    HA   GLN 843           HA       GLN 843  41.450 -21.772 -25.311
    3    HB2  GLN 843           HB2      GLN 843  39.385 -20.330 -25.446
    4    HB3  GLN 843           HB3      GLN 843  40.625 -19.747 -24.355
    5    HG2  GLN 843           HG2      GLN 843  41.275 -18.051 -25.961
    6    HG3  GLN 843           HG3      GLN 843  40.129 -18.697 -27.134
    7   HE21  GLN 843          HE21      GLN 843  38.036 -19.185 -25.165
    8   HE22  GLN 843          HE22      GLN 843  37.391 -17.657 -24.751

  No H/Q in entry =           8
  In of MODEL   22
    1    H1   GLY 689           H2       GLY 689  52.107  16.190 -27.117
    2    H2   GLY 689           H1       GLY 689  50.846  15.073 -27.102
    3    H3   GLY 689           H3       GLY 689  50.513  16.727 -26.948
    4    HA2  GLY 689           HA2      GLY 689  50.352  15.617 -24.824
    5    HA3  GLY 689           HA3      GLY 689  51.642  16.813 -24.841

  No H/Q in entry =           5
  In of MODEL   22
    1    H    SER 690           H        SER 690  53.838  15.938 -25.432
    2    HA   SER 690           HA       SER 690  54.288  13.137 -25.276
    3    HB2  SER 690           HB2      SER 690  55.707  14.689 -26.618
    4    HB3  SER 690           HB3      SER 690  56.260  15.441 -25.127
    5    HG   SER 690           HG       SER 690  56.793  12.857 -26.132

  No H/Q in entry =           5
  In of MODEL   22
    1    H    HIS 691           H        HIS 691  54.504  11.952 -23.524
    2    HA   HIS 691           HA       HIS 691  54.568  11.271 -21.450
    3    HB2  HIS 691           HB2      HIS 691  56.443  13.601 -21.098
    4    HB3  HIS 691           HB3      HIS 691  56.027  12.535 -19.758
    5    HD1  HIS 691           HD1      HIS 691  58.436  12.905 -22.405
    6    HD2  HIS 691           HD2      HIS 691  56.650   9.729 -20.424
    7    HE1  HIS 691           HE1      HIS 691  59.893  10.914 -22.861
    8    HE2  HIS 691           HE2      HIS 691  58.535   9.002 -21.989

  No H/Q in entry =           8
  In of MODEL   22
    1    H    MET 692           H        MET 692  52.395  11.550 -21.326
    2    HA   MET 692           HA       MET 692  51.415  13.772 -19.707
    3    HB2  MET 692           HB2      MET 692  49.995  11.311 -20.764
    4    HB3  MET 692           HB3      MET 692  49.213  12.610 -19.884
    5    HG2  MET 692           HG2      MET 692  49.850  14.163 -21.703
    6    HG3  MET 692           HG3      MET 692  50.514  12.793 -22.589
    7    HE1  MET 692           HE1      MET 692  49.044  10.728 -23.438
    8    HE3  MET 692           HE2      MET 692  47.300  10.630 -23.241
    9    HE2  MET 692           HE3      MET 692  48.350  10.485 -21.833

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ASN 693           H        ASN 693  52.426  10.537 -19.549
    2    HA   ASN 693           HA       ASN 693  51.990  10.492 -16.661
    3    HB2  ASN 693           HB2      ASN 693  52.037   8.214 -18.651
    4    HB3  ASN 693           HB3      ASN 693  52.103   7.981 -16.913
    5   HD21  ASN 693          HD21      ASN 693  50.245   8.282 -15.702
    6   HD22  ASN 693          HD22      ASN 693  48.697   8.465 -16.427

  No H/Q in entry =           6
  In of MODEL   22
    1    HA   PRO 694           HA       PRO 694  56.431  10.340 -16.609
    2    HB2  PRO 694           HB2      PRO 694  56.770   9.281 -14.116
    3    HB3  PRO 694           HB3      PRO 694  56.356  10.975 -14.400
    4    HG2  PRO 694           HG2      PRO 694  54.580   8.698 -13.639
    5    HG3  PRO 694           HG3      PRO 694  54.590  10.369 -13.047
    6    HD2  PRO 694           HD2      PRO 694  52.814   9.494 -14.881
    7    HD3  PRO 694           HD3      PRO 694  53.433  11.158 -14.866

  No H/Q in entry =           7
  In of MODEL   22
    1    H    LEU 695           H        LEU 695  54.406   7.614 -15.918
    2    HA   LEU 695           HA       LEU 695  56.553   5.801 -16.735
    3    HB2  LEU 695           HB2      LEU 695  55.567   5.461 -14.457
    4    HB3  LEU 695           HB3      LEU 695  54.011   5.210 -15.212
    5    HG   LEU 695           HG       LEU 695  54.978   3.228 -16.388
    6   HD12  LEU 695          HD11      LEU 695  57.050   2.270 -15.514
    7   HD11  LEU 695          HD12      LEU 695  57.303   3.714 -14.528
    8   HD13  LEU 695          HD13      LEU 695  57.329   3.828 -16.288
    9   HD23  LEU 695          HD21      LEU 695  55.066   3.180 -13.373
   10   HD22  LEU 695          HD22      LEU 695  54.870   1.782 -14.435
   11   HD21  LEU 695          HD23      LEU 695  53.623   3.019 -14.371

  No H/Q in entry =          11
  In of MODEL   22
    1    H    THR 696           H        THR 696  56.306   5.368 -18.833
    2    HA   THR 696           HA       THR 696  53.708   4.509 -19.840
    3    HB   THR 696           HB       THR 696  55.199   6.754 -21.267
    4    HG1  THR 696           HG1      THR 696  53.473   6.822 -19.243
    5   HG23  THR 696          HG21      THR 696  53.199   6.843 -22.705
    6   HG22  THR 696          HG22      THR 696  52.500   5.491 -21.812
    7   HG21  THR 696          HG23      THR 696  53.957   5.250 -22.773

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLN 697           H        GLN 697  57.081   5.207 -20.527
    2    HA   GLN 697           HA       GLN 697  57.290   3.345 -22.671
    3    HB2  GLN 697           HB2      GLN 697  59.802   3.894 -22.355
    4    HB3  GLN 697           HB3      GLN 697  58.723   5.111 -23.007
    5    HG2  GLN 697           HG2      GLN 697  60.399   5.924 -21.305
    6    HG3  GLN 697           HG3      GLN 697  58.719   6.330 -20.980
    7   HE21  GLN 697          HE21      GLN 697  61.355   4.228 -20.102
    8   HE22  GLN 697          HE22      GLN 697  60.723   3.816 -18.554

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ALA 698           H        ALA 698  56.953   2.716 -19.539
    2    HA   ALA 698           HA       ALA 698  58.094   0.119 -19.840
    3    HB1  ALA 698           HB1      ALA 698  60.023   1.369 -18.981
    4    HB2  ALA 698           HB2      ALA 698  59.418   0.234 -17.775
    5    HB3  ALA 698           HB3      ALA 698  59.050   1.952 -17.631

  No H/Q in entry =           5
  In of MODEL   22
    1    H    VAL 699           H        VAL 699  57.353  -1.269 -18.226
    2    HA   VAL 699           HA       VAL 699  55.359  -0.313 -16.340
    3    HB   VAL 699           HB       VAL 699  55.116  -2.846 -18.053
    4   HG12  VAL 699          HG11      VAL 699  53.210  -1.710 -16.008
    5   HG11  VAL 699          HG12      VAL 699  54.218  -3.142 -15.809
    6   HG13  VAL 699          HG13      VAL 699  52.920  -3.136 -17.006
    7   HG23  VAL 699          HG21      VAL 699  53.424  -0.345 -18.153
    8   HG22  VAL 699          HG22      VAL 699  53.121  -1.826 -19.062
    9   HG21  VAL 699          HG23      VAL 699  54.567  -0.872 -19.388

  No H/Q in entry =           9
  In of MODEL   22
    1    HA   PRO 700           HA       PRO 700  58.486  -2.373 -13.900
    2    HB2  PRO 700           HB2      PRO 700  56.317  -3.078 -12.067
    3    HB3  PRO 700           HB3      PRO 700  57.815  -2.216 -11.731
    4    HG2  PRO 700           HG2      PRO 700  55.481  -0.886 -11.825
    5    HG3  PRO 700           HG3      PRO 700  56.989  -0.168 -12.411
    6    HD2  PRO 700           HD2      PRO 700  54.698  -1.273 -13.974
    7    HD3  PRO 700           HD3      PRO 700  55.807   0.061 -14.351

  No H/Q in entry =           7
  In of MODEL   22
    1    H    LYS 701           H        LYS 701  59.279  -4.222 -14.209
    2    HA   LYS 701           HA       LYS 701  57.508  -6.392 -14.884
    3    HB2  LYS 701           HB2      LYS 701  60.532  -6.305 -15.116
    4    HB3  LYS 701           HB3      LYS 701  59.540  -7.687 -15.553
    5    HG2  LYS 701           HG2      LYS 701  59.887  -6.680 -17.620
    6    HG3  LYS 701           HG3      LYS 701  58.343  -5.985 -17.113
    7    HD2  LYS 701           HD2      LYS 701  59.552  -4.019 -16.253
    8    HD3  LYS 701           HD3      LYS 701  61.049  -4.684 -16.904
    9    HE2  LYS 701           HE2      LYS 701  58.590  -3.884 -18.470
   10    HE3  LYS 701           HE3      LYS 701  60.123  -3.030 -18.420
   11    HZ2  LYS 701           HZ1      LYS 701  59.618  -5.706 -19.639
   12    HZ1  LYS 701           HZ2      LYS 701  61.140  -5.039 -19.457
   13    HZ3  LYS 701           HZ3      LYS 701  60.013  -4.278 -20.425

  No H/Q in entry =          13
  In of MODEL   22
    1    H    CYS 702           H        CYS 702  56.651  -6.633 -12.964
    2    HA   CYS 702           HA       CYS 702  58.129  -8.468 -11.296
    3    HB2  CYS 702           HB2      CYS 702  56.493  -6.122 -10.200
    4    HB3  CYS 702           HB3      CYS 702  56.925  -7.533  -9.304

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLN 703           H        GLN 703  56.571  -9.750  -9.963
    2    HA   GLN 703           HA       GLN 703  54.319 -10.457 -11.634
    3    HB2  GLN 703           HB2      GLN 703  55.337 -11.557  -9.018
    4    HB3  GLN 703           HB3      GLN 703  54.032 -12.252  -9.964
    5    HG2  GLN 703           HG2      GLN 703  56.876 -11.956 -10.929
    6    HG3  GLN 703           HG3      GLN 703  56.206 -13.418 -10.220
    7   HE21  GLN 703          HE21      GLN 703  56.605 -14.596 -12.065
    8   HE22  GLN 703          HE22      GLN 703  55.668 -14.416 -13.507

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ARG 704           H        ARG 704  52.322 -11.001 -10.357
    2    HA   ARG 704           HA       ARG 704  51.087  -8.561  -9.763
    3    HB2  ARG 704           HB2      ARG 704  50.233 -11.368  -9.194
    4    HB3  ARG 704           HB3      ARG 704  49.190  -9.965  -9.058
    5    HG2  ARG 704           HG2      ARG 704  50.604 -10.560 -11.612
    6    HG3  ARG 704           HG3      ARG 704  49.119 -11.402 -11.179
    7    HD2  ARG 704           HD2      ARG 704  48.613  -9.562 -12.590
    8    HD3  ARG 704           HD3      ARG 704  48.011  -9.226 -10.954
    9    HE   ARG 704           HE       ARG 704  50.577  -8.060 -11.549
   10   HH11  ARG 704          HH11      ARG 704  47.057  -7.642 -11.800
   11   HH12  ARG 704          HH12      ARG 704  47.145  -5.958 -12.063
   12   HH21  ARG 704          HH21      ARG 704  50.650  -5.692 -11.856
   13   HH22  ARG 704          HH22      ARG 704  49.190  -4.816 -12.032

  No H/Q in entry =          13
  In of MODEL   22
    1    H    TRP 705           H        TRP 705  52.598 -10.915  -7.724
    2    HA   TRP 705           HA       TRP 705  51.594  -9.709  -5.262
    3    HB2  TRP 705           HB2      TRP 705  52.732 -11.678  -4.193
    4    HB3  TRP 705           HB3      TRP 705  51.445 -12.096  -5.310
    5    HD1  TRP 705           HD1      TRP 705  55.155 -12.547  -4.706
    6    HE1  TRP 705           HE1      TRP 705  56.114 -14.134  -6.441
    7    HE3  TRP 705           HE3      TRP 705  51.114 -12.881  -7.830
    8    HZ2  TRP 705           HZ2      TRP 705  55.280 -15.415  -8.831
    9    HZ3  TRP 705           HZ3      TRP 705  51.281 -14.320  -9.814
   10    HH2  TRP 705           HH2      TRP 705  53.323 -15.560 -10.303

  No H/Q in entry =          10
  In of MODEL   22
    1    H    GLU 706           H        GLU 706  53.904  -8.889  -7.325
    2    HA   GLU 706           HA       GLU 706  55.835  -8.220  -5.233
    3    HB2  GLU 706           HB2      GLU 706  56.457  -8.867  -8.127
    4    HB3  GLU 706           HB3      GLU 706  57.609  -8.370  -6.876
    5    HG2  GLU 706           HG2      GLU 706  57.154 -10.419  -5.692
    6    HG3  GLU 706           HG3      GLU 706  55.971 -10.878  -6.915

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LYS 707           H        LYS 707  57.022  -6.334  -5.574
    2    HA   LYS 707           HA       LYS 707  55.567  -4.196  -7.026
    3    HB2  LYS 707           HB2      LYS 707  56.893  -3.935  -4.359
    4    HB3  LYS 707           HB3      LYS 707  55.914  -2.731  -5.165
    5    HG2  LYS 707           HG2      LYS 707  53.915  -4.108  -4.759
    6    HG3  LYS 707           HG3      LYS 707  54.923  -5.303  -3.933
    7    HD2  LYS 707           HD2      LYS 707  54.520  -2.418  -3.104
    8    HD3  LYS 707           HD3      LYS 707  53.865  -3.839  -2.294
    9    HE2  LYS 707           HE2      LYS 707  56.125  -4.591  -1.730
   10    HE3  LYS 707           HE3      LYS 707  56.819  -3.237  -2.612
   11    HZ3  LYS 707           HZ1      LYS 707  56.883  -2.685  -0.392
   12    HZ2  LYS 707           HZ2      LYS 707  55.282  -3.140  -0.095
   13    HZ1  LYS 707           HZ3      LYS 707  55.614  -1.776  -1.024

  No H/Q in entry =          13
  In of MODEL   22
    1    H    LEU 708           H        LEU 708  57.015  -2.363  -7.416
    2    HA   LEU 708           HA       LEU 708  59.853  -3.087  -7.402
    3    HB2  LEU 708           HB2      LEU 708  58.881  -2.764  -9.650
    4    HB3  LEU 708           HB3      LEU 708  58.330  -1.169  -9.186
    5    HG   LEU 708           HG       LEU 708  60.711  -0.471  -8.937
    6   HD13  LEU 708          HD11      LEU 708  61.724  -2.630  -8.517
    7   HD12  LEU 708          HD12      LEU 708  62.457  -1.869  -9.928
    8   HD11  LEU 708          HD13      LEU 708  61.286  -3.171 -10.138
    9   HD21  LEU 708          HD21      LEU 708  59.473   0.002 -10.986
   10   HD23  LEU 708          HD22      LEU 708  59.948  -1.569 -11.641
   11   HD22  LEU 708          HD23      LEU 708  61.169  -0.336 -11.335

  No H/Q in entry =          11
  In of MODEL   22
    1    H    GLN 709           H        GLN 709  60.808  -2.107  -5.704
    2    HA   GLN 709           HA       GLN 709  60.445   0.752  -5.333
    3    HB2  GLN 709           HB2      GLN 709  60.091   0.647  -2.948
    4    HB3  GLN 709           HB3      GLN 709  58.887  -0.412  -3.657
    5    HG2  GLN 709           HG2      GLN 709  60.300  -2.362  -3.089
    6    HG3  GLN 709           HG3      GLN 709  61.460  -1.251  -2.362
    7   HE21  GLN 709          HE21      GLN 709  60.995  -0.302  -0.403
    8   HE22  GLN 709          HE22      GLN 709  59.713  -0.865   0.608

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ASN 710           H        ASN 710  62.337   1.673  -4.493
    2    HA   ASN 710           HA       ASN 710  64.583   1.851  -3.905
    3    HB2  ASN 710           HB2      ASN 710  63.717   0.164  -2.127
    4    HB3  ASN 710           HB3      ASN 710  64.432  -1.082  -3.119
    5   HD21  ASN 710          HD21      ASN 710  64.932   1.400  -0.900
    6   HD22  ASN 710          HD22      ASN 710  66.626   1.200  -0.641

  No H/Q in entry =           6
  In of MODEL   22
    1    H    SER 711           H        SER 711  63.499   0.695  -6.476
    2    HA   SER 711           HA       SER 711  64.180   0.092  -8.483
    3    HB2  SER 711           HB2      SER 711  66.932   0.403  -7.306
    4    HB3  SER 711           HB3      SER 711  66.612   0.212  -9.047
    5    HG   SER 711           HG       SER 711  65.146   2.134  -7.734

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ARG 712           H        ARG 712  63.896  -1.867  -6.150
    2    HA   ARG 712           HA       ARG 712  64.965  -4.185  -7.597
    3    HB2  ARG 712           HB2      ARG 712  65.279  -5.359  -5.480
    4    HB3  ARG 712           HB3      ARG 712  66.214  -3.875  -5.476
    5    HG2  ARG 712           HG2      ARG 712  64.567  -2.794  -4.093
    6    HG3  ARG 712           HG3      ARG 712  63.531  -4.216  -4.156
    7    HD2  ARG 712           HD2      ARG 712  64.741  -4.166  -2.042
    8    HD3  ARG 712           HD3      ARG 712  65.305  -5.516  -3.026
    9    HE   ARG 712           HE       ARG 712  66.838  -3.136  -3.367
   10   HH11  ARG 712          HH11      ARG 712  66.471  -5.959  -1.286
   11   HH12  ARG 712          HH12      ARG 712  68.109  -6.017  -0.839
   12   HH21  ARG 712          HH21      ARG 712  69.044  -3.174  -2.761
   13   HH22  ARG 712          HH22      ARG 712  69.639  -4.354  -1.684

  No H/Q in entry =          13
  In of MODEL   22
    1    H    CYS 713           H        CYS 713  63.634  -6.148  -7.156
    2    HA   CYS 713           HA       CYS 713  60.837  -5.315  -6.994
    3    HB2  CYS 713           HB2      CYS 713  61.586  -6.469  -9.094
    4    HB3  CYS 713           HB3      CYS 713  61.945  -7.901  -8.126

  No H/Q in entry =           4
  In of MODEL   22
    1    H    VAL 714           H        VAL 714  59.781  -5.765  -5.232
    2    HA   VAL 714           HA       VAL 714  60.709  -7.931  -3.432
    3    HB   VAL 714           HB       VAL 714  59.922  -6.558  -1.507
    4   HG13  VAL 714          HG11      VAL 714  62.282  -6.379  -2.049
    5   HG12  VAL 714          HG12      VAL 714  61.648  -4.812  -1.516
    6   HG11  VAL 714          HG13      VAL 714  61.921  -5.112  -3.228
    7   HG23  VAL 714          HG21      VAL 714  59.369  -4.191  -1.824
    8   HG22  VAL 714          HG22      VAL 714  58.233  -5.256  -2.654
    9   HG21  VAL 714          HG23      VAL 714  59.477  -4.411  -3.570

  No H/Q in entry =           9
  In of MODEL   22
    1    H    CYS 715           H        CYS 715  58.814  -8.458  -1.830
    2    HA   CYS 715           HA       CYS 715  56.442  -8.875  -3.448
    3    HB2  CYS 715           HB2      CYS 715  57.240  -9.949  -0.730
    4    HB3  CYS 715           HB3      CYS 715  55.679 -10.258  -1.470

  No H/Q in entry =           4
  In of MODEL   22
    1    H    LYS 716           H        LYS 716  54.337  -8.441  -2.662
    2    HA   LYS 716           HA       LYS 716  53.910  -5.932  -1.275
    3    HB2  LYS 716           HB2      LYS 716  52.522  -6.831  -3.211
    4    HB3  LYS 716           HB3      LYS 716  51.986  -8.132  -2.177
    5    HG2  LYS 716           HG2      LYS 716  50.206  -6.573  -2.343
    6    HG3  LYS 716           HG3      LYS 716  50.872  -6.380  -0.730
    7    HD2  LYS 716           HD2      LYS 716  52.128  -4.417  -1.492
    8    HD3  LYS 716           HD3      LYS 716  51.455  -4.608  -3.114
    9    HE2  LYS 716           HE2      LYS 716  49.858  -4.080  -0.594
   10    HE3  LYS 716           HE3      LYS 716  50.294  -2.865  -1.789
   11    HZ2  LYS 716           HZ1      LYS 716  48.015  -3.689  -2.036
   12    HZ1  LYS 716           HZ2      LYS 716  48.553  -5.236  -2.333
   13    HZ3  LYS 716           HZ3      LYS 716  48.909  -3.991  -3.408

  No H/Q in entry =          13
  In of MODEL   22
    1    H    MET 717           H        MET 717  51.970  -6.279   0.638
    2    HA   MET 717           HA       MET 717  52.884  -8.543   2.270
    3    HB2  MET 717           HB2      MET 717  51.415  -6.041   3.190
    4    HB3  MET 717           HB3      MET 717  51.938  -7.349   4.232
    5    HG2  MET 717           HG2      MET 717  53.671  -5.395   2.740
    6    HG3  MET 717           HG3      MET 717  53.444  -5.522   4.475
    7    HE3  MET 717           HE1      MET 717  55.325  -8.913   5.268
    8    HE2  MET 717           HE2      MET 717  53.608  -8.734   4.915
    9    HE1  MET 717           HE3      MET 717  54.423  -7.565   5.954

  No H/Q in entry =           9
  In of MODEL   22
    1    HA   PRO 718           HA       PRO 718  49.154 -10.580   1.296
    2    HB2  PRO 718           HB2      PRO 718  48.679 -12.075   3.550
    3    HB3  PRO 718           HB3      PRO 718  49.883 -12.485   2.324
    4    HG2  PRO 718           HG2      PRO 718  50.255 -11.154   4.973
    5    HG3  PRO 718           HG3      PRO 718  51.269 -12.359   4.161
    6    HD2  PRO 718           HD2      PRO 718  51.877  -9.722   4.218
    7    HD3  PRO 718           HD3      PRO 718  52.332 -10.775   2.863

  No H/Q in entry =           7
  In of MODEL   22
    1    H    TYR 719           H        TYR 719  49.159  -8.916   4.369
    2    HA   TYR 719           HA       TYR 719  46.275  -8.955   4.561
    3    HB2  TYR 719           HB2      TYR 719  46.566  -7.603   6.608
    4    HB3  TYR 719           HB3      TYR 719  47.604  -9.017   6.637
    5    HD1  TYR 719           HD1      TYR 719  50.086  -8.713   6.204
    6    HD2  TYR 719           HD2      TYR 719  47.452  -5.421   6.776
    7    HE1  TYR 719           HE1      TYR 719  52.012  -7.258   6.691
    8    HE2  TYR 719           HE2      TYR 719  49.364  -3.969   7.259
    9    HH   TYR 719           HH       TYR 719  51.604  -4.124   7.995

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLU 720           H        GLU 720  48.465  -7.279   2.813
    2    HA   GLU 720           HA       GLU 720  46.929  -4.807   2.724
    3    HB2  GLU 720           HB2      GLU 720  49.705  -5.560   1.932
    4    HB3  GLU 720           HB3      GLU 720  48.979  -4.016   1.458
    5    HG2  GLU 720           HG2      GLU 720  49.332  -4.983   4.293
    6    HG3  GLU 720           HG3      GLU 720  50.416  -3.862   3.467

  No H/Q in entry =           6
  In of MODEL   22
    1    H    CYS 721           H        CYS 721  46.573  -7.582   1.416
    2    HA   CYS 721           HA       CYS 721  46.536  -6.819  -1.381
    3    HB2  CYS 721           HB2      CYS 721  45.833  -9.377   0.036
    4    HB3  CYS 721           HB3      CYS 721  45.641  -9.110  -1.691

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLY 722           H        GLY 722  44.895  -5.567  -1.913
    2    HA3  GLY 722           HA2      GLY 722  42.371  -5.722  -0.545
    3    HA2  GLY 722           HA3      GLY 722  42.780  -4.627  -1.852

  No H/Q in entry =           3
  In of MODEL   22
    1    HA   PRO 723           HA       PRO 723  40.459  -7.264  -4.495
    2    HB2  PRO 723           HB2      PRO 723  41.474  -6.669  -6.906
    3    HB3  PRO 723           HB3      PRO 723  40.654  -5.476  -5.893
    4    HG2  PRO 723           HG2      PRO 723  43.504  -5.702  -6.570
    5    HG3  PRO 723           HG3      PRO 723  42.605  -4.311  -5.947
    6    HD2  PRO 723           HD2      PRO 723  44.256  -6.212  -4.501
    7    HD3  PRO 723           HD3      PRO 723  43.504  -4.720  -3.908

  No H/Q in entry =           7
  In of MODEL   22
    1    H    SER 724           H        SER 724  40.534  -9.542  -4.414
    2    HA   SER 724           HA       SER 724  41.936 -10.866  -6.446
    3    HB2  SER 724           HB2      SER 724  42.734 -11.338  -3.572
    4    HB3  SER 724           HB3      SER 724  43.030 -12.522  -4.848
    5    HG   SER 724           HG       SER 724  43.885 -10.181  -5.644

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU 725           H        LEU 725  41.350 -13.209  -6.418
    2    HA   LEU 725           HA       LEU 725  38.615 -13.696  -5.632
    3    HB2  LEU 725           HB2      LEU 725  40.643 -15.035  -7.190
    4    HB3  LEU 725           HB3      LEU 725  39.722 -16.134  -6.184
    5    HG   LEU 725           HG       LEU 725  38.559 -16.224  -8.006
    6   HD12  LEU 725          HD11      LEU 725  37.219 -13.844  -6.938
    7   HD11  LEU 725          HD12      LEU 725  37.019 -15.504  -6.339
    8   HD13  LEU 725          HD13      LEU 725  36.520 -15.064  -7.989
    9   HD21  LEU 725          HD21      LEU 725  39.790 -14.824  -9.419
   10   HD23  LEU 725          HD22      LEU 725  39.040 -13.384  -8.684
   11   HD22  LEU 725          HD23      LEU 725  38.073 -14.501  -9.637

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ASP 726           H        ASP 726  37.966 -14.490  -3.708
    2    HA   ASP 726           HA       ASP 726  39.940 -15.423  -1.843
    3    HB2  ASP 726           HB2      ASP 726  36.933 -15.188  -1.545
    4    HB3  ASP 726           HB3      ASP 726  37.984 -15.857  -0.311

  No H/Q in entry =           4
  In of MODEL   22
    1    H    VAL 727           H        VAL 727  40.323 -17.356  -1.186
    2    HA   VAL 727           HA       VAL 727  38.931 -19.607  -2.467
    3    HB   VAL 727           HB       VAL 727  41.182 -20.673  -2.950
    4   HG12  VAL 727          HG11      VAL 727  41.610 -19.424  -5.046
    5   HG11  VAL 727          HG12      VAL 727  40.594 -18.113  -4.457
    6   HG13  VAL 727          HG13      VAL 727  39.886 -19.695  -4.783
    7   HG21  VAL 727          HG21      VAL 727  42.551 -19.263  -1.478
    8   HG23  VAL 727          HG22      VAL 727  42.225 -17.869  -2.512
    9   HG22  VAL 727          HG23      VAL 727  43.151 -19.227  -3.136

  No H/Q in entry =           9
  In of MODEL   22
    1    H    CYS 728           H        CYS 728  39.548 -21.694  -1.451
    2    HA   CYS 728           HA       CYS 728  40.153 -21.362   1.392
    3    HB2  CYS 728           HB2      CYS 728  39.176 -23.771  -0.151
    4    HB3  CYS 728           HB3      CYS 728  39.580 -23.797   1.557

  No H/Q in entry =           4
  In of MODEL   22
    1    H    ALA 729           H        ALA 729  42.010 -21.914   2.249
    2    HA   ALA 729           HA       ALA 729  43.811 -23.558   0.669
    3    HB2  ALA 729           HB1      ALA 729  45.653 -22.098   1.392
    4    HB1  ALA 729           HB2      ALA 729  44.461 -21.029   2.147
    5    HB3  ALA 729           HB3      ALA 729  44.474 -21.243   0.395

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLN 730           H        GLN 730  45.581 -24.311   2.110
    2    HA   GLN 730           HA       GLN 730  44.529 -24.781   4.800
    3    HB2  GLN 730           HB2      GLN 730  44.346 -26.839   3.389
    4    HB3  GLN 730           HB3      GLN 730  46.069 -26.741   3.133
    5    HG2  GLN 730           HG2      GLN 730  46.563 -27.106   5.407
    6    HG3  GLN 730           HG3      GLN 730  44.875 -27.010   5.872
    7   HE21  GLN 730          HE21      GLN 730  44.837 -29.072   6.751
    8   HE22  GLN 730          HE22      GLN 730  44.935 -30.488   5.781

  No H/Q in entry =           8
  In of MODEL   22
    1    H    ASP 731           H        ASP 731  45.725 -24.128   6.254
    2    HA   ASP 731           HA       ASP 731  48.349 -23.052   5.974
    3    HB2  ASP 731           HB2      ASP 731  46.760 -22.228   7.592
    4    HB3  ASP 731           HB3      ASP 731  46.560 -23.821   8.278

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLU 732           H        GLU 732  50.251 -24.219   6.030
    2    HA   GLU 732           HA       GLU 732  49.987 -27.060   6.437
    3    HB2  GLU 732           HB2      GLU 732  52.303 -25.405   5.506
    4    HB3  GLU 732           HB3      GLU 732  52.360 -27.165   5.633
    5    HG2  GLU 732           HG2      GLU 732  50.306 -27.076   4.034
    6    HG3  GLU 732           HG3      GLU 732  50.837 -25.415   3.762

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ARG 733           H        ARG 733  50.326 -24.775   8.658
    2    HA   ARG 733           HA       ARG 733  52.436 -26.186  10.122
    3    HB2  ARG 733           HB2      ARG 733  52.310 -23.555   9.698
    4    HB3  ARG 733           HB3      ARG 733  51.190 -23.614  11.045
    5    HG2  ARG 733           HG2      ARG 733  54.058 -24.552  11.113
    6    HG3  ARG 733           HG3      ARG 733  53.471 -23.014  11.726
    7    HD2  ARG 733           HD2      ARG 733  52.163 -24.150  13.408
    8    HD3  ARG 733           HD3      ARG 733  52.612 -25.724  12.740
    9    HE   ARG 733           HE       ARG 733  54.830 -24.070  13.461
   10   HH11  ARG 733          HH11      ARG 733  52.534 -26.470  14.738
   11   HH12  ARG 733          HH12      ARG 733  53.587 -27.027  15.942
   12   HH21  ARG 733          HH21      ARG 733  56.254 -24.835  15.141
   13   HH22  ARG 733          HH22      ARG 733  55.752 -26.085  16.177

  No H/Q in entry =          13
  In of MODEL   22
    1    H    SER 734           H        SER 734  49.224 -24.752  10.526
    2    HA   SER 734           HA       SER 734  48.722 -26.442  12.867
    3    HB2  SER 734           HB2      SER 734  46.982 -24.289  11.655
    4    HB3  SER 734           HB3      SER 734  46.798 -25.024  13.248
    5    HG   SER 734           HG       SER 734  48.914 -24.174  13.716

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LYS 735           H        LYS 735  48.278 -26.544   9.533
    2    HA   LYS 735           HA       LYS 735  47.188 -27.885   8.089
    3    HB2  LYS 735           HB2      LYS 735  46.547 -29.541  10.533
    4    HB3  LYS 735           HB3      LYS 735  46.440 -30.099   8.869
    5    HG2  LYS 735           HG2      LYS 735  48.967 -29.242  10.283
    6    HG3  LYS 735           HG3      LYS 735  48.473 -30.904   9.984
    7    HD2  LYS 735           HD2      LYS 735  49.011 -28.857   7.817
    8    HD3  LYS 735           HD3      LYS 735  50.184 -30.037   8.380
    9    HE2  LYS 735           HE2      LYS 735  47.509 -30.663   7.115
   10    HE3  LYS 735           HE3      LYS 735  49.077 -30.775   6.325
   11    HZ1  LYS 735           HZ1      LYS 735  48.288 -32.371   8.707
   12    HZ3  LYS 735           HZ2      LYS 735  49.721 -32.521   7.812
   13    HZ2  LYS 735           HZ3      LYS 735  48.244 -32.907   7.117

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ARG 736           H        ARG 736  45.842 -25.772   9.471
    2    HA   ARG 736           HA       ARG 736  43.056 -26.529   9.648
    3    HB2  ARG 736           HB2      ARG 736  42.729 -24.129  10.292
    4    HB3  ARG 736           HB3      ARG 736  43.879 -24.962  11.323
    5    HG2  ARG 736           HG2      ARG 736  45.735 -23.971  10.090
    6    HG3  ARG 736           HG3      ARG 736  44.596 -23.143   9.034
    7    HD2  ARG 736           HD2      ARG 736  43.804 -21.821  10.909
    8    HD3  ARG 736           HD3      ARG 736  44.851 -22.717  12.013
    9    HE   ARG 736           HE       ARG 736  46.647 -21.738  10.246
   10   HH11  ARG 736          HH11      ARG 736  44.003 -20.014  11.854
   11   HH12  ARG 736          HH12      ARG 736  44.868 -18.567  11.989
   12   HH21  ARG 736          HH21      ARG 736  47.812 -19.793  10.428
   13   HH22  ARG 736          HH22      ARG 736  47.111 -18.436  11.185

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ILE 737           H        ILE 737  41.515 -26.023   8.111
    2    HA   ILE 737           HA       ILE 737  42.437 -25.000   5.573
    3    HB   ILE 737           HB       ILE 737  39.563 -25.506   6.386
    4   HG12  ILE 737          HG12      ILE 737  40.926 -27.565   6.861
    5   HG13  ILE 737          HG13      ILE 737  39.725 -27.796   5.597
    6   HG21  ILE 737          HG21      ILE 737  40.190 -24.275   4.296
    7   HG23  ILE 737          HG22      ILE 737  39.172 -25.694   4.057
    8   HG22  ILE 737          HG23      ILE 737  40.900 -25.778   3.700
    9   HD13  ILE 737          HD11      ILE 737  41.444 -27.550   3.927
   10   HD12  ILE 737          HD12      ILE 737  41.814 -28.882   5.032
   11   HD11  ILE 737          HD13      ILE 737  42.668 -27.335   5.178

  No H/Q in entry =          11
  In of MODEL   22
    1    H    LEU 738           H        LEU 738  42.410 -22.806   5.193
    2    HA   LEU 738           HA       LEU 738  40.464 -21.265   6.687
    3    HB2  LEU 738           HB2      LEU 738  42.038 -19.538   7.245
    4    HB3  LEU 738           HB3      LEU 738  42.546 -21.051   7.966
    5    HG   LEU 738           HG       LEU 738  44.205 -21.079   5.856
    6   HD13  LEU 738          HD11      LEU 738  44.908 -18.941   5.223
    7   HD12  LEU 738          HD12      LEU 738  43.642 -18.186   6.201
    8   HD11  LEU 738          HD13      LEU 738  43.202 -19.188   4.805
    9   HD21  LEU 738          HD21      LEU 738  44.520 -19.339   8.280
   10   HD23  LEU 738          HD22      LEU 738  45.798 -19.760   7.170
   11   HD22  LEU 738          HD23      LEU 738  45.010 -21.035   8.123

  No H/Q in entry =          11
  In of MODEL   22
    1    HA   PRO 739           HA       PRO 739  39.769 -19.282   2.846
    2    HB2  PRO 739           HB2      PRO 739  38.732 -16.937   3.664
    3    HB3  PRO 739           HB3      PRO 739  37.839 -18.472   3.801
    4    HG2  PRO 739           HG2      PRO 739  39.335 -16.931   5.879
    5    HG3  PRO 739           HG3      PRO 739  37.780 -17.769   6.011
    6    HD2  PRO 739           HD2      PRO 739  40.127 -18.813   6.899
    7    HD3  PRO 739           HD3      PRO 739  38.765 -19.805   6.344

  No H/Q in entry =           7
  In of MODEL   22
    1    H    LEU 740           H        LEU 740  41.335 -18.543   1.636
    2    HA   LEU 740           HA       LEU 740  42.811 -16.168   2.495
    3    HB2  LEU 740           HB2      LEU 740  43.808 -18.595   1.048
    4    HB3  LEU 740           HB3      LEU 740  44.572 -17.047   0.767
    5    HG   LEU 740           HG       LEU 740  44.330 -18.399   3.440
    6   HD13  LEU 740          HD11      LEU 740  46.667 -18.823   3.280
    7   HD12  LEU 740          HD12      LEU 740  46.721 -18.121   1.635
    8   HD11  LEU 740          HD13      LEU 740  45.816 -19.602   1.952
    9   HD21  LEU 740          HD21      LEU 740  45.812 -15.921   2.586
   10   HD23  LEU 740          HD22      LEU 740  45.971 -16.714   4.151
   11   HD22  LEU 740          HD23      LEU 740  44.434 -15.994   3.692

  No H/Q in entry =          11
  In of MODEL   22
    1    H    THR 741           H        THR 741  43.922 -15.385   0.294
    2    HA   THR 741           HA       THR 741  41.875 -15.320  -1.752
    3    HB   THR 741           HB       THR 741  43.313 -12.794  -0.937
    4    HG1  THR 741           HG1      THR 741  40.786 -13.498   0.184
    5   HG23  THR 741          HG21      THR 741  41.355 -11.716  -1.801
    6   HG22  THR 741          HG22      THR 741  40.495 -13.249  -1.828
    7   HG21  THR 741          HG23      THR 741  41.816 -12.980  -2.954

  No H/Q in entry =           7
  In of MODEL   22
    1    H    VAL 742           H        VAL 742  42.887 -14.880  -3.802
    2    HA   VAL 742           HA       VAL 742  45.189 -16.234  -4.377
    3    HB   VAL 742           HB       VAL 742  44.190 -13.837  -5.900
    4   HG13  VAL 742          HG11      VAL 742  46.372 -14.451  -6.658
    5   HG12  VAL 742          HG12      VAL 742  45.169 -14.914  -7.861
    6   HG11  VAL 742          HG13      VAL 742  45.889 -16.141  -6.810
    7   HG21  VAL 742          HG21      VAL 742  43.451 -16.727  -6.127
    8   HG23  VAL 742          HG22      VAL 742  42.990 -15.430  -7.247
    9   HG22  VAL 742          HG23      VAL 742  42.431 -15.379  -5.574

  No H/Q in entry =           9
  In of MODEL   22
    1    H    CYS 743           H        CYS 743  45.156 -12.631  -4.179
    2    HA   CYS 743           HA       CYS 743  47.870 -12.278  -4.419
    3    HB2  CYS 743           HB2      CYS 743  46.295 -10.419  -4.461
    4    HB3  CYS 743           HB3      CYS 743  45.959 -10.666  -2.752

  No H/Q in entry =           4
  In of MODEL   22
    1    H    LYS 744           H        LYS 744  45.999 -12.657  -1.428
    2    HA   LYS 744           HA       LYS 744  48.014 -12.333   0.448
    3    HB2  LYS 744           HB2      LYS 744  45.654 -14.205   0.556
    4    HB3  LYS 744           HB3      LYS 744  46.658 -13.766   1.926
    5    HG2  LYS 744           HG2      LYS 744  45.943 -11.455   1.737
    6    HG3  LYS 744           HG3      LYS 744  45.023 -11.838   0.283
    7    HD2  LYS 744           HD2      LYS 744  43.616 -13.367   1.605
    8    HD3  LYS 744           HD3      LYS 744  44.519 -12.922   3.055
    9    HE2  LYS 744           HE2      LYS 744  43.754 -10.662   2.923
   10    HE3  LYS 744           HE3      LYS 744  43.053 -10.931   1.332
   11    HZ1  LYS 744           HZ1      LYS 744  41.466 -12.451   2.323
   12    HZ3  LYS 744           HZ2      LYS 744  41.345 -10.933   3.004
   13    HZ2  LYS 744           HZ3      LYS 744  42.104 -12.181   3.863

  No H/Q in entry =          13
  In of MODEL   22
    1    H    MET 745           H        MET 745  46.834 -15.346  -0.940
    2    HA   MET 745           HA       MET 745  48.670 -17.106   0.195
    3    HB2  MET 745           HB2      MET 745  46.887 -18.159  -0.773
    4    HB3  MET 745           HB3      MET 745  46.882 -17.149  -2.195
    5    HG2  MET 745           HG2      MET 745  47.563 -19.233  -2.992
    6    HG3  MET 745           HG3      MET 745  49.027 -18.318  -2.843
    7    HE3  MET 745           HE1      MET 745  46.949 -20.174  -0.001
    8    HE2  MET 745           HE2      MET 745  47.780 -21.738  -0.035
    9    HE1  MET 745           HE3      MET 745  46.904 -21.169  -1.452

  No H/Q in entry =           9
  In of MODEL   22
    1    H    HIS 746           H        HIS 746  48.843 -15.408  -2.907
    2    HA   HIS 746           HA       HIS 746  51.278 -16.639  -3.714
    3    HB2  HIS 746           HB2      HIS 746  49.723 -14.340  -4.588
    4    HB3  HIS 746           HB3      HIS 746  51.421 -14.330  -5.103
    5    HD1  HIS 746           HD1      HIS 746  52.015 -16.573  -6.643
    6    HD2  HIS 746           HD2      HIS 746  48.012 -15.623  -6.078
    7    HE1  HIS 746           HE1      HIS 746  50.819 -17.541  -8.590
    8    HE2  HIS 746           HE2      HIS 746  48.374 -17.112  -8.141

  No H/Q in entry =           8
  In of MODEL   22
    1    H    VAL 747           H        VAL 747  50.565 -13.595  -2.124
    2    HA   VAL 747           HA       VAL 747  53.204 -12.683  -2.025
    3    HB   VAL 747           HB       VAL 747  50.750 -11.969  -0.418
    4   HG11  VAL 747          HG11      VAL 747  52.766 -11.611   0.935
    5   HG13  VAL 747          HG12      VAL 747  52.023 -10.086   0.451
    6   HG12  VAL 747          HG13      VAL 747  53.469 -10.671  -0.377
    7   HG22  VAL 747          HG21      VAL 747  50.835  -9.926  -1.701
    8   HG21  VAL 747          HG22      VAL 747  50.798 -11.325  -2.782
    9   HG23  VAL 747          HG23      VAL 747  52.315 -10.469  -2.488

  No H/Q in entry =           9
  In of MODEL   22
    1    H    LEU 748           H        LEU 748  51.220 -14.364   0.431
    2    HA   LEU 748           HA       LEU 748  53.348 -14.429   2.262
    3    HB2  LEU 748           HB2      LEU 748  52.017 -16.109   3.545
    4    HB3  LEU 748           HB3      LEU 748  51.119 -14.672   3.123
    5    HG   LEU 748           HG       LEU 748  50.050 -16.005   1.289
    6   HD11  LEU 748          HD11      LEU 748  51.631 -17.830   1.118
    7   HD13  LEU 748          HD12      LEU 748  50.018 -18.431   1.508
    8   HD12  LEU 748          HD13      LEU 748  51.250 -18.328   2.766
    9   HD21  LEU 748          HD21      LEU 748  48.901 -15.462   3.338
   10   HD23  LEU 748          HD22      LEU 748  49.612 -16.867   4.135
   11   HD22  LEU 748          HD23      LEU 748  48.472 -17.089   2.809

  No H/Q in entry =          11
  In of MODEL   22
    1    H    HIS 749           H        HIS 749  52.610 -16.358  -0.430
    2    HA   HIS 749           HA       HIS 749  54.217 -18.576   0.302
    3    HB2  HIS 749           HB2      HIS 749  52.331 -18.364  -1.522
    4    HB3  HIS 749           HB3      HIS 749  53.669 -17.877  -2.554
    5    HD1  HIS 749           HD1      HIS 749  55.350 -19.698  -3.232
    6    HD2  HIS 749           HD2      HIS 749  52.317 -20.997  -0.740
    7    HE1  HIS 749           HE1      HIS 749  55.559 -22.190  -3.188
    8    HE2  HIS 749           HE2      HIS 749  53.668 -22.987  -1.739

  No H/Q in entry =           8
  In of MODEL   22
    1    H    CYS 750           H        CYS 750  54.798 -15.506  -1.425
    2    HA   CYS 750           HA       CYS 750  57.478 -16.367  -1.991
    3    HB2  CYS 750           HB2      CYS 750  57.865 -14.178  -3.029
    4    HB3  CYS 750           HB3      CYS 750  56.374 -14.878  -3.634

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLN 751           H        GLN 751  55.801 -14.649   0.474
    2    HA   GLN 751           HA       GLN 751  57.974 -13.478   1.822
    3    HB2  GLN 751           HB2      GLN 751  55.395 -14.618   2.925
    4    HB3  GLN 751           HB3      GLN 751  56.537 -13.703   3.883
    5    HG2  GLN 751           HG2      GLN 751  55.094 -12.643   1.465
    6    HG3  GLN 751           HG3      GLN 751  54.576 -12.388   3.125
    7   HE21  GLN 751          HE21      GLN 751  55.245 -10.375   1.193
    8   HE22  GLN 751          HE22      GLN 751  56.585  -9.512   1.833

  No H/Q in entry =           8
  In of MODEL   22
    1    H    GLY 752           H        GLY 752  56.762 -16.713   1.629
    2    HA3  GLY 752           HA2      GLY 752  58.358 -18.513   1.891
    3    HA2  GLY 752           HA3      GLY 752  59.015 -17.669   3.281

  No H/Q in entry =           3
  In of MODEL   22
    1    H    ARG 753           H        ARG 753  55.572 -18.031   2.673
    2    HA   ARG 753           HA       ARG 753  55.394 -19.691   5.073
    3    HB2  ARG 753           HB2      ARG 753  53.195 -18.273   3.561
    4    HB3  ARG 753           HB3      ARG 753  53.011 -19.138   5.080
    5    HG2  ARG 753           HG2      ARG 753  54.542 -16.589   4.611
    6    HG3  ARG 753           HG3      ARG 753  53.025 -16.769   5.492
    7    HD2  ARG 753           HD2      ARG 753  54.196 -18.214   7.125
    8    HD3  ARG 753           HD3      ARG 753  55.710 -17.899   6.273
    9    HE   ARG 753           HE       ARG 753  54.063 -15.905   7.634
   10   HH11  ARG 753          HH11      ARG 753  57.283 -17.016   6.567
   11   HH12  ARG 753          HH12      ARG 753  58.125 -15.762   7.324
   12   HH21  ARG 753          HH21      ARG 753  55.261 -14.170   8.700
   13   HH22  ARG 753          HH22      ARG 753  56.943 -14.094   8.581

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ASN 754           H        ASN 754  53.848 -21.497   5.025
    2    HA   ASN 754           HA       ASN 754  53.882 -22.800   2.392
    3    HB2  ASN 754           HB2      ASN 754  54.065 -24.105   5.121
    4    HB3  ASN 754           HB3      ASN 754  53.901 -24.957   3.603
    5   HD21  ASN 754          HD21      ASN 754  56.017 -23.213   5.652
    6   HD22  ASN 754          HD22      ASN 754  57.482 -23.521   4.789

  No H/Q in entry =           6
  In of MODEL   22
    1    H    TYR 755           H        TYR 755  51.976 -23.005   1.568
    2    HA   TYR 755           HA       TYR 755  49.758 -23.787   3.250
    3    HB2  TYR 755           HB2      TYR 755  49.739 -21.396   1.421
    4    HB3  TYR 755           HB3      TYR 755  48.289 -22.281   1.889
    5    HD1  TYR 755           HD1      TYR 755  47.185 -21.742   3.861
    6    HD2  TYR 755           HD2      TYR 755  51.146 -20.359   3.304
    7    HE1  TYR 755           HE1      TYR 755  46.968 -20.353   5.844
    8    HE2  TYR 755           HE2      TYR 755  50.944 -18.945   5.302
    9    HH   TYR 755           HH       TYR 755  49.119 -17.865   6.605

  No H/Q in entry =           9
  In of MODEL   22
    1    H    THR 756           H        THR 756  48.383 -25.060   2.271
    2    HA   THR 756           HA       THR 756  48.977 -26.003  -0.451
    3    HB   THR 756           HB       THR 756  47.211 -27.161   1.726
    4    HG1  THR 756           HG1      THR 756  49.941 -27.366   1.265
    5   HG22  THR 756          HG21      THR 756  47.441 -29.258   0.507
    6   HG21  THR 756          HG22      THR 756  48.423 -28.435  -0.720
    7   HG23  THR 756          HG23      THR 756  46.725 -27.987  -0.485

  No H/Q in entry =           7
  In of MODEL   22
    1    H    LEU 757           H        LEU 757  46.913 -26.190  -1.864
    2    HA   LEU 757           HA       LEU 757  44.865 -24.487  -0.737
    3    HB2  LEU 757           HB2      LEU 757  45.362 -25.186  -3.611
    4    HB3  LEU 757           HB3      LEU 757  43.881 -24.442  -3.053
    5    HG   LEU 757           HG       LEU 757  45.542 -22.709  -2.023
    6   HD12  LEU 757          HD11      LEU 757  47.448 -22.260  -3.477
    7   HD11  LEU 757          HD12      LEU 757  47.135 -23.765  -4.341
    8   HD13  LEU 757          HD13      LEU 757  47.584 -23.803  -2.634
    9   HD23  LEU 757          HD21      LEU 757  45.211 -21.355  -4.015
   10   HD22  LEU 757          HD22      LEU 757  43.773 -22.242  -3.505
   11   HD21  LEU 757          HD23      LEU 757  44.707 -22.807  -4.899

  No H/Q in entry =          11
  In of MODEL   22
    1    H    THR 758           H        THR 758  42.678 -25.045  -0.942
    2    HA   THR 758           HA       THR 758  42.277 -27.896  -1.187
    3    HB   THR 758           HB       THR 758  40.781 -27.679   0.906
    4    HG1  THR 758           HG1      THR 758  42.371 -25.818   2.041
    5   HG23  THR 758          HG21      THR 758  42.680 -28.118   2.426
    6   HG22  THR 758          HG22      THR 758  43.784 -27.463   1.224
    7   HG21  THR 758          HG23      THR 758  42.896 -28.945   0.883

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLY 759           H        GLY 759  39.770 -28.229  -0.879
    2    HA3  GLY 759           HA2      GLY 759  38.581 -26.796  -3.026
    3    HA2  GLY 759           HA3      GLY 759  37.838 -28.027  -2.013

  No H/Q in entry =           3
  In of MODEL   22
    1    H    ARG 760           H        ARG 760  36.727 -25.524  -2.942
    2    HA   ARG 760           HA       ARG 760  36.674 -23.537  -0.913
    3    HB2  ARG 760           HB2      ARG 760  34.956 -22.454  -2.111
    4    HB3  ARG 760           HB3      ARG 760  35.865 -23.292  -3.354
    5    HG2  ARG 760           HG2      ARG 760  33.252 -24.223  -2.155
    6    HG3  ARG 760           HG3      ARG 760  33.423 -23.426  -3.717
    7    HD2  ARG 760           HD2      ARG 760  34.725 -25.315  -4.533
    8    HD3  ARG 760           HD3      ARG 760  34.635 -26.059  -2.921
    9    HE   ARG 760           HE       ARG 760  32.064 -25.612  -3.748
   10   HH11  ARG 760          HH11      ARG 760  34.825 -27.587  -4.811
   11   HH12  ARG 760          HH12      ARG 760  33.876 -28.798  -5.517
   12   HH21  ARG 760          HH21      ARG 760  30.761 -27.310  -4.704
   13   HH22  ARG 760          HH22      ARG 760  31.505 -28.665  -5.412

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ASP 761           H        ASP 761  35.348 -26.573  -1.007
    2    HA   ASP 761           HA       ASP 761  33.005 -26.148   0.556
    3    HB2  ASP 761           HB2      ASP 761  33.160 -27.927  -1.107
    4    HB3  ASP 761           HB3      ASP 761  34.500 -28.642  -0.225

  No H/Q in entry =           4
  In of MODEL   22
    1    H    SER 762           H        SER 762  36.352 -26.592   1.168
    2    HA   SER 762           HA       SER 762  35.993 -27.875   3.717
    3    HB2  SER 762           HB2      SER 762  38.498 -26.889   2.370
    4    HB3  SER 762           HB3      SER 762  38.425 -27.937   3.788
    5    HG   SER 762           HG       SER 762  37.049 -29.295   2.372

  No H/Q in entry =           5
  In of MODEL   22
    1    H    CYS 763           H        CYS 763  36.389 -24.572   2.622
    2    HA   CYS 763           HA       CYS 763  36.586 -23.867   5.460
    3    HB2  CYS 763           HB2      CYS 763  37.913 -21.986   5.058
    4    HB3  CYS 763           HB3      CYS 763  38.651 -23.241   4.066

  No H/Q in entry =           4
  In of MODEL   22
    1    H    THR 764           H        THR 764  35.817 -21.537   5.802
    2    HA   THR 764           HA       THR 764  33.353 -21.128   4.301
    3    HB   THR 764           HB       THR 764  34.310 -19.834   6.875
    4    HG1  THR 764           HG1      THR 764  33.380 -22.341   6.497
    5   HG22  THR 764          HG21      THR 764  31.940 -19.239   7.154
    6   HG21  THR 764          HG22      THR 764  31.574 -20.010   5.604
    7   HG23  THR 764          HG23      THR 764  32.607 -18.582   5.657

  No H/Q in entry =           7
  In of MODEL   22
    1    H    LEU 765           H        LEU 765  33.840 -19.759   2.583
    2    HA   LEU 765           HA       LEU 765  35.994 -17.990   2.580
    3    HB2  LEU 765           HB2      LEU 765  33.742 -18.561   0.814
    4    HB3  LEU 765           HB3      LEU 765  34.123 -16.848   0.821
    5    HG   LEU 765           HG       LEU 765  36.364 -17.247   0.038
    6   HD11  LEU 765          HD11      LEU 765  35.810 -20.185   0.340
    7   HD13  LEU 765          HD12      LEU 765  36.937 -19.208   1.295
    8   HD12  LEU 765          HD13      LEU 765  37.230 -19.463  -0.418
    9   HD23  LEU 765          HD21      LEU 765  36.026 -18.437  -2.050
   10   HD22  LEU 765          HD22      LEU 765  34.734 -17.264  -1.745
   11   HD21  LEU 765          HD23      LEU 765  34.453 -18.997  -1.491

  No H/Q in entry =          11
  In of MODEL   22
    1    HA   PRO 766           HA       PRO 766  35.345 -15.029   5.408
    2    HB2  PRO 766           HB2      PRO 766  36.318 -12.745   4.408
    3    HB3  PRO 766           HB3      PRO 766  37.344 -14.153   4.725
    4    HG2  PRO 766           HG2      PRO 766  36.013 -13.321   2.205
    5    HG3  PRO 766           HG3      PRO 766  37.741 -13.693   2.435
    6    HD2  PRO 766           HD2      PRO 766  36.092 -15.527   1.432
    7    HD3  PRO 766           HD3      PRO 766  37.302 -16.014   2.637

  No H/Q in entry =           7
  In of MODEL   22
    1    H    ALA 767           H        ALA 767  34.774 -12.717   5.829
    2    HA   ALA 767           HA       ALA 767  33.110 -11.365   6.398
    3    HB2  ALA 767           HB1      ALA 767  33.440 -10.538   4.122
    4    HB1  ALA 767           HB2      ALA 767  31.773 -10.336   4.677
    5    HB3  ALA 767           HB3      ALA 767  32.187 -11.637   3.547

  No H/Q in entry =           5
  In of MODEL   22
    1    H    SER 768           H        SER 768  31.321 -13.270   4.181
    2    HA   SER 768           HA       SER 768  29.360 -14.555   4.384
    3    HB2  SER 768           HB2      SER 768  31.079 -15.882   5.745
    4    HB3  SER 768           HB3      SER 768  30.407 -15.081   7.166
    5    HG   SER 768           HG       SER 768  28.755 -16.372   7.119

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA 769           H        ALA 769  29.363 -11.787   5.204
    2    HA   ALA 769           HA       ALA 769  27.531 -11.680   7.474
    3    HB3  ALA 769           HB1      ALA 769  29.219  -9.542   6.206
    4    HB2  ALA 769           HB2      ALA 769  29.593 -10.457   7.666
    5    HB1  ALA 769           HB3      ALA 769  28.212  -9.345   7.646

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLU 770           H        GLU 770  26.335  -9.328   7.113
    2    HA   GLU 770           HA       GLU 770  24.325  -9.910   5.165
    3    HB2  GLU 770           HB2      GLU 770  23.227  -7.881   6.162
    4    HB3  GLU 770           HB3      GLU 770  23.619  -9.147   7.317
    5    HG2  GLU 770           HG2      GLU 770  25.633  -7.880   7.974
    6    HG3  GLU 770           HG3      GLU 770  25.166  -6.600   6.860

  No H/Q in entry =           6
  In of MODEL   22
    1    H    LYS 771           H        LYS 771  26.757  -9.344   3.976
    2    HA   LYS 771           HA       LYS 771  26.457  -6.723   2.696
    3    HB2  LYS 771           HB2      LYS 771  28.539  -8.851   2.245
    4    HB3  LYS 771           HB3      LYS 771  28.575  -7.218   1.636
    5    HG2  LYS 771           HG2      LYS 771  28.829  -7.993   4.549
    6    HG3  LYS 771           HG3      LYS 771  30.148  -7.513   3.490
    7    HD2  LYS 771           HD2      LYS 771  29.731  -5.534   4.581
    8    HD3  LYS 771           HD3      LYS 771  28.692  -5.345   3.179
    9    HE2  LYS 771           HE2      LYS 771  26.773  -6.154   4.573
   10    HE3  LYS 771           HE3      LYS 771  27.866  -6.234   5.944
   11    HZ2  LYS 771           HZ1      LYS 771  27.170  -3.772   4.443
   12    HZ1  LYS 771           HZ2      LYS 771  28.202  -3.837   5.766
   13    HZ3  LYS 771           HZ3      LYS 771  26.571  -4.210   5.943

  No H/Q in entry =          13
  In of MODEL   22
    1    H    ALA 772           H        ALA 772  26.525  -6.865   0.234
    2    HA   ALA 772           HA       ALA 772  24.491  -8.418  -0.837
    3    HB3  ALA 772           HB1      ALA 772  25.334  -7.705  -2.978
    4    HB1  ALA 772           HB2      ALA 772  26.857  -7.205  -2.231
    5    HB2  ALA 772           HB3      ALA 772  25.350  -6.371  -1.824

  No H/Q in entry =           5
  In of MODEL   22
    1    H    CYS 773           H        CYS 773  24.424 -10.516  -1.061
    2    HA   CYS 773           HA       CYS 773  25.243 -12.469  -0.189
    3    HB2  CYS 773           HB2      CYS 773  25.912 -13.964  -2.060
    4    HB3  CYS 773           HB3      CYS 773  24.454 -13.047  -2.358

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLY 774           H        GLY 774  26.811 -11.089   1.055
    2    HA3  GLY 774           HA2      GLY 774  28.610 -11.786   2.409
    3    HA2  GLY 774           HA3      GLY 774  29.227 -12.727   1.067

  No H/Q in entry =           3
  In of MODEL   22
    1    H    ALA 775           H        ALA 775  28.950 -10.057  -0.695
    2    HA   ALA 775           HA       ALA 775  31.055  -8.477   0.414
    3    HB3  ALA 775           HB1      ALA 775  32.684  -9.057  -1.355
    4    HB2  ALA 775           HB2      ALA 775  31.589 -10.297  -1.948
    5    HB1  ALA 775           HB3      ALA 775  32.312 -10.457  -0.347

  No H/Q in entry =           5
  In of MODEL   22
    1    H    CYS 776           H        CYS 776  31.938  -7.518  -2.003
    2    HA   CYS 776           HA       CYS 776  30.327  -7.314  -4.180
    3    HB2  CYS 776           HB2      CYS 776  28.741  -6.055  -2.596
    4    HB3  CYS 776           HB3      CYS 776  29.930  -4.776  -2.540

  No H/Q in entry =           4
  In of MODEL   22
    1    HA   PRO 777           HA       PRO 777  34.531  -5.622  -4.581
    2    HB2  PRO 777           HB2      PRO 777  35.762  -7.789  -5.548
    3    HB3  PRO 777           HB3      PRO 777  35.285  -7.698  -3.857
    4    HG2  PRO 777           HG2      PRO 777  34.060  -9.236  -6.074
    5    HG3  PRO 777           HG3      PRO 777  34.149  -9.615  -4.347
    6    HD2  PRO 777           HD2      PRO 777  31.981  -8.410  -5.775
    7    HD3  PRO 777           HD3      PRO 777  32.092  -8.739  -4.033

  No H/Q in entry =           7
  In of MODEL   22
    1    H    LEU 778           H        LEU 778  35.997  -6.696  -6.755
    2    HA   LEU 778           HA       LEU 778  35.905  -4.910  -8.768
    3    HB2  LEU 778           HB2      LEU 778  36.646  -7.810  -9.011
    4    HB3  LEU 778           HB3      LEU 778  37.032  -6.599 -10.199
    5    HG   LEU 778           HG       LEU 778  38.589  -5.548  -8.547
    6   HD13  LEU 778          HD11      LEU 778  37.600  -6.241  -6.435
    7   HD12  LEU 778          HD12      LEU 778  39.232  -6.894  -6.562
    8   HD11  LEU 778          HD13      LEU 778  37.843  -7.935  -6.854
    9   HD21  LEU 778          HD21      LEU 778  39.334  -7.189 -10.199
   10   HD23  LEU 778          HD22      LEU 778  38.990  -8.476  -9.050
   11   HD22  LEU 778          HD23      LEU 778  40.267  -7.308  -8.700

  No H/Q in entry =          11
  In of MODEL   22
    1    H    TRP 779           H        TRP 779  34.746  -8.222  -9.256
    2    HA   TRP 779           HA       TRP 779  33.485  -7.579 -11.747
    3    HB2  TRP 779           HB2      TRP 779  32.925 -10.058 -11.681
    4    HB3  TRP 779           HB3      TRP 779  34.638  -9.652 -11.654
    5    HD1  TRP 779           HD1      TRP 779  31.877 -11.214  -9.473
    6    HE1  TRP 779           HE1      TRP 779  32.973 -12.308  -7.430
    7    HE3  TRP 779           HE3      TRP 779  36.694  -9.559 -10.077
    8    HZ2  TRP 779           HZ2      TRP 779  35.526 -12.457  -6.232
    9    HZ3  TRP 779           HZ3      TRP 779  38.391 -10.265  -8.425
   10    HH2  TRP 779           HH2      TRP 779  37.799 -11.677  -6.560

  No H/Q in entry =          10
  In of MODEL   22
    1    H    GLY 780           H        GLY 780  32.554  -7.218  -8.668
    2    HA3  GLY 780           HA2      GLY 780  30.429  -6.464  -8.058
    3    HA2  GLY 780           HA3      GLY 780  29.741  -7.417  -9.373

  No H/Q in entry =           3
  In of MODEL   22
    1    H    LYS 781           H        LYS 781  28.366  -8.014  -7.558
    2    HA   LYS 781           HA       LYS 781  28.986 -10.586  -6.609
    3    HB2  LYS 781           HB2      LYS 781  30.055  -8.870  -5.018
    4    HB3  LYS 781           HB3      LYS 781  28.399  -8.625  -4.411
    5    HG2  LYS 781           HG2      LYS 781  29.628 -10.239  -3.015
    6    HG3  LYS 781           HG3      LYS 781  28.346 -11.078  -3.891
    7    HD2  LYS 781           HD2      LYS 781  29.899 -11.947  -5.491
    8    HD3  LYS 781           HD3      LYS 781  31.187 -10.907  -4.888
    9    HE2  LYS 781           HE2      LYS 781  31.482 -13.185  -4.235
   10    HE3  LYS 781           HE3      LYS 781  31.225 -12.173  -2.815
   11    HZ3  LYS 781           HZ1      LYS 781  28.956 -13.038  -2.659
   12    HZ2  LYS 781           HZ2      LYS 781  30.049 -14.297  -2.710
   13    HZ1  LYS 781           HZ3      LYS 781  29.172 -13.918  -4.090

  No H/Q in entry =          13
  In of MODEL   22
    1    H    CYS 782           H        CYS 782  26.747 -10.793  -4.894
    2    HA   CYS 782           HA       CYS 782  24.770  -9.669  -6.725
    3    HB2  CYS 782           HB2      CYS 782  23.728 -11.614  -6.831
    4    HB3  CYS 782           HB3      CYS 782  25.419 -11.831  -7.283

  No H/Q in entry =           4
  In of MODEL   22
    1    H    ASP 783           H        ASP 783  22.566 -11.106  -5.567
    2    HA   ASP 783           HA       ASP 783  21.835  -9.332  -3.473
    3    HB2  ASP 783           HB2      ASP 783  20.164  -9.995  -5.056
    4    HB3  ASP 783           HB3      ASP 783  20.456 -11.692  -4.716

  No H/Q in entry =           4
  In of MODEL   22
    1    H    ALA 784           H        ALA 784  21.548  -9.532  -1.459
    2    HA   ALA 784           HA       ALA 784  22.286 -12.061  -0.159
    3    HB1  ALA 784           HB1      ALA 784  23.788 -10.224   0.486
    4    HB2  ALA 784           HB2      ALA 784  22.773 -10.702   1.836
    5    HB3  ALA 784           HB3      ALA 784  22.395  -9.240   0.929

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLU 785           H        GLU 785  20.512  -9.121   0.702
    2    HA   GLU 785           HA       GLU 785  17.910 -10.007   0.673
    3    HB2  GLU 785           HB2      GLU 785  18.666 -11.649   2.393
    4    HB3  GLU 785           HB3      GLU 785  19.202 -10.315   3.396
    5    HG2  GLU 785           HG2      GLU 785  16.916  -9.550   3.637
    6    HG3  GLU 785           HG3      GLU 785  16.361 -10.843   2.569

  No H/Q in entry =           6
  In of MODEL   22
    1    H    SER 786           H        SER 786  20.185  -8.362   2.839
    2    HA   SER 786           HA       SER 786  18.575  -6.142   3.432
    3    HB2  SER 786           HB2      SER 786  20.872  -5.223   4.090
    4    HB3  SER 786           HB3      SER 786  20.376  -6.728   4.876
    5    HG   SER 786           HG       SER 786  22.078  -7.626   4.029

  No H/Q in entry =           5
  In of MODEL   22
    1    H    SER 787           H        SER 787  21.405  -6.435   1.371
    2    HA   SER 787           HA       SER 787  20.304  -4.481  -0.501
    3    HB2  SER 787           HB2      SER 787  22.035  -3.422   0.984
    4    HB3  SER 787           HB3      SER 787  23.182  -4.650   0.473
    5    HG   SER 787           HG       SER 787  21.949  -2.666  -1.133

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LYS 788           H        LYS 788  21.296  -4.837  -2.697
    2    HA   LYS 788           HA       LYS 788  22.477  -7.477  -2.893
    3    HB2  LYS 788           HB2      LYS 788  21.153  -8.145  -4.698
    4    HB3  LYS 788           HB3      LYS 788  20.005  -7.530  -3.509
    5    HG2  LYS 788           HG2      LYS 788  19.732  -5.534  -4.843
    6    HG3  LYS 788           HG3      LYS 788  21.040  -6.056  -5.911
    7    HD2  LYS 788           HD2      LYS 788  19.620  -8.149  -6.311
    8    HD3  LYS 788           HD3      LYS 788  18.295  -7.224  -5.608
    9    HE2  LYS 788           HE2      LYS 788  19.941  -6.448  -8.016
   10    HE3  LYS 788           HE3      LYS 788  18.298  -7.064  -8.043
   11    HZ3  LYS 788           HZ1      LYS 788  18.240  -4.701  -8.263
   12    HZ2  LYS 788           HZ2      LYS 788  19.212  -4.466  -6.927
   13    HZ1  LYS 788           HZ3      LYS 788  17.649  -5.062  -6.727

  No H/Q in entry =          13
  In of MODEL   22
    1    H    CYS 789           H        CYS 789  24.008  -7.677  -4.347
    2    HA   CYS 789           HA       CYS 789  24.442  -5.415  -6.087
    3    HB2  CYS 789           HB2      CYS 789  26.488  -7.289  -4.874
    4    HB3  CYS 789           HB3      CYS 789  26.875  -6.374  -6.317

  No H/Q in entry =           4
  In of MODEL   22
    1    H    VAL 790           H        VAL 790  26.105  -6.567  -7.945
    2    HA   VAL 790           HA       VAL 790  24.395  -8.349  -9.311
    3    HB   VAL 790           HB       VAL 790  23.374  -6.133  -9.762
    4   HG11  VAL 790          HG11      VAL 790  25.299  -4.738  -9.470
    5   HG13  VAL 790          HG12      VAL 790  24.573  -4.423 -11.053
    6   HG12  VAL 790          HG13      VAL 790  26.044  -5.401 -10.919
    7   HG21  VAL 790          HG21      VAL 790  24.757  -7.339 -12.153
    8   HG23  VAL 790          HG22      VAL 790  23.383  -6.231 -12.230
    9   HG22  VAL 790          HG23      VAL 790  23.200  -7.815 -11.473

  No H/Q in entry =           9
  In of MODEL   22
    1    H    CYS 791           H        CYS 791  25.658  -9.140 -11.185
    2    HA   CYS 791           HA       CYS 791  28.524  -8.566 -10.863
    3    HB2  CYS 791           HB2      CYS 791  27.182 -11.176 -11.561
    4    HB3  CYS 791           HB3      CYS 791  28.927 -10.900 -11.565

  No H/Q in entry =           4
  In of MODEL   22
    1    H    ARG 792           H        ARG 792  29.692  -8.049 -12.372
    2    HA   ARG 792           HA       ARG 792  28.477  -7.367 -14.935
    3    HB2  ARG 792           HB2      ARG 792  31.138  -6.679 -13.683
    4    HB3  ARG 792           HB3      ARG 792  30.567  -6.117 -15.246
    5    HG2  ARG 792           HG2      ARG 792  29.220  -5.519 -12.628
    6    HG3  ARG 792           HG3      ARG 792  30.364  -4.446 -13.439
    7    HD2  ARG 792           HD2      ARG 792  28.886  -4.472 -15.418
    8    HD3  ARG 792           HD3      ARG 792  27.694  -5.377 -14.476
    9    HE   ARG 792           HE       ARG 792  27.854  -3.406 -12.907
   10   HH11  ARG 792          HH11      ARG 792  28.066  -3.169 -16.430
   11   HH12  ARG 792          HH12      ARG 792  27.729  -1.511 -16.501
   12   HH21  ARG 792          HH21      ARG 792  27.325  -1.137 -12.979
   13   HH22  ARG 792          HH22      ARG 792  27.280  -0.305 -14.461

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLU 793           H        GLU 793  30.250  -7.580 -16.779
    2    HA   GLU 793           HA       GLU 793  31.195 -10.307 -16.641
    3    HB2  GLU 793           HB2      GLU 793  30.892  -8.352 -18.901
    4    HB3  GLU 793           HB3      GLU 793  31.636  -9.933 -19.096
    5    HG2  GLU 793           HG2      GLU 793  28.814  -9.407 -18.198
    6    HG3  GLU 793           HG3      GLU 793  29.305  -9.933 -19.807

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ALA 794           H        ALA 794  33.332 -10.332 -18.214
    2    HA   ALA 794           HA       ALA 794  35.342  -9.535 -16.399
    3    HB1  ALA 794           HB1      ALA 794  35.667 -10.495 -19.219
    4    HB2  ALA 794           HB2      ALA 794  35.424 -11.542 -17.827
    5    HB3  ALA 794           HB3      ALA 794  36.879 -10.544 -17.939

  No H/Q in entry =           5
  In of MODEL   22
    1    H    SER 795           H        SER 795  34.004  -7.999 -19.202
    2    HA   SER 795           HA       SER 795  36.315  -6.492 -19.810
    3    HB2  SER 795           HB2      SER 795  33.509  -5.861 -20.672
    4    HB3  SER 795           HB3      SER 795  35.017  -5.525 -21.520
    5    HG   SER 795           HG       SER 795  35.287  -7.899 -21.600

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLU 796           H        GLU 796  33.641  -6.107 -17.626
    2    HA   GLU 796           HA       GLU 796  33.977  -3.225 -17.432
    3    HB2  GLU 796           HB2      GLU 796  32.058  -5.064 -16.013
    4    HB3  GLU 796           HB3      GLU 796  32.074  -3.319 -15.846
    5    HG2  GLU 796           HG2      GLU 796  30.340  -3.677 -17.323
    6    HG3  GLU 796           HG3      GLU 796  31.681  -3.307 -18.395

  No H/Q in entry =           6
  In of MODEL   22
    1    H    CYS 797           H        CYS 797  36.231  -4.578 -16.610
    2    HA   CYS 797           HA       CYS 797  36.257  -3.845 -13.784
    3    HB2  CYS 797           HB2      CYS 797  35.968  -6.326 -14.013
    4    HB3  CYS 797           HB3      CYS 797  37.504  -6.377 -14.863

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLU 798           H        GLU 798  37.936  -2.550 -13.393
    2    HA   GLU 798           HA       GLU 798  40.074  -2.420 -15.421
    3    HB2  GLU 798           HB2      GLU 798  40.455  -0.114 -14.647
    4    HB3  GLU 798           HB3      GLU 798  38.815  -0.336 -15.232
    5    HG2  GLU 798           HG2      GLU 798  37.967  -0.417 -12.987
    6    HG3  GLU 798           HG3      GLU 798  39.601  -0.392 -12.327

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU 799           H        GLU 799  39.342  -3.315 -12.281
    2    HA   GLU 799           HA       GLU 799  41.621  -2.402 -10.924
    3    HB2  GLU 799           HB2      GLU 799  39.483  -3.011  -9.842
    4    HB3  GLU 799           HB3      GLU 799  39.818  -4.702 -10.184
    5    HG2  GLU 799           HG2      GLU 799  40.333  -4.049  -7.860
    6    HG3  GLU 799           HG3      GLU 799  41.732  -4.668  -8.736

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLU 800           H        GLU 800  43.329  -3.572 -10.095
    2    HA   GLU 800           HA       GLU 800  44.390  -5.384 -12.063
    3    HB2  GLU 800           HB2      GLU 800  45.720  -3.711  -9.960
    4    HB3  GLU 800           HB3      GLU 800  46.581  -4.894 -10.912
    5    HG2  GLU 800           HG2      GLU 800  45.804  -3.605 -12.952
    6    HG3  GLU 800           HG3      GLU 800  45.254  -2.366 -11.826

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLY 801           H        GLY 801  42.964  -6.989 -11.107
    2    HA3  GLY 801           HA2      GLY 801  43.959  -8.229  -8.737
    3    HA2  GLY 801           HA3      GLY 801  42.786  -8.902  -9.870

  No H/Q in entry =           3
  In of MODEL   22
    1    H    PHE 802           H        PHE 802  44.059 -10.783  -9.443
    2    HA   PHE 802           HA       PHE 802  46.652 -10.975 -10.787
    3    HB2  PHE 802           HB2      PHE 802  45.139 -12.775  -8.926
    4    HB3  PHE 802           HB3      PHE 802  46.537 -13.344  -9.819
    5    HD1  PHE 802           HD1      PHE 802  48.021 -13.766  -8.082
    6    HD2  PHE 802           HD2      PHE 802  46.102  -9.982  -8.288
    7    HE1  PHE 802           HE1      PHE 802  49.486 -12.954  -6.373
    8    HE2  PHE 802           HE2      PHE 802  47.578  -9.130  -6.574
    9    HZ   PHE 802           HZ       PHE 802  49.303 -10.606  -5.579

  No H/Q in entry =           9
  In of MODEL   22
    1    H    SER 803           H        SER 803  46.876 -13.395 -11.658
    2    HA   SER 803           HA       SER 803  44.717 -13.900 -13.528
    3    HB2  SER 803           HB2      SER 803  47.685 -14.388 -13.935
    4    HB3  SER 803           HB3      SER 803  46.379 -14.610 -15.105
    5    HG   SER 803           HG       SER 803  46.037 -12.435 -15.136

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ILE 804           H        ILE 804  43.984 -15.956 -13.336
    2    HA   ILE 804           HA       ILE 804  45.543 -17.790 -11.678
    3    HB   ILE 804           HB       ILE 804  43.612 -18.571 -10.468
    4   HG12  ILE 804          HG12      ILE 804  41.884 -18.221 -12.277
    5   HG13  ILE 804          HG13      ILE 804  41.354 -17.727 -10.681
    6   HG23  ILE 804          HG21      ILE 804  44.736 -16.684  -9.484
    7   HG22  ILE 804          HG22      ILE 804  42.999 -16.572  -9.161
    8   HG21  ILE 804          HG23      ILE 804  43.731 -15.578 -10.425
    9   HD12  ILE 804          HD11      ILE 804  42.240 -15.919 -12.929
   10   HD11  ILE 804          HD12      ILE 804  41.805 -15.378 -11.309
   11   HD13  ILE 804          HD13      ILE 804  40.602 -16.156 -12.334

  No H/Q in entry =          11
  In of MODEL   22
    1    H    CYS 805           H        CYS 805  44.488 -20.069 -11.822
    2    HA   CYS 805           HA       CYS 805  43.942 -20.568 -14.668
    3    HB2  CYS 805           HB2      CYS 805  46.140 -21.360 -13.863
    4    HB3  CYS 805           HB3      CYS 805  45.314 -22.283 -12.612

  No H/Q in entry =           4
  In of MODEL   22
    1    H    VAL 806           H        VAL 806  42.053 -21.438 -15.032
    2    HA   VAL 806           HA       VAL 806  40.801 -22.835 -12.832
    3    HB   VAL 806           HB       VAL 806  40.002 -20.507 -12.857
    4   HG13  VAL 806          HG11      VAL 806  38.649 -19.658 -14.676
    5   HG12  VAL 806          HG12      VAL 806  39.069 -21.093 -15.617
    6   HG11  VAL 806          HG13      VAL 806  40.330 -19.959 -15.130
    7   HG21  VAL 806          HG21      VAL 806  37.981 -22.519 -13.754
    8   HG23  VAL 806          HG22      VAL 806  37.591 -20.975 -12.979
    9   HG22  VAL 806          HG23      VAL 806  38.480 -22.220 -12.097

  No H/Q in entry =           9
  In of MODEL   22
    1    H    GLU 807           H        GLU 807  39.741 -24.596 -13.399
    2    HA   GLU 807           HA       GLU 807  40.085 -25.550 -16.082
    3    HB2  GLU 807           HB2      GLU 807  40.543 -26.945 -14.100
    4    HB3  GLU 807           HB3      GLU 807  38.868 -26.803 -13.625
    5    HG2  GLU 807           HG2      GLU 807  38.208 -28.007 -15.655
    6    HG3  GLU 807           HG3      GLU 807  39.912 -28.162 -16.095

  No H/Q in entry =           6
  In of MODEL   22
    1    H    VAL 808           H        VAL 808  38.713 -25.204 -17.526
    2    HA   VAL 808           HA       VAL 808  35.860 -25.107 -16.994
    3    HB   VAL 808           HB       VAL 808  36.666 -22.769 -17.058
    4   HG12  VAL 808          HG11      VAL 808  37.683 -23.370 -19.816
    5   HG11  VAL 808          HG12      VAL 808  38.646 -22.969 -18.396
    6   HG13  VAL 808          HG13      VAL 808  37.570 -21.762 -19.102
    7   HG22  VAL 808          HG21      VAL 808  35.185 -21.899 -18.803
    8   HG21  VAL 808          HG22      VAL 808  34.431 -23.204 -17.880
    9   HG23  VAL 808          HG23      VAL 808  35.074 -23.517 -19.494

  No H/Q in entry =           9
  In of MODEL   22
    1    H    ASN 809           H        ASN 809  34.787 -26.176 -18.589
    2    HA   ASN 809           HA       ASN 809  34.400 -27.417 -20.472
    3    HB2  ASN 809           HB2      ASN 809  36.704 -25.771 -21.325
    4    HB3  ASN 809           HB3      ASN 809  36.169 -27.054 -22.437
    5   HD21  ASN 809          HD21      ASN 809  35.823 -23.897 -21.263
    6   HD22  ASN 809          HD22      ASN 809  34.403 -23.438 -22.112

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLY 810           H        GLY 810  36.525 -28.042 -18.285
    2    HA3  GLY 810           HA2      GLY 810  37.514 -30.083 -17.759
    3    HA2  GLY 810           HA3      GLY 810  37.387 -30.561 -19.449

  No H/Q in entry =           3
  In of MODEL   22
    1    H    LYS 811           H        LYS 811  38.624 -27.490 -19.416
    2    HA   LYS 811           HA       LYS 811  41.389 -28.473 -19.373
    3    HB2  LYS 811           HB2      LYS 811  40.159 -26.485 -21.290
    4    HB3  LYS 811           HB3      LYS 811  41.864 -26.913 -21.220
    5    HG2  LYS 811           HG2      LYS 811  41.338 -29.201 -21.849
    6    HG3  LYS 811           HG3      LYS 811  39.621 -28.820 -21.852
    7    HD2  LYS 811           HD2      LYS 811  40.493 -28.833 -24.124
    8    HD3  LYS 811           HD3      LYS 811  39.995 -27.206 -23.664
    9    HE2  LYS 811           HE2      LYS 811  42.290 -26.586 -23.244
   10    HE3  LYS 811           HE3      LYS 811  42.832 -28.228 -23.573
   11    HZ1  LYS 811           HZ1      LYS 811  41.505 -26.419 -25.507
   12    HZ3  LYS 811           HZ2      LYS 811  42.072 -27.980 -25.849
   13    HZ2  LYS 811           HZ3      LYS 811  43.150 -26.745 -25.462

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLU 812           H        GLU 812  42.923 -26.977 -18.663
    2    HA   GLU 812           HA       GLU 812  41.801 -25.016 -16.827
    3    HB2  GLU 812           HB2      GLU 812  44.626 -25.997 -17.133
    4    HB3  GLU 812           HB3      GLU 812  44.042 -24.914 -15.876
    5    HG2  GLU 812           HG2      GLU 812  42.520 -26.701 -15.117
    6    HG3  GLU 812           HG3      GLU 812  43.251 -27.790 -16.287

  No H/Q in entry =           6
  In of MODEL   22
    1    H    GLN 813           H        GLN 813  41.412 -23.123 -17.596
    2    HA   GLN 813           HA       GLN 813  43.352 -21.978 -19.455
    3    HB2  GLN 813           HB2      GLN 813  41.187 -22.214 -20.481
    4    HB3  GLN 813           HB3      GLN 813  40.401 -21.429 -19.120
    5    HG2  GLN 813           HG2      GLN 813  41.433 -19.354 -19.658
    6    HG3  GLN 813           HG3      GLN 813  42.392 -20.092 -20.936
    7   HE21  GLN 813          HE21      GLN 813  39.031 -20.930 -20.431
    8   HE22  GLN 813          HE22      GLN 813  38.450 -20.157 -21.859

  No H/Q in entry =           8
  In of MODEL   22
    1    H    THR 814           H        THR 814  44.172 -19.986 -19.045
    2    HA   THR 814           HA       THR 814  44.088 -19.064 -16.331
    3    HB   THR 814           HB       THR 814  45.424 -17.861 -18.753
    4    HG1  THR 814           HG1      THR 814  47.244 -19.112 -18.025
    5   HG21  THR 814          HG21      THR 814  45.351 -16.401 -16.771
    6   HG23  THR 814          HG22      THR 814  47.001 -16.937 -17.094
    7   HG22  THR 814          HG23      THR 814  46.066 -17.684 -15.798

  No H/Q in entry =           7
  In of MODEL   22
    1    H    MET 815           H        MET 815  42.811 -17.477 -15.648
    2    HA   MET 815           HA       MET 815  41.688 -15.684 -17.667
    3    HB2  MET 815           HB2      MET 815  40.202 -16.602 -15.201
    4    HB3  MET 815           HB3      MET 815  39.596 -15.534 -16.460
    5    HG2  MET 815           HG2      MET 815  39.959 -17.515 -18.037
    6    HG3  MET 815           HG3      MET 815  40.180 -18.406 -16.531
    7    HE1  MET 815           HE1      MET 815  38.495 -20.038 -17.294
    8    HE3  MET 815           HE2      MET 815  38.068 -19.157 -18.753
    9    HE2  MET 815           HE3      MET 815  36.793 -19.729 -17.653

  No H/Q in entry =           9
  In of MODEL   22
    1    H    SER 816           H        SER 816  41.186 -13.636 -16.821
    2    HA   SER 816           HA       SER 816  43.015 -12.744 -14.806
    3    HB2  SER 816           HB2      SER 816  40.679 -11.295 -16.051
    4    HB3  SER 816           HB3      SER 816  42.119 -10.567 -15.327
    5    HG   SER 816           HG       SER 816  41.702 -11.436 -17.843

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLU 817           H        GLU 817  42.328 -11.809 -12.824
    2    HA   GLU 817           HA       GLU 817  40.658 -13.419 -11.341
    3    HB2  GLU 817           HB2      GLU 817  42.550 -11.655 -10.743
    4    HB3  GLU 817           HB3      GLU 817  41.119 -10.631 -10.562
    5    HG2  GLU 817           HG2      GLU 817  40.354 -11.682  -8.783
    6    HG3  GLU 817           HG3      GLU 817  41.076 -13.214  -9.280

  No H/Q in entry =           6
  In of MODEL   22
    1    H    CYS 818           H        CYS 818  39.889 -10.314 -12.884
    2    HA   CYS 818           HA       CYS 818  37.303 -10.072 -11.778
    3    HB2  CYS 818           HB2      CYS 818  38.153  -9.103 -14.502
    4    HB3  CYS 818           HB3      CYS 818  36.864  -8.480 -13.482

  No H/Q in entry =           4
  In of MODEL   22
    1    H    GLU 819           H        GLU 819  38.527 -11.637 -14.662
    2    HA   GLU 819           HA       GLU 819  36.112 -12.237 -15.941
    3    HB2  GLU 819           HB2      GLU 819  38.363 -12.190 -16.968
    4    HB3  GLU 819           HB3      GLU 819  38.760 -13.633 -16.058
    5    HG2  GLU 819           HG2      GLU 819  37.166 -14.923 -17.303
    6    HG3  GLU 819           HG3      GLU 819  36.609 -13.476 -18.149

  No H/Q in entry =           6
  In of MODEL   22
    1    H    ALA 820           H        ALA 820  38.300 -14.429 -14.152
    2    HA   ALA 820           HA       ALA 820  36.673 -16.641 -14.176
    3    HB3  ALA 820           HB1      ALA 820  38.621 -15.833 -12.044
    4    HB1  ALA 820           HB2      ALA 820  38.987 -16.735 -13.526
    5    HB2  ALA 820           HB3      ALA 820  37.979 -17.460 -12.275

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLY 821           H        GLY 821  36.865 -13.956 -11.857
    2    HA3  GLY 821           HA2      GLY 821  35.141 -14.955  -9.868
    3    HA2  GLY 821           HA3      GLY 821  35.542 -13.264 -10.128

  No H/Q in entry =           3
  In of MODEL   22
    1    H    ALA 822           H        ALA 822  34.524 -12.907 -12.694
    2    HA   ALA 822           HA       ALA 822  31.813 -12.490 -12.103
    3    HB3  ALA 822           HB1      ALA 822  31.583 -11.637 -14.329
    4    HB1  ALA 822           HB2      ALA 822  33.111 -12.380 -14.830
    5    HB2  ALA 822           HB3      ALA 822  33.099 -11.066 -13.646

  No H/Q in entry =           5
  In of MODEL   22
    1    H    LEU 823           H        LEU 823  33.461 -14.942 -14.102
    2    HA   LEU 823           HA       LEU 823  31.165 -16.240 -14.977
    3    HB2  LEU 823           HB2      LEU 823  33.969 -17.114 -14.591
    4    HB3  LEU 823           HB3      LEU 823  32.756 -18.355 -14.815
    5    HG   LEU 823           HG       LEU 823  32.109 -17.241 -16.953
    6   HD11  LEU 823          HD11      LEU 823  34.611 -15.625 -16.528
    7   HD13  LEU 823          HD12      LEU 823  32.952 -15.021 -16.566
    8   HD12  LEU 823          HD13      LEU 823  33.667 -15.722 -18.018
    9   HD23  LEU 823          HD21      LEU 823  34.926 -18.205 -16.675
   10   HD22  LEU 823          HD22      LEU 823  33.982 -18.146 -18.186
   11   HD21  LEU 823          HD23      LEU 823  33.462 -19.183 -16.846

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ARG 824           H        ARG 824  32.979 -16.654 -12.000
    2    HA   ARG 824           HA       ARG 824  31.576 -18.780 -10.890
    3    HB2  ARG 824           HB2      ARG 824  32.941 -16.411  -9.643
    4    HB3  ARG 824           HB3      ARG 824  32.191 -17.686  -8.691
    5    HG2  ARG 824           HG2      ARG 824  33.722 -19.302  -9.531
    6    HG3  ARG 824           HG3      ARG 824  34.382 -18.139 -10.692
    7    HD2  ARG 824           HD2      ARG 824  35.711 -18.583  -8.561
    8    HD3  ARG 824           HD3      ARG 824  35.430 -16.902  -9.004
    9    HE   ARG 824           HE       ARG 824  34.187 -16.622  -7.157
   10   HH11  ARG 824          HH11      ARG 824  34.484 -20.164  -7.576
   11   HH12  ARG 824          HH12      ARG 824  33.878 -20.511  -6.025
   12   HH21  ARG 824          HH21      ARG 824  33.398 -17.163  -5.050
   13   HH22  ARG 824          HH22      ARG 824  33.258 -18.807  -4.573

  No H/Q in entry =          13
  In of MODEL   22
    1    H    CYS 825           H        CYS 825  30.827 -15.342 -10.921
    2    HA   CYS 825           HA       CYS 825  28.621 -15.684  -9.145
    3    HB2  CYS 825           HB2      CYS 825  29.898 -13.611  -9.148
    4    HB3  CYS 825           HB3      CYS 825  29.358 -13.284 -10.793

  No H/Q in entry =           4
  In of MODEL   22
    1    H    ARG 826           H        ARG 826  28.938 -15.215 -12.653
    2    HA   ARG 826           HA       ARG 826  26.151 -14.950 -13.068
    3    HB2  ARG 826           HB2      ARG 826  26.640 -15.507 -15.470
    4    HB3  ARG 826           HB3      ARG 826  27.484 -14.096 -14.826
    5    HG2  ARG 826           HG2      ARG 826  29.471 -15.419 -14.616
    6    HG3  ARG 826           HG3      ARG 826  28.622 -16.857 -15.199
    7    HD2  ARG 826           HD2      ARG 826  28.978 -14.292 -16.747
    8    HD3  ARG 826           HD3      ARG 826  29.972 -15.732 -16.956
    9    HE   ARG 826           HE       ARG 826  27.763 -16.853 -17.460
   10   HH11  ARG 826          HH11      ARG 826  28.447 -13.448 -18.303
   11   HH12  ARG 826          HH12      ARG 826  27.432 -13.454 -19.643
   12   HH21  ARG 826          HH21      ARG 826  26.329 -16.789 -19.354
   13   HH22  ARG 826          HH22      ARG 826  26.209 -15.338 -20.243

  No H/Q in entry =          13
  In of MODEL   22
    1    H    GLY 827           H        GLY 827  28.116 -17.746 -12.673
    2    HA3  GLY 827           HA2      GLY 827  26.794 -19.695 -11.944
    3    HA2  GLY 827           HA3      GLY 827  25.693 -19.294 -13.254

  No H/Q in entry =           3
  In of MODEL   22
    1    H    GLN 828           H        GLN 828  28.775 -18.748 -14.292
    2    HA   GLN 828           HA       GLN 828  28.769 -21.056 -15.989
    3    HB2  GLN 828           HB2      GLN 828  29.842 -18.890 -16.622
    4    HB3  GLN 828           HB3      GLN 828  31.061 -19.196 -15.395
    5    HG2  GLN 828           HG2      GLN 828  31.813 -19.802 -17.669
    6    HG3  GLN 828           HG3      GLN 828  31.795 -21.178 -16.548
    7   HE21  GLN 828          HE21      GLN 828  30.280 -19.695 -19.328
    8   HE22  GLN 828          HE22      GLN 828  29.419 -21.106 -19.816

  No H/Q in entry =           8
  In of MODEL   22
    1    H    SER 829           H        SER 829  29.789 -22.946 -15.748
    2    HA   SER 829           HA       SER 829  30.572 -23.470 -13.014
    3    HB2  SER 829           HB2      SER 829  30.111 -25.398 -15.295
    4    HB3  SER 829           HB3      SER 829  30.340 -25.829 -13.596
    5    HG   SER 829           HG       SER 829  28.432 -23.936 -14.007

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ILE 830           H        ILE 830  32.553 -23.098 -12.555
    2    HA   ILE 830           HA       ILE 830  34.664 -24.107 -14.293
    3    HB   ILE 830           HB       ILE 830  36.064 -22.184 -13.927
    4   HG12  ILE 830          HG12      ILE 830  35.254 -21.459 -11.672
    5   HG13  ILE 830          HG13      ILE 830  35.432 -20.126 -12.792
    6   HG21  ILE 830          HG21      ILE 830  34.739 -22.055 -15.885
    7   HG23  ILE 830          HG22      ILE 830  34.930 -20.438 -15.206
    8   HG22  ILE 830          HG23      ILE 830  33.413 -21.310 -14.991
    9   HD13  ILE 830          HD11      ILE 830  33.438 -19.836 -11.453
   10   HD12  ILE 830          HD12      ILE 830  32.846 -21.413 -11.942
   11   HD11  ILE 830          HD13      ILE 830  32.989 -20.120 -13.133

  No H/Q in entry =          11
  In of MODEL   22
    1    H    SER 831           H        SER 831  36.582 -24.622 -13.176
    2    HA   SER 831           HA       SER 831  36.216 -24.962 -10.284
    3    HB2  SER 831           HB2      SER 831  37.567 -26.678 -12.321
    4    HB3  SER 831           HB3      SER 831  37.594 -26.961 -10.582
    5    HG   SER 831           HG       SER 831  35.094 -26.567 -11.563

  No H/Q in entry =           5
  In of MODEL   22
    1    H    VAL 832           H        VAL 832  37.578 -23.436  -9.373
    2    HA   VAL 832           HA       VAL 832  40.009 -22.674 -10.692
    3    HB   VAL 832           HB       VAL 832  39.180 -22.130  -7.829
    4   HG12  VAL 832          HG11      VAL 832  41.248 -20.767  -9.566
    5   HG11  VAL 832          HG12      VAL 832  41.583 -21.839  -8.214
    6   HG13  VAL 832          HG13      VAL 832  40.809 -20.277  -7.928
    7   HG22  VAL 832          HG21      VAL 832  37.529 -21.217  -9.369
    8   HG21  VAL 832          HG22      VAL 832  38.802 -20.407 -10.282
    9   HG23  VAL 832          HG23      VAL 832  38.455 -19.912  -8.625

  No H/Q in entry =           9
  In of MODEL   22
    1    H    THR 833           H        THR 833  41.461 -24.208 -10.916
    2    HA   THR 833           HA       THR 833  41.800 -26.206  -8.910
    3    HB   THR 833           HB       THR 833  43.461 -27.038 -10.634
    4    HG1  THR 833           HG1      THR 833  43.454 -26.031 -12.593
    5   HG22  THR 833          HG21      THR 833  41.670 -27.746 -12.195
    6   HG21  THR 833          HG22      THR 833  40.601 -26.550 -11.467
    7   HG23  THR 833          HG23      THR 833  41.180 -27.918 -10.505

  No H/Q in entry =           7
  In of MODEL   22
    1    H    SER 834           H        SER 834  43.512 -23.467 -10.271
    2    HA   SER 834           HA       SER 834  45.443 -23.649  -8.113
    3    HB2  SER 834           HB2      SER 834  46.133 -23.351 -11.023
    4    HB3  SER 834           HB3      SER 834  47.282 -23.274  -9.693
    5    HG   SER 834           HG       SER 834  45.729 -25.543  -9.657

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ILE 835           H        ILE 835  46.129 -21.672  -7.422
    2    HA   ILE 835           HA       ILE 835  44.736 -19.426  -8.557
    3    HB   ILE 835           HB       ILE 835  45.702 -18.132  -6.594
    4   HG12  ILE 835          HG12      ILE 835  46.262 -19.614  -4.598
    5   HG13  ILE 835          HG13      ILE 835  46.552 -20.908  -5.747
    6   HG23  ILE 835          HG21      ILE 835  43.445 -18.878  -6.657
    7   HG22  ILE 835          HG22      ILE 835  44.117 -19.082  -5.024
    8   HG21  ILE 835          HG23      ILE 835  43.943 -20.479  -6.096
    9   HD12  ILE 835          HD11      ILE 835  47.986 -18.298  -5.570
   10   HD11  ILE 835          HD12      ILE 835  48.317 -19.567  -6.758
   11   HD13  ILE 835          HD13      ILE 835  48.597 -19.865  -5.029

  No H/Q in entry =          11
  In of MODEL   22
    1    H    ARG 836           H        ARG 836  47.377 -20.953  -9.272
    2    HA   ARG 836           HA       ARG 836  48.982 -18.624  -9.952
    3    HB2  ARG 836           HB2      ARG 836  49.625 -21.576 -10.133
    4    HB3  ARG 836           HB3      ARG 836  50.721 -20.279 -10.595
    5    HG2  ARG 836           HG2      ARG 836  50.471 -19.427  -8.216
    6    HG3  ARG 836           HG3      ARG 836  49.687 -20.961  -7.872
    7    HD2  ARG 836           HD2      ARG 836  52.446 -20.700  -9.033
    8    HD3  ARG 836           HD3      ARG 836  52.068 -20.841  -7.322
    9    HE   ARG 836           HE       ARG 836  50.848 -22.984  -8.532
   10   HH11  ARG 836          HH11      ARG 836  54.177 -21.818  -8.408
   11   HH12  ARG 836          HH12      ARG 836  54.871 -23.363  -8.318
   12   HH21  ARG 836          HH21      ARG 836  51.775 -25.092  -8.400
   13   HH22  ARG 836          HH22      ARG 836  53.452 -25.300  -8.315

  No H/Q in entry =          13
  In of MODEL   22
    1    HA   PRO 837           HA       PRO 837  47.209 -18.698 -14.023
    2    HB2  PRO 837           HB2      PRO 837  49.268 -17.596 -15.448
    3    HB3  PRO 837           HB3      PRO 837  48.162 -16.652 -14.445
    4    HG2  PRO 837           HG2      PRO 837  50.911 -17.654 -13.805
    5    HG3  PRO 837           HG3      PRO 837  50.192 -16.068 -13.466
    6    HD2  PRO 837           HD2      PRO 837  50.398 -17.953 -11.569
    7    HD3  PRO 837           HD3      PRO 837  49.000 -16.860 -11.642

  No H/Q in entry =           7
  In of MODEL   22
    1    H    CYS 838           H        CYS 838  47.181 -20.003 -15.844
    2    HA   CYS 838           HA       CYS 838  49.204 -22.048 -15.863
    3    HB2  CYS 838           HB2      CYS 838  46.387 -21.977 -16.842
    4    HB3  CYS 838           HB3      CYS 838  47.504 -23.137 -17.550

  No H/Q in entry =           4
  In of MODEL   22
    1    H    ALA 839           H        ALA 839  49.622 -22.958 -18.177
    2    HA   ALA 839           HA       ALA 839  50.357 -20.725 -19.869
    3    HB3  ALA 839           HB1      ALA 839  51.764 -22.370 -21.057
    4    HB1  ALA 839           HB2      ALA 839  51.153 -23.646 -20.006
    5    HB2  ALA 839           HB3      ALA 839  52.135 -22.342 -19.332

  No H/Q in entry =           5
  In of MODEL   22
    1    H    ALA 840           H        ALA 840  48.125 -20.538 -20.124
    2    HA   ALA 840           HA       ALA 840  47.108 -22.078 -22.437
    3    HB3  ALA 840           HB1      ALA 840  45.870 -22.754 -20.445
    4    HB1  ALA 840           HB2      ALA 840  44.845 -21.813 -21.540
    5    HB2  ALA 840           HB3      ALA 840  45.511 -21.058 -20.092

  No H/Q in entry =           5
  In of MODEL   22
    1    H    GLU 841           H        GLU 841  48.592 -19.590 -22.196
    2    HA   GLU 841           HA       GLU 841  46.644 -17.909 -23.471
    3    HB2  GLU 841           HB2      GLU 841  47.638 -15.877 -22.409
    4    HB3  GLU 841           HB3      GLU 841  46.785 -16.925 -21.293
    5    HG2  GLU 841           HG2      GLU 841  48.896 -17.783 -20.455
    6    HG3  GLU 841           HG3      GLU 841  49.775 -16.799 -21.626

  No H/Q in entry =           6
  In of MODEL   22
    1    H    THR 842           H        THR 842  47.272 -18.046 -25.448
    2    HA   THR 842           HA       THR 842  50.023 -18.140 -26.151
    3    HB   THR 842           HB       THR 842  48.859 -17.864 -28.528
    4    HG1  THR 842           HG1      THR 842  46.800 -17.410 -27.754
    5   HG22  THR 842          HG21      THR 842  48.543 -20.301 -28.563
    6   HG21  THR 842          HG22      THR 842  48.625 -20.337 -26.801
    7   HG23  THR 842          HG23      THR 842  50.040 -19.865 -27.741

  No H/Q in entry =           7
  In of MODEL   22
    1    H    GLN 843           H        GLN 843  51.050 -16.386 -25.639
    2    HA   GLN 843           HA       GLN 843  50.103 -13.786 -26.618
    3    HB2  GLN 843           HB2      GLN 843  52.197 -14.282 -24.502
    4    HB3  GLN 843           HB3      GLN 843  51.339 -12.795 -24.840
    5    HG2  GLN 843           HG2      GLN 843  50.046 -15.274 -23.727
    6    HG3  GLN 843           HG3      GLN 843  50.640 -13.940 -22.750
    7   HE21  GLN 843          HE21      GLN 843  48.619 -13.698 -21.930
    8   HE22  GLN 843          HE22      GLN 843  47.348 -12.881 -22.779

  No H/Q in entry =           8
  In of MODEL   23
    1    H1   GLY 689           H3       GLY 689  57.639  13.344 -27.675
    2    H2   GLY 689           H2       GLY 689  56.744  11.933 -27.878
    3    H3   GLY 689           H1       GLY 689  57.615  12.544 -29.175
    4    HA2  GLY 689           HA2      GLY 689  55.242  12.951 -29.328
    5    HA3  GLY 689           HA3      GLY 689  56.158  14.458 -29.236

  No H/Q in entry =           5
  In of MODEL   23
    1    H    SER 690           H        SER 690  56.196  15.629 -27.314
    2    HA   SER 690           HA       SER 690  55.347  16.574 -25.507
    3    HB2  SER 690           HB2      SER 690  52.902  15.010 -26.329
    4    HB3  SER 690           HB3      SER 690  52.893  16.297 -25.114
    5    HG   SER 690           HG       SER 690  54.032  16.760 -27.626

  No H/Q in entry =           5
  In of MODEL   23
    1    H    HIS 691           H        HIS 691  53.320  15.276 -23.688
    2    HA   HIS 691           HA       HIS 691  53.281  14.202 -21.786
    3    HB2  HIS 691           HB2      HIS 691  55.324  12.319 -23.031
    4    HB3  HIS 691           HB3      HIS 691  54.582  12.051 -21.460
    5    HD1  HIS 691           HD1      HIS 691  52.277  10.899 -21.457
    6    HD2  HIS 691           HD2      HIS 691  53.500  12.093 -25.255
    7    HE1  HIS 691           HE1      HIS 691  50.628   9.916 -23.034
    8    HE2  HIS 691           HE2      HIS 691  51.535  10.402 -25.302

  No H/Q in entry =           8
  In of MODEL   23
    1    H    MET 692           H        MET 692  53.906  15.928 -20.752
    2    HA   MET 692           HA       MET 692  56.562  16.884 -20.501
    3    HB2  MET 692           HB2      MET 692  54.238  17.328 -18.614
    4    HB3  MET 692           HB3      MET 692  55.701  18.289 -18.688
    5    HG2  MET 692           HG2      MET 692  53.603  18.073 -20.837
    6    HG3  MET 692           HG3      MET 692  53.839  19.429 -19.739
    7    HE3  MET 692           HE1      MET 692  57.306  20.839 -20.936
    8    HE2  MET 692           HE2      MET 692  57.061  19.628 -19.683
    9    HE1  MET 692           HE3      MET 692  55.978  21.017 -19.788

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ASN 693           H        ASN 693  54.541  14.844 -18.567
    2    HA   ASN 693           HA       ASN 693  56.691  14.312 -16.678
    3    HB2  ASN 693           HB2      ASN 693  53.798  13.402 -16.754
    4    HB3  ASN 693           HB3      ASN 693  54.941  12.984 -15.484
    5   HD21  ASN 693          HD21      ASN 693  53.003  15.522 -16.895
    6   HD22  ASN 693          HD22      ASN 693  53.196  16.640 -15.595

  No H/Q in entry =           6
  In of MODEL   23
    1    HA   PRO 694           HA       PRO 694  57.650  10.799 -19.314
    2    HB2  PRO 694           HB2      PRO 694  59.348   9.952 -17.060
    3    HB3  PRO 694           HB3      PRO 694  59.800  10.306 -18.731
    4    HG2  PRO 694           HG2      PRO 694  60.445  11.949 -16.724
    5    HG3  PRO 694           HG3      PRO 694  60.011  12.571 -18.329
    6    HD2  PRO 694           HD2      PRO 694  58.365  12.446 -15.829
    7    HD3  PRO 694           HD3      PRO 694  58.505  13.733 -17.053

  No H/Q in entry =           7
  In of MODEL   23
    1    H    LEU 695           H        LEU 695  56.098   9.350 -19.410
    2    HA   LEU 695           HA       LEU 695  55.725   7.607 -17.101
    3    HB2  LEU 695           HB2      LEU 695  53.553   8.677 -18.891
    4    HB3  LEU 695           HB3      LEU 695  53.332   7.337 -17.788
    5    HG   LEU 695           HG       LEU 695  53.980  10.182 -17.012
    6   HD13  LEU 695          HD11      LEU 695  51.718   9.932 -17.802
    7   HD12  LEU 695          HD12      LEU 695  51.722  10.131 -16.046
    8   HD11  LEU 695          HD13      LEU 695  51.479   8.536 -16.754
    9   HD21  LEU 695          HD21      LEU 695  53.438   7.757 -15.291
   10   HD23  LEU 695          HD22      LEU 695  53.594   9.415 -14.714
   11   HD22  LEU 695          HD23      LEU 695  54.980   8.607 -15.436

  No H/Q in entry =          11
  In of MODEL   23
    1    H    THR 696           H        THR 696  57.011   6.056 -17.849
    2    HA   THR 696           HA       THR 696  56.515   4.920 -20.439
    3    HB   THR 696           HB       THR 696  58.297   3.299 -19.647
    4    HG1  THR 696           HG1      THR 696  57.730   3.836 -17.384
    5   HG22  THR 696          HG21      THR 696  58.981   6.234 -19.476
    6   HG21  THR 696          HG22      THR 696  58.842   5.295 -20.965
    7   HG23  THR 696          HG23      THR 696  60.122   4.923 -19.805

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLN 697           H        GLN 697  54.603   3.890 -20.462
    2    HA   GLN 697           HA       GLN 697  53.776   2.440 -18.137
    3    HB2  GLN 697           HB2      GLN 697  52.144   3.789 -19.345
    4    HB3  GLN 697           HB3      GLN 697  52.411   2.840 -20.793
    5    HG2  GLN 697           HG2      GLN 697  51.396   0.931 -19.846
    6    HG3  GLN 697           HG3      GLN 697  51.397   1.649 -18.231
    7   HE21  GLN 697          HE21      GLN 697  49.951   3.215 -17.738
    8   HE22  GLN 697          HE22      GLN 697  48.585   3.588 -18.712

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ALA 698           H        ALA 698  54.982   0.690 -17.911
    2    HA   ALA 698           HA       ALA 698  54.867  -1.339 -19.982
    3    HB2  ALA 698           HB1      ALA 698  57.267  -1.812 -19.699
    4    HB3  ALA 698           HB2      ALA 698  57.410  -0.405 -18.644
    5    HB1  ALA 698           HB3      ALA 698  56.995  -0.192 -20.344

  No H/Q in entry =           5
  In of MODEL   23
    1    H    VAL 699           H        VAL 699  54.955  -3.389 -19.132
    2    HA   VAL 699           HA       VAL 699  54.112  -3.675 -16.414
    3    HB   VAL 699           HB       VAL 699  54.899  -5.839 -18.394
    4   HG12  VAL 699          HG11      VAL 699  53.167  -5.997 -15.927
    5   HG11  VAL 699          HG12      VAL 699  54.793  -6.651 -16.107
    6   HG13  VAL 699          HG13      VAL 699  53.467  -7.314 -17.063
    7   HG22  VAL 699          HG21      VAL 699  53.154  -4.449 -19.354
    8   HG21  VAL 699          HG22      VAL 699  52.183  -4.620 -17.894
    9   HG23  VAL 699          HG23      VAL 699  52.500  -6.028 -18.913

  No H/Q in entry =           9
  In of MODEL   23
    1    HA   PRO 700           HA       PRO 700  58.341  -4.062 -14.971
    2    HB2  PRO 700           HB2      PRO 700  57.777  -4.624 -12.373
    3    HB3  PRO 700           HB3      PRO 700  57.696  -2.988 -13.041
    4    HG2  PRO 700           HG2      PRO 700  55.492  -4.928 -12.506
    5    HG3  PRO 700           HG3      PRO 700  55.545  -3.175 -12.233
    6    HD2  PRO 700           HD2      PRO 700  54.301  -4.297 -14.377
    7    HD3  PRO 700           HD3      PRO 700  55.052  -2.684 -14.419

  No H/Q in entry =           7
  In of MODEL   23
    1    H    LYS 701           H        LYS 701  59.605  -5.740 -13.857
    2    HA   LYS 701           HA       LYS 701  58.764  -8.370 -14.767
    3    HB2  LYS 701           HB2      LYS 701  61.394  -7.417 -13.621
    4    HB3  LYS 701           HB3      LYS 701  61.102  -9.018 -14.277
    5    HG2  LYS 701           HG2      LYS 701  60.930  -6.437 -15.836
    6    HG3  LYS 701           HG3      LYS 701  62.287  -7.558 -15.854
    7    HD2  LYS 701           HD2      LYS 701  59.468  -8.247 -16.719
    8    HD3  LYS 701           HD3      LYS 701  60.767  -7.789 -17.813
    9    HE2  LYS 701           HE2      LYS 701  62.073  -9.725 -17.103
   10    HE3  LYS 701           HE3      LYS 701  60.804 -10.184 -15.971
   11    HZ2  LYS 701           HZ1      LYS 701  60.719 -11.444 -18.030
   12    HZ1  LYS 701           HZ2      LYS 701  60.471 -10.020 -18.918
   13    HZ3  LYS 701           HZ3      LYS 701  59.319 -10.532 -17.813

  No H/Q in entry =          13
  In of MODEL   23
    1    H    CYS 702           H        CYS 702  57.557  -7.148 -12.455
    2    HA   CYS 702           HA       CYS 702  58.466  -8.905 -10.292
    3    HB2  CYS 702           HB2      CYS 702  56.430  -6.697  -9.958
    4    HB3  CYS 702           HB3      CYS 702  57.502  -7.407  -8.782

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLN 703           H        GLN 703  56.905 -10.222  -9.314
    2    HA   GLN 703           HA       GLN 703  54.908 -11.144 -11.148
    3    HB2  GLN 703           HB2      GLN 703  55.571 -11.986  -8.336
    4    HB3  GLN 703           HB3      GLN 703  54.470 -12.832  -9.407
    5    HG2  GLN 703           HG2      GLN 703  57.409 -12.409  -9.932
    6    HG3  GLN 703           HG3      GLN 703  56.693 -13.888  -9.292
    7   HE21  GLN 703          HE21      GLN 703  57.159 -11.914 -12.090
    8   HE22  GLN 703          HE22      GLN 703  56.573 -13.051 -13.247

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ARG 704           H        ARG 704  52.739 -11.755 -10.069
    2    HA   ARG 704           HA       ARG 704  51.248  -9.392  -9.814
    3    HB2  ARG 704           HB2      ARG 704  50.552 -12.251  -9.231
    4    HB3  ARG 704           HB3      ARG 704  49.381 -10.955  -9.058
    5    HG2  ARG 704           HG2      ARG 704  50.866 -11.497 -11.606
    6    HG3  ARG 704           HG3      ARG 704  49.306 -12.223 -11.215
    7    HD2  ARG 704           HD2      ARG 704  48.284 -10.035 -11.076
    8    HD3  ARG 704           HD3      ARG 704  49.835  -9.261 -11.288
    9    HE   ARG 704           HE       ARG 704  49.769 -10.605 -13.529
   10   HH11  ARG 704          HH11      ARG 704  46.956  -8.961 -12.061
   11   HH12  ARG 704          HH12      ARG 704  46.362  -8.417 -13.551
   12   HH21  ARG 704          HH21      ARG 704  48.896  -9.875 -15.540
   13   HH22  ARG 704          HH22      ARG 704  47.489  -8.923 -15.573

  No H/Q in entry =          13
  In of MODEL   23
    1    H    TRP 705           H        TRP 705  52.663 -11.373  -7.354
    2    HA   TRP 705           HA       TRP 705  51.224 -10.016  -5.209
    3    HB2  TRP 705           HB2      TRP 705  52.402 -11.702  -3.790
    4    HB3  TRP 705           HB3      TRP 705  51.339 -12.395  -5.006
    5    HD1  TRP 705           HD1      TRP 705  54.981 -12.125  -4.027
    6    HE1  TRP 705           HE1      TRP 705  56.348 -13.799  -5.375
    7    HE3  TRP 705           HE3      TRP 705  51.373 -13.609  -7.319
    8    HZ2  TRP 705           HZ2      TRP 705  55.948 -15.547  -7.595
    9    HZ3  TRP 705           HZ3      TRP 705  51.947 -15.279  -9.028
   10    HH2  TRP 705           HH2      TRP 705  54.186 -16.229  -9.158

  No H/Q in entry =          10
  In of MODEL   23
    1    H    GLU 706           H        GLU 706  53.690  -9.229  -7.063
    2    HA   GLU 706           HA       GLU 706  55.300  -8.141  -4.888
    3    HB2  GLU 706           HB2      GLU 706  56.070  -8.801  -7.728
    4    HB3  GLU 706           HB3      GLU 706  57.094  -7.915  -6.605
    5    HG2  GLU 706           HG2      GLU 706  57.097  -9.926  -5.156
    6    HG3  GLU 706           HG3      GLU 706  56.189 -10.775  -6.410

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LYS 707           H        LYS 707  56.126  -6.083  -5.246
    2    HA   LYS 707           HA       LYS 707  54.703  -4.436  -7.187
    3    HB2  LYS 707           HB2      LYS 707  54.515  -2.628  -5.511
    4    HB3  LYS 707           HB3      LYS 707  53.594  -4.040  -5.017
    5    HG2  LYS 707           HG2      LYS 707  55.227  -4.637  -3.387
    6    HG3  LYS 707           HG3      LYS 707  56.367  -3.454  -4.013
    7    HD2  LYS 707           HD2      LYS 707  53.739  -2.836  -2.650
    8    HD3  LYS 707           HD3      LYS 707  55.340  -2.681  -1.925
    9    HE2  LYS 707           HE2      LYS 707  55.887  -1.084  -3.827
   10    HE3  LYS 707           HE3      LYS 707  54.164  -1.087  -4.193
   11    HZ2  LYS 707           HZ1      LYS 707  55.442  -0.220  -1.676
   12    HZ1  LYS 707           HZ2      LYS 707  53.767  -0.274  -1.910
   13    HZ3  LYS 707           HZ3      LYS 707  54.720   0.777  -2.831

  No H/Q in entry =          13
  In of MODEL   23
    1    H    LEU 708           H        LEU 708  56.011  -2.664  -7.925
    2    HA   LEU 708           HA       LEU 708  58.796  -3.144  -7.340
    3    HB2  LEU 708           HB2      LEU 708  58.004  -3.266  -9.708
    4    HB3  LEU 708           HB3      LEU 708  57.598  -1.564  -9.618
    5    HG   LEU 708           HG       LEU 708  60.369  -2.439  -9.014
    6   HD12  LEU 708          HD11      LEU 708  60.928  -2.170 -11.431
    7   HD11  LEU 708          HD12      LEU 708  59.201  -1.995 -11.778
    8   HD13  LEU 708          HD13      LEU 708  59.828  -3.516 -11.145
    9   HD22  LEU 708          HD21      LEU 708  60.955  -0.255  -9.972
   10   HD21  LEU 708          HD22      LEU 708  59.795  -0.107  -8.652
   11   HD23  LEU 708          HD23      LEU 708  59.251   0.029 -10.326

  No H/Q in entry =          11
  In of MODEL   23
    1    H    GLN 709           H        GLN 709  59.735  -1.908  -6.004
    2    HA   GLN 709           HA       GLN 709  59.242   0.935  -5.978
    3    HB2  GLN 709           HB2      GLN 709  58.870   1.090  -3.616
    4    HB3  GLN 709           HB3      GLN 709  57.753  -0.139  -4.192
    5    HG2  GLN 709           HG2      GLN 709  59.268  -1.889  -3.434
    6    HG3  GLN 709           HG3      GLN 709  60.388  -0.656  -2.849
    7   HE21  GLN 709          HE21      GLN 709  60.252  -1.390  -0.746
    8   HE22  GLN 709          HE22      GLN 709  58.853  -1.126   0.220

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ASN 710           H        ASN 710  61.079   2.003  -5.113
    2    HA   ASN 710           HA       ASN 710  63.289   2.306  -4.592
    3    HB2  ASN 710           HB2      ASN 710  62.530   0.729  -2.697
    4    HB3  ASN 710           HB3      ASN 710  63.257  -0.570  -3.607
    5   HD21  ASN 710          HD21      ASN 710  63.815   2.187  -1.697
    6   HD22  ASN 710          HD22      ASN 710  65.509   1.973  -1.409

  No H/Q in entry =           6
  In of MODEL   23
    1    H    SER 711           H        SER 711  62.296   1.168  -7.113
    2    HA   SER 711           HA       SER 711  63.027   0.523  -9.127
    3    HB2  SER 711           HB2      SER 711  64.963   1.998  -8.711
    4    HB3  SER 711           HB3      SER 711  65.796   0.693  -7.876
    5    HG   SER 711           HG       SER 711  65.584  -0.468  -9.895

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ARG 712           H        ARG 712  62.538  -1.487  -6.843
    2    HA   ARG 712           HA       ARG 712  63.622  -3.797  -8.264
    3    HB2  ARG 712           HB2      ARG 712  64.212  -4.867  -6.131
    4    HB3  ARG 712           HB3      ARG 712  65.165  -3.420  -6.429
    5    HG2  ARG 712           HG2      ARG 712  63.693  -2.164  -4.908
    6    HG3  ARG 712           HG3      ARG 712  62.780  -3.639  -4.631
    7    HD2  ARG 712           HD2      ARG 712  64.701  -4.709  -3.659
    8    HD3  ARG 712           HD3      ARG 712  65.707  -3.306  -4.035
    9    HE   ARG 712           HE       ARG 712  63.883  -2.165  -2.571
   10   HH11  ARG 712          HH11      ARG 712  65.582  -5.215  -1.966
   11   HH12  ARG 712          HH12      ARG 712  65.433  -5.104  -0.272
   12   HH21  ARG 712          HH21      ARG 712  63.730  -2.021  -0.215
   13   HH22  ARG 712          HH22      ARG 712  64.409  -3.261   0.724

  No H/Q in entry =          13
  In of MODEL   23
    1    H    CYS 713           H        CYS 713  62.568  -5.838  -7.426
    2    HA   CYS 713           HA       CYS 713  59.710  -5.344  -7.095
    3    HB2  CYS 713           HB2      CYS 713  61.197  -7.860  -7.872
    4    HB3  CYS 713           HB3      CYS 713  59.446  -7.671  -7.849

  No H/Q in entry =           4
  In of MODEL   23
    1    H    VAL 714           H        VAL 714  58.951  -5.501  -5.113
    2    HA   VAL 714           HA       VAL 714  60.156  -7.439  -3.257
    3    HB   VAL 714           HB       VAL 714  59.517  -5.961  -1.380
    4   HG13  VAL 714          HG11      VAL 714  61.202  -4.203  -1.689
    5   HG12  VAL 714          HG12      VAL 714  61.245  -4.566  -3.414
    6   HG11  VAL 714          HG13      VAL 714  61.777  -5.775  -2.245
    7   HG23  VAL 714          HG21      VAL 714  58.829  -3.624  -1.793
    8   HG22  VAL 714          HG22      VAL 714  57.647  -4.784  -2.396
    9   HG21  VAL 714          HG23      VAL 714  58.733  -3.973  -3.520

  No H/Q in entry =           9
  In of MODEL   23
    1    H    CYS 715           H        CYS 715  58.414  -7.965  -1.465
    2    HA   CYS 715           HA       CYS 715  56.110  -8.858  -3.004
    3    HB2  CYS 715           HB2      CYS 715  56.634  -9.394  -0.080
    4    HB3  CYS 715           HB3      CYS 715  55.684 -10.347  -1.206

  No H/Q in entry =           4
  In of MODEL   23
    1    H    LYS 716           H        LYS 716  53.972  -8.306  -2.466
    2    HA   LYS 716           HA       LYS 716  53.464  -5.820  -1.178
    3    HB2  LYS 716           HB2      LYS 716  51.590  -8.093  -1.920
    4    HB3  LYS 716           HB3      LYS 716  51.062  -6.533  -1.321
    5    HG2  LYS 716           HG2      LYS 716  51.765  -5.432  -3.309
    6    HG3  LYS 716           HG3      LYS 716  52.666  -6.851  -3.851
    7    HD2  LYS 716           HD2      LYS 716  50.547  -6.629  -5.086
    8    HD3  LYS 716           HD3      LYS 716  50.572  -8.096  -4.122
    9    HE2  LYS 716           HE2      LYS 716  48.404  -7.151  -3.885
   10    HE3  LYS 716           HE3      LYS 716  49.241  -6.845  -2.373
   11    HZ3  LYS 716           HZ1      LYS 716  48.149  -4.854  -2.929
   12    HZ2  LYS 716           HZ2      LYS 716  48.569  -4.964  -4.533
   13    HZ1  LYS 716           HZ3      LYS 716  49.731  -4.525  -3.431

  No H/Q in entry =          13
  In of MODEL   23
    1    H    MET 717           H        MET 717  51.779  -5.803   0.667
    2    HA   MET 717           HA       MET 717  52.723  -7.594   2.805
    3    HB2  MET 717           HB2      MET 717  51.067  -5.053   2.959
    4    HB3  MET 717           HB3      MET 717  51.684  -5.948   4.324
    5    HG2  MET 717           HG2      MET 717  53.571  -4.772   2.321
    6    HG3  MET 717           HG3      MET 717  52.837  -3.756   3.547
    7    HE2  MET 717           HE1      MET 717  55.904  -7.133   4.381
    8    HE1  MET 717           HE2      MET 717  55.264  -6.735   2.780
    9    HE3  MET 717           HE3      MET 717  54.257  -7.569   3.967

  No H/Q in entry =           9
  In of MODEL   23
    1    HA   PRO 718           HA       PRO 718  48.913  -9.912   2.662
    2    HB2  PRO 718           HB2      PRO 718  48.291 -10.138   5.368
    3    HB3  PRO 718           HB3      PRO 718  49.407 -11.190   4.497
    4    HG2  PRO 718           HG2      PRO 718  49.989  -8.831   6.233
    5    HG3  PRO 718           HG3      PRO 718  50.870 -10.362   6.096
    6    HD2  PRO 718           HD2      PRO 718  51.784  -8.115   4.950
    7    HD3  PRO 718           HD3      PRO 718  51.973  -9.698   4.165

  No H/Q in entry =           7
  In of MODEL   23
    1    H    TYR 719           H        TYR 719  48.941  -7.115   4.743
    2    HA   TYR 719           HA       TYR 719  46.076  -6.754   4.678
    3    HB2  TYR 719           HB2      TYR 719  46.554  -4.758   6.081
    4    HB3  TYR 719           HB3      TYR 719  47.238  -6.247   6.717
    5    HD1  TYR 719           HD1      TYR 719  47.916  -2.931   5.537
    6    HD2  TYR 719           HD2      TYR 719  49.729  -6.645   6.511
    7    HE1  TYR 719           HE1      TYR 719  50.086  -1.811   5.744
    8    HE2  TYR 719           HE2      TYR 719  51.906  -5.524   6.736
    9    HH   TYR 719           HH       TYR 719  52.182  -2.160   6.883

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLU 720           H        GLU 720  48.600  -6.034   2.702
    2    HA   GLU 720           HA       GLU 720  47.482  -3.606   1.495
    3    HB2  GLU 720           HB2      GLU 720  49.897  -3.680   2.014
    4    HB3  GLU 720           HB3      GLU 720  50.062  -5.172   1.106
    5    HG2  GLU 720           HG2      GLU 720  50.997  -3.339  -0.121
    6    HG3  GLU 720           HG3      GLU 720  49.550  -3.914  -0.947

  No H/Q in entry =           6
  In of MODEL   23
    1    H    CYS 721           H        CYS 721  46.554  -6.522   1.535
    2    HA   CYS 721           HA       CYS 721  46.297  -6.847  -1.331
    3    HB2  CYS 721           HB2      CYS 721  47.909  -8.500   0.219
    4    HB3  CYS 721           HB3      CYS 721  46.366  -9.345   0.127

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLY 722           H        GLY 722  44.263  -7.244  -1.907
    2    HA3  GLY 722           HA2      GLY 722  42.379  -8.342   0.001
    3    HA2  GLY 722           HA3      GLY 722  42.063  -6.698  -0.541

  No H/Q in entry =           3
  In of MODEL   23
    1    HA   PRO 723           HA       PRO 723  39.928  -7.919  -4.183
    2    HB2  PRO 723           HB2      PRO 723  41.984  -6.518  -5.823
    3    HB3  PRO 723           HB3      PRO 723  40.223  -6.350  -5.835
    4    HG2  PRO 723           HG2      PRO 723  41.728  -4.498  -4.691
    5    HG3  PRO 723           HG3      PRO 723  40.202  -5.013  -3.947
    6    HD2  PRO 723           HD2      PRO 723  43.004  -5.697  -3.189
    7    HD3  PRO 723           HD3      PRO 723  41.598  -5.395  -2.153

  No H/Q in entry =           7
  In of MODEL   23
    1    H    SER 724           H        SER 724  40.226 -10.086  -4.276
    2    HA   SER 724           HA       SER 724  41.534 -11.212  -6.471
    3    HB2  SER 724           HB2      SER 724  43.023 -12.724  -5.098
    4    HB3  SER 724           HB3      SER 724  43.558 -11.049  -5.224
    5    HG   SER 724           HG       SER 724  42.399 -10.793  -3.163

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU 725           H        LEU 725  41.242 -13.625  -6.378
    2    HA   LEU 725           HA       LEU 725  38.548 -14.096  -5.508
    3    HB2  LEU 725           HB2      LEU 725  40.457 -15.551  -7.117
    4    HB3  LEU 725           HB3      LEU 725  39.262 -16.530  -6.272
    5    HG   LEU 725           HG       LEU 725  38.248 -16.179  -8.242
    6   HD13  LEU 725          HD11      LEU 725  36.483 -14.739  -8.153
    7   HD12  LEU 725          HD12      LEU 725  37.265 -13.785  -6.931
    8   HD11  LEU 725          HD13      LEU 725  36.748 -15.457  -6.549
    9   HD22  LEU 725          HD21      LEU 725  38.229 -14.223  -9.578
   10   HD21  LEU 725          HD22      LEU 725  39.852 -14.840  -9.276
   11   HD23  LEU 725          HD23      LEU 725  39.231 -13.423  -8.371

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ASP 726           H        ASP 726  37.737 -15.331  -3.996
    2    HA   ASP 726           HA       ASP 726  39.325 -15.933  -1.714
    3    HB2  ASP 726           HB2      ASP 726  37.091 -16.752  -0.836
    4    HB3  ASP 726           HB3      ASP 726  37.197 -15.054  -1.251

  No H/Q in entry =           4
  In of MODEL   23
    1    H    VAL 727           H        VAL 727  40.070 -17.796  -1.061
    2    HA   VAL 727           HA       VAL 727  39.101 -20.211  -2.312
    3    HB   VAL 727           HB       VAL 727  41.501 -21.082  -2.607
    4   HG13  VAL 727          HG11      VAL 727  40.185 -20.454  -4.566
    5   HG12  VAL 727          HG12      VAL 727  41.863 -19.977  -4.805
    6   HG11  VAL 727          HG13      VAL 727  40.663 -18.772  -4.364
    7   HG22  VAL 727          HG21      VAL 727  43.275 -19.408  -2.911
    8   HG21  VAL 727          HG22      VAL 727  42.670 -19.436  -1.251
    9   HG23  VAL 727          HG23      VAL 727  42.173 -18.151  -2.350

  No H/Q in entry =           9
  In of MODEL   23
    1    H    CYS 728           H        CYS 728  39.705 -22.247  -1.054
    2    HA   CYS 728           HA       CYS 728  40.243 -21.641   1.765
    3    HB2  CYS 728           HB2      CYS 728  39.310 -24.225   0.476
    4    HB3  CYS 728           HB3      CYS 728  39.543 -23.969   2.192

  No H/Q in entry =           4
  In of MODEL   23
    1    H    ALA 729           H        ALA 729  42.197 -22.057   2.574
    2    HA   ALA 729           HA       ALA 729  43.914 -23.834   1.024
    3    HB1  ALA 729           HB1      ALA 729  44.683 -21.268   2.362
    4    HB3  ALA 729           HB2      ALA 729  44.507 -21.519   0.620
    5    HB2  ALA 729           HB3      ALA 729  45.772 -22.363   1.511

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLN 730           H        GLN 730  45.465 -24.857   2.178
    2    HA   GLN 730           HA       GLN 730  44.810 -25.261   4.995
    3    HB2  GLN 730           HB2      GLN 730  44.738 -27.271   3.521
    4    HB3  GLN 730           HB3      GLN 730  46.427 -27.004   3.146
    5    HG2  GLN 730           HG2      GLN 730  47.090 -27.390   5.381
    6    HG3  GLN 730           HG3      GLN 730  45.429 -27.468   5.944
    7   HE21  GLN 730          HE21      GLN 730  45.570 -29.557   6.734
    8   HE22  GLN 730          HE22      GLN 730  45.804 -30.929   5.718

  No H/Q in entry =           8
  In of MODEL   23
    1    H    ASP 731           H        ASP 731  46.114 -24.579   6.414
    2    HA   ASP 731           HA       ASP 731  48.547 -23.219   5.814
    3    HB2  ASP 731           HB2      ASP 731  47.210 -22.453   7.669
    4    HB3  ASP 731           HB3      ASP 731  47.213 -24.055   8.376

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLU 732           H        GLU 732  50.548 -24.130   5.666
    2    HA   GLU 732           HA       GLU 732  50.809 -26.936   5.975
    3    HB2  GLU 732           HB2      GLU 732  52.815 -24.803   5.293
    4    HB3  GLU 732           HB3      GLU 732  53.291 -26.464   5.593
    5    HG2  GLU 732           HG2      GLU 732  51.254 -25.661   3.549
    6    HG3  GLU 732           HG3      GLU 732  52.969 -25.913   3.211

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ARG 733           H        ARG 733  51.184 -24.420   8.221
    2    HA   ARG 733           HA       ARG 733  53.182 -25.816   9.735
    3    HB2  ARG 733           HB2      ARG 733  53.008 -23.309   9.669
    4    HB3  ARG 733           HB3      ARG 733  51.530 -23.451  10.612
    5    HG2  ARG 733           HG2      ARG 733  53.333 -22.906  12.083
    6    HG3  ARG 733           HG3      ARG 733  52.836 -24.574  12.398
    7    HD2  ARG 733           HD2      ARG 733  54.684 -25.346  10.924
    8    HD3  ARG 733           HD3      ARG 733  55.217 -23.673  10.775
    9    HE   ARG 733           HE       ARG 733  55.013 -24.424  13.475
   10   HH11  ARG 733          HH11      ARG 733  57.120 -24.695  10.647
   11   HH12  ARG 733          HH12      ARG 733  58.478 -25.245  11.514
   12   HH21  ARG 733          HH21      ARG 733  56.871 -25.205  14.675
   13   HH22  ARG 733          HH22      ARG 733  58.341 -25.533  13.859

  No H/Q in entry =          13
  In of MODEL   23
    1    H    SER 734           H        SER 734  49.780 -24.938  10.345
    2    HA   SER 734           HA       SER 734  49.719 -26.870  12.539
    3    HB2  SER 734           HB2      SER 734  47.600 -24.901  11.721
    4    HB3  SER 734           HB3      SER 734  47.801 -25.701  13.281
    5    HG   SER 734           HG       SER 734  49.212 -23.568  12.163

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LYS 735           H        LYS 735  48.857 -26.696   9.245
    2    HA   LYS 735           HA       LYS 735  47.711 -27.911   7.845
    3    HB2  LYS 735           HB2      LYS 735  47.763 -29.942  10.062
    4    HB3  LYS 735           HB3      LYS 735  47.107 -30.284   8.467
    5    HG2  LYS 735           HG2      LYS 735  49.948 -29.575   9.165
    6    HG3  LYS 735           HG3      LYS 735  49.350 -31.123   8.560
    7    HD2  LYS 735           HD2      LYS 735  48.578 -29.812   6.495
    8    HD3  LYS 735           HD3      LYS 735  49.550 -28.495   7.119
    9    HE2  LYS 735           HE2      LYS 735  50.565 -31.234   6.383
   10    HE3  LYS 735           HE3      LYS 735  50.817 -29.743   5.482
   11    HZ3  LYS 735           HZ1      LYS 735  52.748 -30.253   6.758
   12    HZ2  LYS 735           HZ2      LYS 735  51.876 -30.407   8.168
   13    HZ1  LYS 735           HZ3      LYS 735  52.057 -28.886   7.463

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ARG 736           H        ARG 736  46.260 -26.061   9.459
    2    HA   ARG 736           HA       ARG 736  43.591 -27.281   9.502
    3    HB2  ARG 736           HB2      ARG 736  42.821 -25.241  10.552
    4    HB3  ARG 736           HB3      ARG 736  44.178 -25.904  11.450
    5    HG2  ARG 736           HG2      ARG 736  45.615 -24.240  10.752
    6    HG3  ARG 736           HG3      ARG 736  44.595 -23.798   9.382
    7    HD2  ARG 736           HD2      ARG 736  43.898 -23.401  12.282
    8    HD3  ARG 736           HD3      ARG 736  44.530 -22.191  11.150
    9    HE   ARG 736           HE       ARG 736  42.190 -23.403  10.112
   10   HH11  ARG 736          HH11      ARG 736  43.175 -20.951  12.478
   11   HH12  ARG 736          HH12      ARG 736  41.716 -20.090  12.399
   12   HH21  ARG 736          HH21      ARG 736  40.204 -22.209   9.987
   13   HH22  ARG 736          HH22      ARG 736  39.980 -20.821  10.937

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ILE 737           H        ILE 737  41.851 -26.188   8.348
    2    HA   ILE 737           HA       ILE 737  42.817 -25.038   5.863
    3    HB   ILE 737           HB       ILE 737  39.949 -25.616   6.618
    4   HG12  ILE 737          HG12      ILE 737  41.282 -27.715   6.903
    5   HG13  ILE 737          HG13      ILE 737  40.121 -27.821   5.588
    6   HG21  ILE 737          HG21      ILE 737  40.455 -24.182   4.680
    7   HG23  ILE 737          HG22      ILE 737  39.608 -25.660   4.235
    8   HG22  ILE 737          HG23      ILE 737  41.345 -25.516   3.943
    9   HD12  ILE 737          HD11      ILE 737  43.082 -27.348   5.320
   10   HD11  ILE 737          HD12      ILE 737  41.915 -27.415   3.999
   11   HD13  ILE 737          HD13      ILE 737  42.218 -28.854   4.976

  No H/Q in entry =          11
  In of MODEL   23
    1    H    LEU 738           H        LEU 738  42.618 -22.901   5.508
    2    HA   LEU 738           HA       LEU 738  40.673 -21.458   7.064
    3    HB2  LEU 738           HB2      LEU 738  42.168 -19.511   7.405
    4    HB3  LEU 738           HB3      LEU 738  42.696 -20.930   8.272
    5    HG   LEU 738           HG       LEU 738  43.944 -19.980   5.682
    6   HD11  LEU 738          HD11      LEU 738  44.189 -18.308   7.467
    7   HD13  LEU 738          HD12      LEU 738  45.727 -19.093   7.106
    8   HD12  LEU 738          HD13      LEU 738  44.814 -19.553   8.545
    9   HD22  LEU 738          HD21      LEU 738  44.183 -22.294   6.216
   10   HD21  LEU 738          HD22      LEU 738  44.782 -21.887   7.821
   11   HD23  LEU 738          HD23      LEU 738  45.750 -21.482   6.380

  No H/Q in entry =          11
  In of MODEL   23
    1    HA   PRO 739           HA       PRO 739  39.577 -19.652   3.236
    2    HB2  PRO 739           HB2      PRO 739  38.327 -17.432   4.140
    3    HB3  PRO 739           HB3      PRO 739  37.622 -19.046   4.320
    4    HG2  PRO 739           HG2      PRO 739  39.103 -17.398   6.338
    5    HG3  PRO 739           HG3      PRO 739  37.639 -18.377   6.551
    6    HD2  PRO 739           HD2      PRO 739  40.169 -19.304   7.245
    7    HD3  PRO 739           HD3      PRO 739  38.829 -20.344   6.709

  No H/Q in entry =           7
  In of MODEL   23
    1    H    LEU 740           H        LEU 740  41.055 -18.801   1.981
    2    HA   LEU 740           HA       LEU 740  42.379 -16.323   2.799
    3    HB2  LEU 740           HB2      LEU 740  43.463 -18.624   1.211
    4    HB3  LEU 740           HB3      LEU 740  44.202 -17.048   1.187
    5    HG   LEU 740           HG       LEU 740  43.988 -18.919   3.532
    6   HD11  LEU 740          HD11      LEU 740  46.279 -17.886   1.870
    7   HD13  LEU 740          HD12      LEU 740  45.616 -19.510   1.846
    8   HD12  LEU 740          HD13      LEU 740  46.435 -18.917   3.299
    9   HD23  LEU 740          HD21      LEU 740  45.350 -17.239   4.727
   10   HD22  LEU 740          HD22      LEU 740  43.758 -16.611   4.320
   11   HD21  LEU 740          HD23      LEU 740  45.162 -16.132   3.364

  No H/Q in entry =          11
  In of MODEL   23
    1    H    THR 741           H        THR 741  43.459 -15.538   0.576
    2    HA   THR 741           HA       THR 741  41.464 -15.632  -1.523
    3    HB   THR 741           HB       THR 741  42.807 -13.035  -0.974
    4    HG1  THR 741           HG1      THR 741  41.160 -14.341   0.878
    5   HG21  THR 741          HG21      THR 741  41.094 -13.294  -2.713
    6   HG23  THR 741          HG22      THR 741  40.593 -12.135  -1.485
    7   HG22  THR 741          HG23      THR 741  39.922 -13.766  -1.482

  No H/Q in entry =           7
  In of MODEL   23
    1    H    VAL 742           H        VAL 742  42.534 -15.315  -3.570
    2    HA   VAL 742           HA       VAL 742  44.878 -16.625  -4.039
    3    HB   VAL 742           HB       VAL 742  43.861 -14.345  -5.668
    4   HG13  VAL 742          HG11      VAL 742  45.987 -14.666  -6.385
    5   HG12  VAL 742          HG12      VAL 742  44.936 -15.409  -7.588
    6   HG11  VAL 742          HG13      VAL 742  45.836 -16.415  -6.428
    7   HG21  VAL 742          HG21      VAL 742  43.224 -17.250  -5.811
    8   HG23  VAL 742          HG22      VAL 742  42.847 -16.058  -7.066
    9   HG22  VAL 742          HG23      VAL 742  42.128 -15.896  -5.457

  No H/Q in entry =           9
  In of MODEL   23
    1    H    CYS 743           H        CYS 743  44.615 -13.062  -3.819
    2    HA   CYS 743           HA       CYS 743  47.333 -12.802  -4.459
    3    HB2  CYS 743           HB2      CYS 743  47.093 -10.517  -4.297
    4    HB3  CYS 743           HB3      CYS 743  45.443 -11.005  -4.706

  No H/Q in entry =           4
  In of MODEL   23
    1    H    LYS 744           H        LYS 744  45.572 -12.675  -1.414
    2    HA   LYS 744           HA       LYS 744  47.656 -12.097   0.287
    3    HB2  LYS 744           HB2      LYS 744  45.272 -13.877   0.756
    4    HB3  LYS 744           HB3      LYS 744  46.372 -13.352   2.021
    5    HG2  LYS 744           HG2      LYS 744  45.739 -11.028   1.612
    6    HG3  LYS 744           HG3      LYS 744  44.662 -11.546   0.307
    7    HD2  LYS 744           HD2      LYS 744  43.329 -12.822   1.870
    8    HD3  LYS 744           HD3      LYS 744  44.429 -12.422   3.183
    9    HE2  LYS 744           HE2      LYS 744  42.720 -10.469   1.630
   10    HE3  LYS 744           HE3      LYS 744  42.401 -11.075   3.252
   11    HZ1  LYS 744           HZ1      LYS 744  44.562 -10.038   3.926
   12    HZ3  LYS 744           HZ2      LYS 744  43.354  -8.973   3.483
   13    HZ2  LYS 744           HZ3      LYS 744  44.607  -9.249   2.421

  No H/Q in entry =          13
  In of MODEL   23
    1    H    MET 745           H        MET 745  46.520 -15.238  -0.844
    2    HA   MET 745           HA       MET 745  48.306 -16.965   0.436
    3    HB2  MET 745           HB2      MET 745  46.655 -18.085  -0.623
    4    HB3  MET 745           HB3      MET 745  46.642 -17.051  -2.030
    5    HG2  MET 745           HG2      MET 745  47.383 -19.118  -2.832
    6    HG3  MET 745           HG3      MET 745  48.850 -18.182  -2.657
    7    HE1  MET 745           HE1      MET 745  46.721 -21.119  -1.378
    8    HE3  MET 745           HE2      MET 745  46.688 -20.105   0.063
    9    HE2  MET 745           HE3      MET 745  47.552 -21.640   0.080

  No H/Q in entry =           9
  In of MODEL   23
    1    H    HIS 746           H        HIS 746  48.718 -15.243  -2.609
    2    HA   HIS 746           HA       HIS 746  51.280 -16.472  -3.032
    3    HB2  HIS 746           HB2      HIS 746  49.763 -14.366  -4.432
    4    HB3  HIS 746           HB3      HIS 746  51.476 -14.575  -4.832
    5    HD1  HIS 746           HD1      HIS 746  52.045 -17.046  -5.785
    6    HD2  HIS 746           HD2      HIS 746  48.042 -15.973  -5.717
    7    HE1  HIS 746           HE1      HIS 746  50.929 -18.565  -7.415
    8    HE2  HIS 746           HE2      HIS 746  48.568 -17.669  -7.576

  No H/Q in entry =           8
  In of MODEL   23
    1    H    VAL 747           H        VAL 747  50.122 -13.457  -1.773
    2    HA   VAL 747           HA       VAL 747  52.596 -12.185  -1.528
    3    HB   VAL 747           HB       VAL 747  49.894 -11.764  -0.278
    4   HG13  VAL 747          HG11      VAL 747  50.745  -9.739   0.875
    5   HG12  VAL 747          HG12      VAL 747  52.377 -10.119   0.350
    6   HG11  VAL 747          HG13      VAL 747  51.556 -11.168   1.492
    7   HG22  VAL 747          HG21      VAL 747  50.244 -11.082  -2.566
    8   HG21  VAL 747          HG22      VAL 747  51.678 -10.195  -2.101
    9   HG23  VAL 747          HG23      VAL 747  50.086  -9.647  -1.541

  No H/Q in entry =           9
  In of MODEL   23
    1    H    LEU 748           H        LEU 748  50.731 -14.105   0.815
    2    HA   LEU 748           HA       LEU 748  52.719 -13.921   2.783
    3    HB2  LEU 748           HB2      LEU 748  51.532 -15.789   3.943
    4    HB3  LEU 748           HB3      LEU 748  50.474 -14.490   3.459
    5    HG   LEU 748           HG       LEU 748  49.813 -15.956   1.495
    6   HD12  LEU 748          HD11      LEU 748  51.094 -18.094   3.178
    7   HD11  LEU 748          HD12      LEU 748  51.623 -17.561   1.584
    8   HD13  LEU 748          HD13      LEU 748  50.058 -18.352   1.773
    9   HD23  LEU 748          HD21      LEU 748  49.134 -16.822   4.295
   10   HD22  LEU 748          HD22      LEU 748  48.202 -17.197   2.841
   11   HD21  LEU 748          HD23      LEU 748  48.365 -15.525   3.377

  No H/Q in entry =          11
  In of MODEL   23
    1    H    HIS 749           H        HIS 749  52.327 -15.987   0.069
    2    HA   HIS 749           HA       HIS 749  54.277 -17.915   0.764
    3    HB2  HIS 749           HB2      HIS 749  52.595 -18.156  -1.106
    4    HB3  HIS 749           HB3      HIS 749  53.560 -17.014  -2.038
    5    HD1  HIS 749           HD1      HIS 749  55.757 -17.910  -3.113
    6    HD2  HIS 749           HD2      HIS 749  53.729 -20.671  -0.766
    7    HE1  HIS 749           HE1      HIS 749  56.885 -20.076  -3.526
    8    HE2  HIS 749           HE2      HIS 749  55.373 -21.729  -2.462

  No H/Q in entry =           8
  In of MODEL   23
    1    H    CYS 750           H        CYS 750  54.402 -14.788  -0.820
    2    HA   CYS 750           HA       CYS 750  57.181 -14.922  -1.500
    3    HB2  CYS 750           HB2      CYS 750  55.347 -13.483  -2.571
    4    HB3  CYS 750           HB3      CYS 750  55.496 -12.402  -1.208

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLN 751           H        GLN 751  55.267 -13.992   1.224
    2    HA   GLN 751           HA       GLN 751  57.290 -12.635   2.677
    3    HB2  GLN 751           HB2      GLN 751  54.710 -13.897   3.596
    4    HB3  GLN 751           HB3      GLN 751  55.757 -12.926   4.616
    5    HG2  GLN 751           HG2      GLN 751  54.451 -11.977   2.085
    6    HG3  GLN 751           HG3      GLN 751  53.860 -11.646   3.710
    7   HE21  GLN 751          HE21      GLN 751  54.747  -9.771   1.643
    8   HE22  GLN 751          HE22      GLN 751  56.076  -8.928   2.339

  No H/Q in entry =           8
  In of MODEL   23
    1    H    GLY 752           H        GLY 752  56.831 -15.904   1.997
    2    HA3  GLY 752           HA2      GLY 752  58.527 -17.487   2.584
    3    HA2  GLY 752           HA3      GLY 752  58.778 -16.607   4.084

  No H/Q in entry =           3
  In of MODEL   23
    1    H    ARG 753           H        ARG 753  55.554 -17.353   3.006
    2    HA   ARG 753           HA       ARG 753  55.359 -19.377   5.133
    3    HB2  ARG 753           HB2      ARG 753  53.174 -17.665   3.928
    4    HB3  ARG 753           HB3      ARG 753  52.972 -18.827   5.227
    5    HG2  ARG 753           HG2      ARG 753  54.647 -16.329   5.376
    6    HG3  ARG 753           HG3      ARG 753  53.009 -16.497   6.000
    7    HD2  ARG 753           HD2      ARG 753  53.752 -18.248   7.530
    8    HD3  ARG 753           HD3      ARG 753  55.391 -18.133   6.888
    9    HE   ARG 753           HE       ARG 753  54.690 -15.608   7.747
   10   HH11  ARG 753          HH11      ARG 753  55.042 -18.779   9.269
   11   HH12  ARG 753          HH12      ARG 753  55.627 -18.168  10.744
   12   HH21  ARG 753          HH21      ARG 753  55.496 -14.758   9.826
   13   HH22  ARG 753          HH22      ARG 753  55.885 -15.880  11.054

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ASN 754           H        ASN 754  54.484 -21.368   4.621
    2    HA   ASN 754           HA       ASN 754  53.918 -21.814   1.771
    3    HB2  ASN 754           HB2      ASN 754  54.777 -23.883   3.821
    4    HB3  ASN 754           HB3      ASN 754  54.461 -24.182   2.122
    5   HD21  ASN 754          HD21      ASN 754  56.685 -23.051   4.442
    6   HD22  ASN 754          HD22      ASN 754  58.008 -22.789   3.382

  No H/Q in entry =           6
  In of MODEL   23
    1    H    TYR 755           H        TYR 755  52.006 -22.525   1.205
    2    HA   TYR 755           HA       TYR 755  50.195 -23.639   3.192
    3    HB2  TYR 755           HB2      TYR 755  49.714 -21.286   1.388
    4    HB3  TYR 755           HB3      TYR 755  48.383 -22.310   1.863
    5    HD1  TYR 755           HD1      TYR 755  51.232 -20.547   3.578
    6    HD2  TYR 755           HD2      TYR 755  47.094 -21.476   3.541
    7    HE1  TYR 755           HE1      TYR 755  50.893 -19.115   5.548
    8    HE2  TYR 755           HE2      TYR 755  46.755 -20.050   5.502
    9    HH   TYR 755           HH       TYR 755  49.059 -17.856   6.551

  No H/Q in entry =           9
  In of MODEL   23
    1    H    THR 756           H        THR 756  48.479 -24.831   2.141
    2    HA   THR 756           HA       THR 756  49.140 -25.749  -0.563
    3    HB   THR 756           HB       THR 756  48.023 -27.262   1.829
    4    HG1  THR 756           HG1      THR 756  50.062 -27.700   2.210
    5   HG21  THR 756          HG21      THR 756  48.704 -28.273  -0.944
    6   HG23  THR 756          HG22      THR 756  47.079 -28.101  -0.265
    7   HG22  THR 756          HG23      THR 756  48.205 -29.266   0.431

  No H/Q in entry =           7
  In of MODEL   23
    1    H    LEU 757           H        LEU 757  47.144 -26.185  -1.847
    2    HA   LEU 757           HA       LEU 757  44.918 -24.798  -0.639
    3    HB2  LEU 757           HB2      LEU 757  45.426 -25.404  -3.527
    4    HB3  LEU 757           HB3      LEU 757  43.884 -24.820  -2.937
    5    HG   LEU 757           HG       LEU 757  45.399 -22.939  -1.895
    6   HD12  LEU 757          HD11      LEU 757  47.204 -22.276  -3.389
    7   HD11  LEU 757          HD12      LEU 757  47.013 -23.787  -4.275
    8   HD13  LEU 757          HD13      LEU 757  47.515 -23.814  -2.584
    9   HD21  LEU 757          HD21      LEU 757  43.535 -22.656  -3.366
   10   HD23  LEU 757          HD22      LEU 757  44.556 -22.973  -4.784
   11   HD22  LEU 757          HD23      LEU 757  44.838 -21.552  -3.757

  No H/Q in entry =          11
  In of MODEL   23
    1    H    THR 758           H        THR 758  42.806 -25.565  -0.889
    2    HA   THR 758           HA       THR 758  42.627 -28.461  -1.027
    3    HB   THR 758           HB       THR 758  41.136 -28.257   1.073
    4    HG1  THR 758           HG1      THR 758  41.824 -25.691   0.759
    5   HG22  THR 758          HG21      THR 758  44.116 -27.737   1.371
    6   HG21  THR 758          HG22      THR 758  43.382 -29.311   1.094
    7   HG23  THR 758          HG23      THR 758  43.066 -28.450   2.595

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLY 759           H        GLY 759  39.911 -28.626  -0.318
    2    HA3  GLY 759           HA2      GLY 759  38.760 -27.604  -2.752
    3    HA2  GLY 759           HA3      GLY 759  37.969 -28.632  -1.558

  No H/Q in entry =           3
  In of MODEL   23
    1    H    ARG 760           H        ARG 760  36.582 -26.555  -2.625
    2    HA   ARG 760           HA       ARG 760  36.840 -24.201  -0.967
    3    HB2  ARG 760           HB2      ARG 760  34.853 -23.334  -2.149
    4    HB3  ARG 760           HB3      ARG 760  36.019 -23.967  -3.292
    5    HG2  ARG 760           HG2      ARG 760  33.977 -24.714  -4.136
    6    HG3  ARG 760           HG3      ARG 760  34.585 -26.106  -3.237
    7    HD2  ARG 760           HD2      ARG 760  33.191 -25.346  -1.290
    8    HD3  ARG 760           HD3      ARG 760  32.491 -24.129  -2.351
    9    HE   ARG 760           HE       ARG 760  32.267 -26.667  -3.512
   10   HH11  ARG 760          HH11      ARG 760  30.875 -24.713  -0.882
   11   HH12  ARG 760          HH12      ARG 760  29.398 -25.542  -0.870
   12   HH21  ARG 760          HH21      ARG 760  30.238 -27.782  -3.501
   13   HH22  ARG 760          HH22      ARG 760  29.017 -27.340  -2.399

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ASP 761           H        ASP 761  35.523 -27.187  -0.642
    2    HA   ASP 761           HA       ASP 761  33.337 -26.626   1.119
    3    HB2  ASP 761           HB2      ASP 761  33.298 -29.100   1.306
    4    HB3  ASP 761           HB3      ASP 761  33.268 -28.544  -0.368

  No H/Q in entry =           4
  In of MODEL   23
    1    H    SER 762           H        SER 762  36.746 -27.017   1.315
    2    HA   SER 762           HA       SER 762  36.907 -28.305   3.812
    3    HB2  SER 762           HB2      SER 762  39.006 -26.673   2.394
    4    HB3  SER 762           HB3      SER 762  39.276 -27.898   3.634
    5    HG   SER 762           HG       SER 762  37.896 -29.175   1.888

  No H/Q in entry =           5
  In of MODEL   23
    1    H    CYS 763           H        CYS 763  36.560 -24.928   2.912
    2    HA   CYS 763           HA       CYS 763  36.823 -24.291   5.763
    3    HB2  CYS 763           HB2      CYS 763  37.835 -22.207   5.310
    4    HB3  CYS 763           HB3      CYS 763  38.720 -23.355   4.307

  No H/Q in entry =           4
  In of MODEL   23
    1    H    THR 764           H        THR 764  35.757 -21.951   6.048
    2    HA   THR 764           HA       THR 764  33.232 -21.953   4.610
    3    HB   THR 764           HB       THR 764  33.901 -20.571   7.238
    4    HG1  THR 764           HG1      THR 764  33.880 -23.007   7.118
    5   HG21  THR 764          HG21      THR 764  31.291 -21.219   5.867
    6   HG23  THR 764          HG22      THR 764  32.054 -19.628   5.949
    7   HG22  THR 764          HG23      THR 764  31.461 -20.401   7.424

  No H/Q in entry =           7
  In of MODEL   23
    1    H    LEU 765           H        LEU 765  33.605 -20.711   2.926
    2    HA   LEU 765           HA       LEU 765  35.608 -18.665   3.022
    3    HB2  LEU 765           HB2      LEU 765  34.976 -20.536   1.245
    4    HB3  LEU 765           HB3      LEU 765  33.869 -19.292   0.707
    5    HG   LEU 765           HG       LEU 765  35.659 -17.861   0.054
    6   HD12  LEU 765          HD11      LEU 765  38.019 -18.537   0.389
    7   HD11  LEU 765          HD12      LEU 765  37.472 -19.944   1.306
    8   HD13  LEU 765          HD13      LEU 765  37.221 -18.331   1.946
    9   HD21  LEU 765          HD21      LEU 765  35.073 -19.678  -1.482
   10   HD23  LEU 765          HD22      LEU 765  36.279 -20.709  -0.716
   11   HD22  LEU 765          HD23      LEU 765  36.781 -19.262  -1.588

  No H/Q in entry =          11
  In of MODEL   23
    1    HA   PRO 766           HA       PRO 766  32.872 -15.233   3.821
    2    HB2  PRO 766           HB2      PRO 766  33.929 -13.398   1.989
    3    HB3  PRO 766           HB3      PRO 766  34.465 -13.614   3.649
    4    HG2  PRO 766           HG2      PRO 766  35.654 -14.616   1.125
    5    HG3  PRO 766           HG3      PRO 766  36.448 -14.193   2.647
    6    HD2  PRO 766           HD2      PRO 766  36.059 -16.735   1.814
    7    HD3  PRO 766           HD3      PRO 766  36.118 -16.320   3.533

  No H/Q in entry =           7
  In of MODEL   23
    1    H    ALA 767           H        ALA 767  33.518 -15.989   0.455
    2    HA   ALA 767           HA       ALA 767  30.914 -14.842  -0.299
    3    HB2  ALA 767           HB1      ALA 767  32.964 -14.167  -1.557
    4    HB3  ALA 767           HB2      ALA 767  31.687 -14.882  -2.565
    5    HB1  ALA 767           HB3      ALA 767  33.097 -15.845  -2.084

  No H/Q in entry =           5
  In of MODEL   23
    1    H    SER 768           H        SER 768  31.382 -17.236   1.112
    2    HA   SER 768           HA       SER 768  29.655 -18.800  -0.594
    3    HB2  SER 768           HB2      SER 768  30.705 -19.417   2.157
    4    HB3  SER 768           HB3      SER 768  29.796 -20.394   0.973
    5    HG   SER 768           HG       SER 768  31.904 -19.428  -0.271

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA 769           H        ALA 769  29.685 -16.468   1.875
    2    HA   ALA 769           HA       ALA 769  26.976 -16.997   2.751
    3    HB1  ALA 769           HB1      ALA 769  28.954 -14.804   3.460
    4    HB2  ALA 769           HB2      ALA 769  28.603 -16.232   4.433
    5    HB3  ALA 769           HB3      ALA 769  27.359 -15.005   4.186

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLU 770           H        GLU 770  25.808 -14.544   2.768
    2    HA   GLU 770           HA       GLU 770  25.731 -14.103  -0.084
    3    HB2  GLU 770           HB2      GLU 770  23.714 -12.813   0.252
    4    HB3  GLU 770           HB3      GLU 770  23.580 -14.397   0.993
    5    HG2  GLU 770           HG2      GLU 770  23.884 -13.434   3.173
    6    HG3  GLU 770           HG3      GLU 770  24.194 -11.848   2.463

  No H/Q in entry =           6
  In of MODEL   23
    1    H    LYS 771           H        LYS 771  26.297 -12.418  -1.111
    2    HA   LYS 771           HA       LYS 771  27.511 -10.260   0.414
    3    HB2  LYS 771           HB2      LYS 771  27.862 -11.066  -2.481
    4    HB3  LYS 771           HB3      LYS 771  28.636  -9.678  -1.740
    5    HG2  LYS 771           HG2      LYS 771  29.056 -12.487  -0.742
    6    HG3  LYS 771           HG3      LYS 771  30.026 -11.795  -2.029
    7    HD2  LYS 771           HD2      LYS 771  31.189 -11.646   0.101
    8    HD3  LYS 771           HD3      LYS 771  30.805 -10.025  -0.470
    9    HE2  LYS 771           HE2      LYS 771  29.108  -9.809   1.177
   10    HE3  LYS 771           HE3      LYS 771  29.188 -11.535   1.609
   11    HZ2  LYS 771           HZ1      LYS 771  30.249 -10.113   3.204
   12    HZ1  LYS 771           HZ2      LYS 771  31.282  -9.450   2.043
   13    HZ3  LYS 771           HZ3      LYS 771  31.410 -11.064   2.468

  No H/Q in entry =          13
  In of MODEL   23
    1    H    ALA 772           H        ALA 772  27.239  -8.107  -0.906
    2    HA   ALA 772           HA       ALA 772  24.447  -7.598  -1.228
    3    HB2  ALA 772           HB1      ALA 772  25.098  -5.424  -1.768
    4    HB3  ALA 772           HB2      ALA 772  26.781  -5.898  -2.050
    5    HB1  ALA 772           HB3      ALA 772  26.104  -5.932  -0.409

  No H/Q in entry =           5
  In of MODEL   23
    1    H    CYS 773           H        CYS 773  23.389  -8.350  -2.868
    2    HA   CYS 773           HA       CYS 773  22.889  -9.439  -4.595
    3    HB2  CYS 773           HB2      CYS 773  23.227  -8.225  -6.830
    4    HB3  CYS 773           HB3      CYS 773  22.175  -7.534  -5.609

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLY 774           H        GLY 774  26.088  -9.719  -4.116
    2    HA3  GLY 774           HA2      GLY 774  26.362 -12.242  -4.574
    3    HA2  GLY 774           HA3      GLY 774  26.049 -11.793  -6.232

  No H/Q in entry =           3
  In of MODEL   23
    1    H    ALA 775           H        ALA 775  27.863  -9.300  -5.743
    2    HA   ALA 775           HA       ALA 775  30.417 -10.721  -5.785
    3    HB2  ALA 775           HB1      ALA 775  31.047  -9.340  -7.726
    4    HB3  ALA 775           HB2      ALA 775  29.425  -8.653  -7.753
    5    HB1  ALA 775           HB3      ALA 775  29.661 -10.366  -8.092

  No H/Q in entry =           5
  In of MODEL   23
    1    H    CYS 776           H        CYS 776  31.819  -8.344  -6.410
    2    HA   CYS 776           HA       CYS 776  31.074  -6.026  -5.317
    3    HB2  CYS 776           HB2      CYS 776  31.976  -7.761  -3.190
    4    HB3  CYS 776           HB3      CYS 776  32.793  -6.207  -3.127

  No H/Q in entry =           4
  In of MODEL   23
    1    HA   PRO 777           HA       PRO 777  33.529  -2.913  -6.554
    2    HB2  PRO 777           HB2      PRO 777  35.899  -4.140  -5.230
    3    HB3  PRO 777           HB3      PRO 777  35.597  -2.432  -5.618
    4    HG2  PRO 777           HG2      PRO 777  34.769  -3.722  -3.244
    5    HG3  PRO 777           HG3      PRO 777  34.170  -2.164  -3.844
    6    HD2  PRO 777           HD2      PRO 777  32.561  -4.432  -3.562
    7    HD3  PRO 777           HD3      PRO 777  32.213  -3.099  -4.660

  No H/Q in entry =           7
  In of MODEL   23
    1    H    LEU 778           H        LEU 778  36.055  -5.365  -6.930
    2    HA   LEU 778           HA       LEU 778  36.268  -4.181  -9.475
    3    HB2  LEU 778           HB2      LEU 778  38.351  -5.288  -9.849
    4    HB3  LEU 778           HB3      LEU 778  38.262  -4.423  -8.332
    5    HG   LEU 778           HG       LEU 778  39.523  -6.216  -7.789
    6   HD13  LEU 778          HD11      LEU 778  37.852  -6.195  -6.158
    7   HD12  LEU 778          HD12      LEU 778  38.341  -7.862  -6.469
    8   HD11  LEU 778          HD13      LEU 778  36.817  -7.256  -7.117
    9   HD23  LEU 778          HD21      LEU 778  39.107  -8.569  -8.572
   10   HD22  LEU 778          HD22      LEU 778  39.632  -7.379  -9.756
   11   HD21  LEU 778          HD23      LEU 778  37.937  -7.854  -9.701

  No H/Q in entry =          11
  In of MODEL   23
    1    H    TRP 779           H        TRP 779  34.586  -6.917  -8.651
    2    HA   TRP 779           HA       TRP 779  33.962  -7.072 -11.492
    3    HB2  TRP 779           HB2      TRP 779  33.656  -9.528 -11.471
    4    HB3  TRP 779           HB3      TRP 779  35.312  -9.123 -11.077
    5    HD1  TRP 779           HD1      TRP 779  32.081 -10.448  -9.378
    6    HE1  TRP 779           HE1      TRP 779  32.770 -11.829  -7.313
    7    HE3  TRP 779           HE3      TRP 779  37.053  -9.545  -9.473
    8    HZ2  TRP 779           HZ2      TRP 779  35.186 -12.460  -5.917
    9    HZ3  TRP 779           HZ3      TRP 779  38.502 -10.549  -7.745
   10    HH2  TRP 779           HH2      TRP 779  37.573 -11.966  -6.015

  No H/Q in entry =          10
  In of MODEL   23
    1    H    GLY 780           H        GLY 780  32.974  -5.824  -9.066
    2    HA3  GLY 780           HA2      GLY 780  30.239  -6.875  -9.183
    3    HA2  GLY 780           HA3      GLY 780  31.015  -6.758  -7.618

  No H/Q in entry =           3
  In of MODEL   23
    1    H    LYS 781           H        LYS 781  28.951  -5.358  -9.629
    2    HA   LYS 781           HA       LYS 781  28.934  -2.830  -8.137
    3    HB2  LYS 781           HB2      LYS 781  30.461  -2.459  -9.952
    4    HB3  LYS 781           HB3      LYS 781  29.248  -2.990 -11.117
    5    HG2  LYS 781           HG2      LYS 781  27.843  -1.035 -10.397
    6    HG3  LYS 781           HG3      LYS 781  29.219  -0.484  -9.434
    7    HD2  LYS 781           HD2      LYS 781  29.223  -0.942 -12.427
    8    HD3  LYS 781           HD3      LYS 781  29.176   0.628 -11.625
    9    HE2  LYS 781           HE2      LYS 781  31.360   0.289 -10.695
   10    HE3  LYS 781           HE3      LYS 781  31.385  -1.381 -11.242
   11    HZ1  LYS 781           HZ1      LYS 781  31.359   0.977 -13.051
   12    HZ3  LYS 781           HZ2      LYS 781  31.422  -0.651 -13.500
   13    HZ2  LYS 781           HZ3      LYS 781  32.706   0.039 -12.630

  No H/Q in entry =          13
  In of MODEL   23
    1    H    CYS 782           H        CYS 782  26.804  -2.639  -7.663
    2    HA   CYS 782           HA       CYS 782  24.813  -3.594  -9.645
    3    HB2  CYS 782           HB2      CYS 782  24.806  -3.590  -6.685
    4    HB3  CYS 782           HB3      CYS 782  23.303  -3.058  -7.406

  No H/Q in entry =           4
  In of MODEL   23
    1    H    ASP 783           H        ASP 783  22.652  -2.255  -9.332
    2    HA   ASP 783           HA       ASP 783  23.125   0.463  -9.950
    3    HB2  ASP 783           HB2      ASP 783  21.181  -0.770 -10.771
    4    HB3  ASP 783           HB3      ASP 783  20.596  -1.000  -9.130

  No H/Q in entry =           4
  In of MODEL   23
    1    H    ALA 784           H        ALA 784  24.248   1.414  -8.365
    2    HA   ALA 784           HA       ALA 784  23.167   2.711  -6.221
    3    HB2  ALA 784           HB1      ALA 784  24.617   0.163  -5.407
    4    HB3  ALA 784           HB2      ALA 784  22.915   0.512  -5.107
    5    HB1  ALA 784           HB3      ALA 784  24.166   1.471  -4.311

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLU 785           H        GLU 785  25.336   3.045  -4.631
    2    HA   GLU 785           HA       GLU 785  27.300   4.120  -6.434
    3    HB2  GLU 785           HB2      GLU 785  27.287   3.900  -3.416
    4    HB3  GLU 785           HB3      GLU 785  28.374   4.903  -4.365
    5    HG2  GLU 785           HG2      GLU 785  26.572   6.313  -5.049
    6    HG3  GLU 785           HG3      GLU 785  25.384   5.209  -4.355

  No H/Q in entry =           6
  In of MODEL   23
    1    H    SER 786           H        SER 786  27.911   2.213  -3.524
    2    HA   SER 786           HA       SER 786  29.095   0.023  -4.993
    3    HB2  SER 786           HB2      SER 786  30.907   1.785  -4.503
    4    HB3  SER 786           HB3      SER 786  30.584   1.535  -2.792
    5    HG   SER 786           HG       SER 786  31.434  -0.450  -4.627

  No H/Q in entry =           5
  In of MODEL   23
    1    H    SER 787           H        SER 787  26.757   0.880  -3.404
    2    HA   SER 787           HA       SER 787  26.771  -0.085  -0.780
    3    HB2  SER 787           HB2      SER 787  24.347   0.144  -2.501
    4    HB3  SER 787           HB3      SER 787  24.612   0.705  -0.840
    5    HG   SER 787           HG       SER 787  25.009   2.567  -1.710

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LYS 788           H        LYS 788  25.990  -1.380  -3.928
    2    HA   LYS 788           HA       LYS 788  25.847  -4.103  -2.880
    3    HB2  LYS 788           HB2      LYS 788  23.942  -2.832  -4.816
    4    HB3  LYS 788           HB3      LYS 788  24.253  -4.553  -4.773
    5    HG2  LYS 788           HG2      LYS 788  23.606  -4.305  -2.322
    6    HG3  LYS 788           HG3      LYS 788  22.774  -2.833  -2.871
    7    HD2  LYS 788           HD2      LYS 788  22.335  -5.709  -3.701
    8    HD3  LYS 788           HD3      LYS 788  21.127  -4.579  -3.076
    9    HE2  LYS 788           HE2      LYS 788  22.440  -4.580  -5.826
   10    HE3  LYS 788           HE3      LYS 788  20.834  -5.074  -5.473
   11    HZ3  LYS 788           HZ1      LYS 788  20.195  -2.833  -4.875
   12    HZ2  LYS 788           HZ2      LYS 788  20.874  -2.797  -6.379
   13    HZ1  LYS 788           HZ3      LYS 788  21.745  -2.247  -5.040

  No H/Q in entry =          13
  In of MODEL   23
    1    H    CYS 789           H        CYS 789  26.261  -5.660  -4.623
    2    HA   CYS 789           HA       CYS 789  27.935  -4.524  -6.756
    3    HB2  CYS 789           HB2      CYS 789  28.358  -6.639  -4.759
    4    HB3  CYS 789           HB3      CYS 789  29.468  -6.318  -6.110

  No H/Q in entry =           4
  In of MODEL   23
    1    H    VAL 790           H        VAL 790  27.066  -5.492  -8.720
    2    HA   VAL 790           HA       VAL 790  25.652  -7.931  -8.275
    3    HB   VAL 790           HB       VAL 790  24.814  -5.873  -9.715
    4   HG12  VAL 790          HG11      VAL 790  26.296  -7.301 -11.901
    5   HG11  VAL 790          HG12      VAL 790  26.598  -5.687 -11.284
    6   HG13  VAL 790          HG13      VAL 790  25.088  -6.030 -12.135
    7   HG23  VAL 790          HG21      VAL 790  23.337  -7.323 -11.060
    8   HG22  VAL 790          HG22      VAL 790  23.448  -7.754  -9.361
    9   HG21  VAL 790          HG23      VAL 790  24.318  -8.716 -10.574

  No H/Q in entry =           9
  In of MODEL   23
    1    H    CYS 791           H        CYS 791  26.246  -9.440 -10.659
    2    HA   CYS 791           HA       CYS 791  29.171  -9.558 -10.459
    3    HB2  CYS 791           HB2      CYS 791  27.420 -11.379 -12.142
    4    HB3  CYS 791           HB3      CYS 791  29.022 -11.663 -11.518

  No H/Q in entry =           4
  In of MODEL   23
    1    H    ARG 792           H        ARG 792  30.255  -8.461 -11.844
    2    HA   ARG 792           HA       ARG 792  28.884  -7.307 -14.133
    3    HB2  ARG 792           HB2      ARG 792  30.187  -6.040 -12.270
    4    HB3  ARG 792           HB3      ARG 792  31.616  -6.623 -13.097
    5    HG2  ARG 792           HG2      ARG 792  31.045  -4.350 -13.747
    6    HG3  ARG 792           HG3      ARG 792  30.917  -5.469 -15.126
    7    HD2  ARG 792           HD2      ARG 792  28.544  -5.515 -14.927
    8    HD3  ARG 792           HD3      ARG 792  28.599  -4.619 -13.410
    9    HE   ARG 792           HE       ARG 792  29.683  -2.852 -14.935
   10   HH11  ARG 792          HH11      ARG 792  27.227  -5.102 -16.105
   11   HH12  ARG 792          HH12      ARG 792  26.265  -3.920 -16.873
   12   HH21  ARG 792          HH21      ARG 792  28.425  -1.222 -16.101
   13   HH22  ARG 792          HH22      ARG 792  26.988  -1.672 -16.904

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLU 793           H        GLU 793  29.876  -7.248 -16.101
    2    HA   GLU 793           HA       GLU 793  30.848  -9.736 -16.919
    3    HB2  GLU 793           HB2      GLU 793  30.719  -7.099 -18.390
    4    HB3  GLU 793           HB3      GLU 793  31.001  -8.659 -19.125
    5    HG2  GLU 793           HG2      GLU 793  28.672  -8.015 -19.485
    6    HG3  GLU 793           HG3      GLU 793  28.773  -9.416 -18.419

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ALA 794           H        ALA 794  32.852 -10.093 -18.034
    2    HA   ALA 794           HA       ALA 794  35.006  -9.504 -16.309
    3    HB2  ALA 794           HB1      ALA 794  34.784 -11.623 -17.524
    4    HB3  ALA 794           HB2      ALA 794  36.348 -10.854 -17.800
    5    HB1  ALA 794           HB3      ALA 794  35.095 -10.771 -19.039

  No H/Q in entry =           5
  In of MODEL   23
    1    H    SER 795           H        SER 795  33.881  -8.010 -19.169
    2    HA   SER 795           HA       SER 795  36.246  -6.777 -19.944
    3    HB2  SER 795           HB2      SER 795  34.580  -5.254 -21.184
    4    HB3  SER 795           HB3      SER 795  34.593  -6.972 -21.581
    5    HG   SER 795           HG       SER 795  32.667  -7.174 -20.838

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLU 796           H        GLU 796  33.897  -6.002 -17.460
    2    HA   GLU 796           HA       GLU 796  35.088  -3.360 -17.202
    3    HB2  GLU 796           HB2      GLU 796  32.571  -3.518 -17.338
    4    HB3  GLU 796           HB3      GLU 796  32.595  -4.379 -15.809
    5    HG2  GLU 796           HG2      GLU 796  33.351  -2.469 -14.637
    6    HG3  GLU 796           HG3      GLU 796  33.743  -1.621 -16.127

  No H/Q in entry =           6
  In of MODEL   23
    1    H    CYS 797           H        CYS 797  36.779  -5.080 -16.644
    2    HA   CYS 797           HA       CYS 797  36.962  -5.750 -13.846
    3    HB2  CYS 797           HB2      CYS 797  37.965  -7.210 -15.494
    4    HB3  CYS 797           HB3      CYS 797  38.937  -5.892 -16.143

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLU 798           H        GLU 798  37.312  -4.209 -12.453
    2    HA   GLU 798           HA       GLU 798  38.558  -1.717 -13.352
    3    HB2  GLU 798           HB2      GLU 798  36.814  -2.260 -10.949
    4    HB3  GLU 798           HB3      GLU 798  37.399  -0.678 -11.453
    5    HG2  GLU 798           HG2      GLU 798  36.180  -0.855 -13.541
    6    HG3  GLU 798           HG3      GLU 798  35.629  -2.467 -13.107

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU 799           H        GLU 799  40.117  -4.050 -12.542
    2    HA   GLU 799           HA       GLU 799  42.037  -2.774 -10.826
    3    HB2  GLU 799           HB2      GLU 799  40.103  -4.226  -9.513
    4    HB3  GLU 799           HB3      GLU 799  41.248  -5.499  -9.883
    5    HG2  GLU 799           HG2      GLU 799  41.778  -3.014  -8.249
    6    HG3  GLU 799           HG3      GLU 799  41.514  -4.636  -7.625

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLU 800           H        GLU 800  43.688  -5.038 -10.510
    2    HA   GLU 800           HA       GLU 800  43.768  -6.089 -13.234
    3    HB2  GLU 800           HB2      GLU 800  45.985  -5.719 -11.229
    4    HB3  GLU 800           HB3      GLU 800  46.154  -6.717 -12.660
    5    HG2  GLU 800           HG2      GLU 800  45.600  -4.664 -13.997
    6    HG3  GLU 800           HG3      GLU 800  45.774  -3.744 -12.499

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLY 801           H        GLY 801  43.776  -6.900  -9.762
    2    HA3  GLY 801           HA2      GLY 801  43.884  -8.769  -8.675
    3    HA2  GLY 801           HA3      GLY 801  42.986  -9.451 -10.028

  No H/Q in entry =           3
  In of MODEL   23
    1    H    PHE 802           H        PHE 802  44.174 -11.279  -9.495
    2    HA   PHE 802           HA       PHE 802  46.844 -11.371 -10.656
    3    HB2  PHE 802           HB2      PHE 802  45.230 -13.255  -8.981
    4    HB3  PHE 802           HB3      PHE 802  46.613 -13.822  -9.902
    5    HD1  PHE 802           HD1      PHE 802  47.893 -14.486  -8.079
    6    HD2  PHE 802           HD2      PHE 802  46.459 -10.500  -8.272
    7    HE1  PHE 802           HE1      PHE 802  49.373 -13.893  -6.327
    8    HE2  PHE 802           HE2      PHE 802  47.959  -9.862  -6.500
    9    HZ   PHE 802           HZ       PHE 802  49.453 -11.548  -5.474

  No H/Q in entry =           9
  In of MODEL   23
    1    H    SER 803           H        SER 803  47.182 -13.395 -11.925
    2    HA   SER 803           HA       SER 803  44.835 -13.929 -13.559
    3    HB2  SER 803           HB2      SER 803  46.644 -12.861 -14.863
    4    HB3  SER 803           HB3      SER 803  47.752 -14.182 -14.434
    5    HG   SER 803           HG       SER 803  45.265 -14.632 -15.680

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ILE 804           H        ILE 804  44.143 -15.929 -13.554
    2    HA   ILE 804           HA       ILE 804  45.691 -17.884 -12.030
    3    HB   ILE 804           HB       ILE 804  43.767 -18.623 -10.772
    4   HG12  ILE 804          HG12      ILE 804  41.961 -18.091 -12.421
    5   HG13  ILE 804          HG13      ILE 804  41.569 -17.568 -10.794
    6   HG23  ILE 804          HG21      ILE 804  43.376 -16.688  -9.307
    7   HG22  ILE 804          HG22      ILE 804  44.110 -15.650 -10.531
    8   HG21  ILE 804          HG23      ILE 804  45.076 -16.895  -9.741
    9   HD12  ILE 804          HD11      ILE 804  42.415 -15.842 -13.119
   10   HD11  ILE 804          HD12      ILE 804  42.208 -15.250 -11.475
   11   HD13  ILE 804          HD13      ILE 804  40.834 -15.914 -12.356

  No H/Q in entry =          11
  In of MODEL   23
    1    H    CYS 805           H        CYS 805  44.684 -20.073 -12.194
    2    HA   CYS 805           HA       CYS 805  44.022 -20.594 -15.002
    3    HB2  CYS 805           HB2      CYS 805  46.147 -21.479 -14.076
    4    HB3  CYS 805           HB3      CYS 805  45.206 -22.354 -12.872

  No H/Q in entry =           4
  In of MODEL   23
    1    H    VAL 806           H        VAL 806  42.079 -21.354 -15.404
    2    HA   VAL 806           HA       VAL 806  40.748 -22.829 -13.316
    3    HB   VAL 806           HB       VAL 806  40.022 -20.511 -13.109
    4   HG13  VAL 806          HG11      VAL 806  40.367 -19.699 -15.294
    5   HG12  VAL 806          HG12      VAL 806  38.682 -19.424 -14.835
    6   HG11  VAL 806          HG13      VAL 806  39.104 -20.748 -15.931
    7   HG21  VAL 806          HG21      VAL 806  38.428 -22.268 -12.552
    8   HG23  VAL 806          HG22      VAL 806  37.880 -22.304 -14.217
    9   HG22  VAL 806          HG23      VAL 806  37.601 -20.862 -13.226

  No H/Q in entry =           9
  In of MODEL   23
    1    H    GLU 807           H        GLU 807  39.760 -24.561 -14.021
    2    HA   GLU 807           HA       GLU 807  39.988 -25.246 -16.817
    3    HB2  GLU 807           HB2      GLU 807  40.587 -26.837 -14.974
    4    HB3  GLU 807           HB3      GLU 807  38.891 -26.884 -14.541
    5    HG2  GLU 807           HG2      GLU 807  38.381 -27.668 -16.816
    6    HG3  GLU 807           HG3      GLU 807  40.130 -27.742 -17.097

  No H/Q in entry =           6
  In of MODEL   23
    1    H    VAL 808           H        VAL 808  38.529 -24.402 -18.115
    2    HA   VAL 808           HA       VAL 808  35.767 -24.779 -17.464
    3    HB   VAL 808           HB       VAL 808  35.262 -22.847 -18.520
    4   HG12  VAL 808          HG11      VAL 808  37.608 -22.146 -16.796
    5   HG11  VAL 808          HG12      VAL 808  35.971 -22.493 -16.259
    6   HG13  VAL 808          HG13      VAL 808  36.286 -21.046 -17.218
    7   HG23  VAL 808          HG21      VAL 808  38.116 -22.437 -19.389
    8   HG22  VAL 808          HG22      VAL 808  36.811 -21.256 -19.633
    9   HG21  VAL 808          HG23      VAL 808  36.717 -22.859 -20.378

  No H/Q in entry =           9
  In of MODEL   23
    1    H    ASN 809           H        ASN 809  34.623 -25.503 -19.218
    2    HA   ASN 809           HA       ASN 809  34.129 -26.288 -21.230
    3    HB2  ASN 809           HB2      ASN 809  36.526 -24.704 -21.983
    4    HB3  ASN 809           HB3      ASN 809  35.811 -25.753 -23.180
    5   HD21  ASN 809          HD21      ASN 809  33.984 -23.967 -20.697
    6   HD22  ASN 809          HD22      ASN 809  33.239 -22.858 -21.751

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLY 810           H        GLY 810  36.577 -27.357 -19.466
    2    HA3  GLY 810           HA2      GLY 810  37.058 -29.729 -19.541
    3    HA2  GLY 810           HA3      GLY 810  37.126 -29.543 -21.300

  No H/Q in entry =           3
  In of MODEL   23
    1    H    LYS 811           H        LYS 811  38.532 -26.867 -20.506
    2    HA   LYS 811           HA       LYS 811  41.198 -28.088 -20.185
    3    HB2  LYS 811           HB2      LYS 811  42.029 -26.333 -21.740
    4    HB3  LYS 811           HB3      LYS 811  40.960 -27.511 -22.492
    5    HG2  LYS 811           HG2      LYS 811  39.104 -25.918 -22.336
    6    HG3  LYS 811           HG3      LYS 811  40.179 -24.744 -21.588
    7    HD2  LYS 811           HD2      LYS 811  40.534 -25.925 -24.324
    8    HD3  LYS 811           HD3      LYS 811  39.792 -24.357 -24.003
    9    HE2  LYS 811           HE2      LYS 811  41.932 -23.655 -22.883
   10    HE3  LYS 811           HE3      LYS 811  42.647 -25.175 -23.407
   11    HZ3  LYS 811           HZ1      LYS 811  42.277 -24.517 -25.709
   12    HZ2  LYS 811           HZ2      LYS 811  43.179 -23.337 -24.906
   13    HZ1  LYS 811           HZ3      LYS 811  41.550 -23.091 -25.195

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLU 812           H        GLU 812  42.784 -26.769 -19.195
    2    HA   GLU 812           HA       GLU 812  41.716 -24.834 -17.323
    3    HB2  GLU 812           HB2      GLU 812  44.473 -26.011 -17.694
    4    HB3  GLU 812           HB3      GLU 812  44.072 -24.806 -16.479
    5    HG2  GLU 812           HG2      GLU 812  42.487 -26.332 -15.463
    6    HG3  GLU 812           HG3      GLU 812  42.858 -27.552 -16.683

  No H/Q in entry =           6
  In of MODEL   23
    1    H    GLN 813           H        GLN 813  41.385 -22.929 -17.906
    2    HA   GLN 813           HA       GLN 813  43.146 -21.710 -19.887
    3    HB2  GLN 813           HB2      GLN 813  40.865 -21.854 -20.663
    4    HB3  GLN 813           HB3      GLN 813  40.263 -21.122 -19.183
    5    HG2  GLN 813           HG2      GLN 813  41.396 -19.050 -19.744
    6    HG3  GLN 813           HG3      GLN 813  42.021 -19.751 -21.226
    7   HE21  GLN 813          HE21      GLN 813  39.476 -21.172 -21.741
    8   HE22  GLN 813          HE22      GLN 813  38.361 -19.956 -22.260

  No H/Q in entry =           8
  In of MODEL   23
    1    H    THR 814           H        THR 814  44.056 -19.802 -19.401
    2    HA   THR 814           HA       THR 814  44.111 -19.052 -16.609
    3    HB   THR 814           HB       THR 814  45.654 -18.014 -18.985
    4    HG1  THR 814           HG1      THR 814  47.281 -19.448 -18.121
    5   HG23  THR 814          HG21      THR 814  45.706 -16.532 -17.035
    6   HG22  THR 814          HG22      THR 814  47.283 -17.284 -17.295
    7   HG21  THR 814          HG23      THR 814  46.221 -17.878 -16.019

  No H/Q in entry =           7
  In of MODEL   23
    1    H    MET 815           H        MET 815  42.998 -17.381 -15.883
    2    HA   MET 815           HA       MET 815  42.009 -15.395 -17.827
    3    HB2  MET 815           HB2      MET 815  40.473 -16.315 -15.397
    4    HB3  MET 815           HB3      MET 815  39.917 -15.217 -16.652
    5    HG2  MET 815           HG2      MET 815  40.250 -17.198 -18.243
    6    HG3  MET 815           HG3      MET 815  40.390 -18.113 -16.741
    7    HE2  MET 815           HE1      MET 815  36.981 -19.223 -18.061
    8    HE1  MET 815           HE2      MET 815  38.651 -19.663 -17.634
    9    HE3  MET 815           HE3      MET 815  38.341 -18.699 -19.062

  No H/Q in entry =           9
  In of MODEL   23
    1    H    SER 816           H        SER 816  41.317 -13.412 -16.708
    2    HA   SER 816           HA       SER 816  43.259 -12.635 -14.712
    3    HB2  SER 816           HB2      SER 816  41.023 -11.045 -16.000
    4    HB3  SER 816           HB3      SER 816  42.388 -10.390 -15.093
    5    HG   SER 816           HG       SER 816  42.596 -11.882 -17.506

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLU 817           H        GLU 817  42.447 -11.549 -12.723
    2    HA   GLU 817           HA       GLU 817  40.819 -13.313 -11.326
    3    HB2  GLU 817           HB2      GLU 817  42.681 -11.617 -10.583
    4    HB3  GLU 817           HB3      GLU 817  41.268 -10.565 -10.389
    5    HG2  GLU 817           HG2      GLU 817  40.489 -11.676  -8.611
    6    HG3  GLU 817           HG3      GLU 817  41.000 -13.184  -9.342

  No H/Q in entry =           6
  In of MODEL   23
    1    H    CYS 818           H        CYS 818  39.952 -10.045 -12.527
    2    HA   CYS 818           HA       CYS 818  37.347 -10.028 -11.466
    3    HB2  CYS 818           HB2      CYS 818  38.068  -8.912 -14.166
    4    HB3  CYS 818           HB3      CYS 818  36.796  -8.362 -13.092

  No H/Q in entry =           4
  In of MODEL   23
    1    H    GLU 819           H        GLU 819  38.738 -11.508 -14.249
    2    HA   GLU 819           HA       GLU 819  36.396 -12.022 -15.742
    3    HB2  GLU 819           HB2      GLU 819  38.682 -11.795 -16.623
    4    HB3  GLU 819           HB3      GLU 819  39.111 -13.276 -15.809
    5    HG2  GLU 819           HG2      GLU 819  37.772 -14.569 -17.281
    6    HG3  GLU 819           HG3      GLU 819  37.061 -13.112 -17.992

  No H/Q in entry =           6
  In of MODEL   23
    1    H    ALA 820           H        ALA 820  38.588 -14.316 -14.064
    2    HA   ALA 820           HA       ALA 820  36.878 -16.500 -14.273
    3    HB3  ALA 820           HB1      ALA 820  38.892 -16.007 -12.103
    4    HB1  ALA 820           HB2      ALA 820  39.253 -16.681 -13.698
    5    HB2  ALA 820           HB3      ALA 820  38.234 -17.575 -12.568

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLY 821           H        GLY 821  37.170 -13.982 -11.815
    2    HA3  GLY 821           HA2      GLY 821  35.458 -15.083  -9.869
    3    HA2  GLY 821           HA3      GLY 821  35.867 -13.374 -10.037

  No H/Q in entry =           3
  In of MODEL   23
    1    H    ALA 822           H        ALA 822  34.869 -12.957 -12.614
    2    HA   ALA 822           HA       ALA 822  32.166 -12.494 -12.122
    3    HB1  ALA 822           HB1      ALA 822  33.586 -12.557 -14.794
    4    HB2  ALA 822           HB2      ALA 822  33.564 -11.192 -13.693
    5    HB3  ALA 822           HB3      ALA 822  32.058 -11.743 -14.431

  No H/Q in entry =           5
  In of MODEL   23
    1    H    LEU 823           H        LEU 823  33.818 -15.048 -13.956
    2    HA   LEU 823           HA       LEU 823  31.443 -16.304 -14.804
    3    HB2  LEU 823           HB2      LEU 823  34.201 -17.475 -14.443
    4    HB3  LEU 823           HB3      LEU 823  32.848 -18.465 -14.921
    5    HG   LEU 823           HG       LEU 823  33.934 -18.045 -16.902
    6   HD11  LEU 823          HD11      LEU 823  31.591 -17.629 -17.149
    7   HD13  LEU 823          HD12      LEU 823  32.543 -16.656 -18.267
    8   HD12  LEU 823          HD13      LEU 823  31.846 -15.911 -16.835
    9   HD21  LEU 823          HD21      LEU 823  35.522 -16.365 -16.175
   10   HD23  LEU 823          HD22      LEU 823  34.255 -15.145 -16.158
   11   HD22  LEU 823          HD23      LEU 823  34.754 -15.877 -17.681

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ARG 824           H        ARG 824  33.346 -16.786 -11.839
    2    HA   ARG 824           HA       ARG 824  31.808 -18.857 -10.721
    3    HB2  ARG 824           HB2      ARG 824  33.351 -16.605  -9.467
    4    HB3  ARG 824           HB3      ARG 824  32.489 -17.802  -8.522
    5    HG2  ARG 824           HG2      ARG 824  33.930 -19.545  -9.402
    6    HG3  ARG 824           HG3      ARG 824  34.785 -18.348 -10.397
    7    HD2  ARG 824           HD2      ARG 824  35.910 -18.936  -8.233
    8    HD3  ARG 824           HD3      ARG 824  35.573 -17.216  -8.443
    9    HE   ARG 824           HE       ARG 824  33.425 -18.477  -7.123
   10   HH11  ARG 824          HH11      ARG 824  36.773 -17.605  -6.389
   11   HH12  ARG 824          HH12      ARG 824  36.382 -17.112  -4.789
   12   HH21  ARG 824          HH21      ARG 824  33.021 -17.898  -4.891
   13   HH22  ARG 824          HH22      ARG 824  34.325 -17.306  -3.924

  No H/Q in entry =          13
  In of MODEL   23
    1    H    CYS 825           H        CYS 825  31.521 -15.369 -10.529
    2    HA   CYS 825           HA       CYS 825  29.479 -15.273  -8.652
    3    HB2  CYS 825           HB2      CYS 825  31.043 -13.371  -9.476
    4    HB3  CYS 825           HB3      CYS 825  29.882 -13.213 -10.767

  No H/Q in entry =           4
  In of MODEL   23
    1    H    ARG 826           H        ARG 826  29.341 -15.187 -12.219
    2    HA   ARG 826           HA       ARG 826  26.522 -14.909 -12.299
    3    HB2  ARG 826           HB2      ARG 826  26.694 -15.551 -14.694
    4    HB3  ARG 826           HB3      ARG 826  27.800 -14.247 -14.246
    5    HG2  ARG 826           HG2      ARG 826  29.609 -15.833 -14.181
    6    HG3  ARG 826           HG3      ARG 826  28.499 -17.139 -14.596
    7    HD2  ARG 826           HD2      ARG 826  29.033 -14.715 -16.306
    8    HD3  ARG 826           HD3      ARG 826  29.787 -16.294 -16.525
    9    HE   ARG 826           HE       ARG 826  26.985 -16.540 -16.488
   10   HH11  ARG 826          HH11      ARG 826  29.602 -15.399 -18.601
   11   HH12  ARG 826          HH12      ARG 826  28.769 -15.706 -20.045
   12   HH21  ARG 826          HH21      ARG 826  25.819 -16.943 -18.493
   13   HH22  ARG 826          HH22      ARG 826  26.559 -16.591 -19.973

  No H/Q in entry =          13
  In of MODEL   23
    1    H    GLY 827           H        GLY 827  28.595 -17.727 -12.161
    2    HA3  GLY 827           HA2      GLY 827  27.582 -19.690 -11.132
    3    HA2  GLY 827           HA3      GLY 827  26.130 -19.308 -12.047

  No H/Q in entry =           3
  In of MODEL   23
    1    H    GLN 828           H        GLN 828  28.959 -18.828 -13.807
    2    HA   GLN 828           HA       GLN 828  28.444 -20.933 -15.644
    3    HB2  GLN 828           HB2      GLN 828  29.581 -18.863 -16.310
    4    HB3  GLN 828           HB3      GLN 828  30.899 -19.210 -15.207
    5    HG2  GLN 828           HG2      GLN 828  31.558 -19.706 -17.525
    6    HG3  GLN 828           HG3      GLN 828  31.501 -21.152 -16.529
    7   HE21  GLN 828          HE21      GLN 828  29.885 -19.423 -19.071
    8   HE22  GLN 828          HE22      GLN 828  28.923 -20.750 -19.599

  No H/Q in entry =           8
  In of MODEL   23
    1    H    SER 829           H        SER 829  29.657 -22.844 -15.964
    2    HA   SER 829           HA       SER 829  30.587 -24.002 -13.507
    3    HB2  SER 829           HB2      SER 829  30.491 -25.143 -16.313
    4    HB3  SER 829           HB3      SER 829  30.774 -26.059 -14.832
    5    HG   SER 829           HG       SER 829  28.408 -24.764 -15.693

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ILE 830           H        ILE 830  32.578 -23.408 -12.855
    2    HA   ILE 830           HA       ILE 830  34.771 -23.752 -14.714
    3    HB   ILE 830           HB       ILE 830  35.902 -21.723 -14.109
    4   HG12  ILE 830          HG12      ILE 830  35.114 -21.629 -11.700
    5   HG13  ILE 830          HG13      ILE 830  35.215 -20.079 -12.517
    6   HG21  ILE 830          HG21      ILE 830  34.304 -21.400 -15.893
    7   HG23  ILE 830          HG22      ILE 830  34.481 -19.935 -14.933
    8   HG22  ILE 830          HG23      ILE 830  33.066 -20.966 -14.714
    9   HD13  ILE 830          HD11      ILE 830  32.824 -20.085 -12.820
   10   HD12  ILE 830          HD12      ILE 830  33.268 -20.202 -11.126
   11   HD11  ILE 830          HD13      ILE 830  32.693 -21.642 -11.990

  No H/Q in entry =          11
  In of MODEL   23
    1    H    SER 831           H        SER 831  36.581 -24.565 -13.770
    2    HA   SER 831           HA       SER 831  36.325 -25.191 -10.920
    3    HB2  SER 831           HB2      SER 831  37.629 -26.653 -13.172
    4    HB3  SER 831           HB3      SER 831  37.713 -27.143 -11.486
    5    HG   SER 831           HG       SER 831  35.156 -26.710 -12.240

  No H/Q in entry =           5
  In of MODEL   23
    1    H    VAL 832           H        VAL 832  37.635 -23.692  -9.920
    2    HA   VAL 832           HA       VAL 832  40.080 -22.780 -11.112
    3    HB   VAL 832           HB       VAL 832  39.210 -22.525  -8.209
    4   HG11  VAL 832          HG11      VAL 832  41.591 -22.116  -8.523
    5   HG13  VAL 832          HG12      VAL 832  40.755 -20.614  -8.130
    6   HG12  VAL 832          HG13      VAL 832  41.236 -20.944  -9.795
    7   HG21  VAL 832          HG21      VAL 832  37.528 -21.535  -9.681
    8   HG23  VAL 832          HG22      VAL 832  38.780 -20.598 -10.496
    9   HG22  VAL 832          HG23      VAL 832  38.402 -20.276  -8.806

  No H/Q in entry =           9
  In of MODEL   23
    1    H    THR 833           H        THR 833  41.614 -24.259 -11.431
    2    HA   THR 833           HA       THR 833  41.882 -26.516  -9.759
    3    HB   THR 833           HB       THR 833  43.888 -26.858 -11.360
    4    HG1  THR 833           HG1      THR 833  43.810 -25.548 -13.185
    5   HG21  THR 833          HG21      THR 833  41.077 -26.581 -12.468
    6   HG23  THR 833          HG22      THR 833  41.713 -28.003 -11.645
    7   HG22  THR 833          HG23      THR 833  42.367 -27.517 -13.209

  No H/Q in entry =           7
  In of MODEL   23
    1    H    SER 834           H        SER 834  43.736 -23.566 -10.349
    2    HA   SER 834           HA       SER 834  44.762 -23.596  -7.679
    3    HB2  SER 834           HB2      SER 834  46.627 -23.921 -10.036
    4    HB3  SER 834           HB3      SER 834  47.167 -23.388  -8.445
    5    HG   SER 834           HG       SER 834  45.649 -25.710  -8.543

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ILE 835           H        ILE 835  45.764 -21.532  -7.159
    2    HA   ILE 835           HA       ILE 835  44.517 -19.519  -8.771
    3    HB   ILE 835           HB       ILE 835  44.757 -17.976  -7.048
    4   HG12  ILE 835          HG12      ILE 835  47.169 -18.350  -6.444
    5   HG13  ILE 835          HG13      ILE 835  46.125 -18.128  -5.055
    6   HG23  ILE 835          HG21      ILE 835  43.092 -19.563  -6.567
    7   HG22  ILE 835          HG22      ILE 835  43.902 -19.151  -5.040
    8   HG21  ILE 835          HG23      ILE 835  44.271 -20.666  -5.852
    9   HD13  ILE 835          HD11      ILE 835  46.143 -20.412  -4.633
   10   HD12  ILE 835          HD12      ILE 835  47.799 -19.772  -4.733
   11   HD11  ILE 835          HD13      ILE 835  47.130 -20.749  -6.071

  No H/Q in entry =          11
  In of MODEL   23
    1    H    ARG 836           H        ARG 836  46.793 -20.885  -9.807
    2    HA   ARG 836           HA       ARG 836  48.859 -18.820 -10.012
    3    HB2  ARG 836           HB2      ARG 836  48.969 -21.766 -10.624
    4    HB3  ARG 836           HB3      ARG 836  50.294 -20.633 -10.864
    5    HG2  ARG 836           HG2      ARG 836  50.266 -20.151  -8.463
    6    HG3  ARG 836           HG3      ARG 836  49.014 -21.380  -8.261
    7    HD2  ARG 836           HD2      ARG 836  51.788 -21.802  -9.327
    8    HD3  ARG 836           HD3      ARG 836  51.149 -22.223  -7.730
    9    HE   ARG 836           HE       ARG 836  49.668 -23.389  -9.901
   10   HH11  ARG 836          HH11      ARG 836  52.489 -23.896  -7.849
   11   HH12  ARG 836          HH12      ARG 836  52.548 -25.570  -8.104
   12   HH21  ARG 836          HH21      ARG 836  49.726 -25.654 -10.245
   13   HH22  ARG 836          HH22      ARG 836  50.914 -26.604  -9.494

  No H/Q in entry =          13
  In of MODEL   23
    1    HA   PRO 837           HA       PRO 837  47.330 -18.709 -14.251
    2    HB2  PRO 837           HB2      PRO 837  49.785 -17.805 -15.416
    3    HB3  PRO 837           HB3      PRO 837  48.389 -16.832 -14.973
    4    HG2  PRO 837           HG2      PRO 837  50.882 -16.734 -13.727
    5    HG3  PRO 837           HG3      PRO 837  49.371 -16.097 -13.067
    6    HD2  PRO 837           HD2      PRO 837  50.809 -18.615 -12.423
    7    HD3  PRO 837           HD3      PRO 837  49.786 -17.594 -11.392

  No H/Q in entry =           7
  In of MODEL   23
    1    H    CYS 838           H        CYS 838  47.205 -20.197 -15.889
    2    HA   CYS 838           HA       CYS 838  49.283 -22.184 -15.993
    3    HB2  CYS 838           HB2      CYS 838  46.483 -22.102 -17.053
    4    HB3  CYS 838           HB3      CYS 838  47.625 -23.273 -17.695

  No H/Q in entry =           4
  In of MODEL   23
    1    H    ALA 839           H        ALA 839  49.682 -23.028 -18.366
    2    HA   ALA 839           HA       ALA 839  50.419 -20.772 -20.003
    3    HB2  ALA 839           HB1      ALA 839  52.053 -22.592 -19.703
    4    HB3  ALA 839           HB2      ALA 839  51.577 -22.443 -21.393
    5    HB1  ALA 839           HB3      ALA 839  50.906 -23.739 -20.399

  No H/Q in entry =           5
  In of MODEL   23
    1    H    ALA 840           H        ALA 840  48.151 -20.411 -20.026
    2    HA   ALA 840           HA       ALA 840  46.910 -21.502 -22.463
    3    HB3  ALA 840           HB1      ALA 840  45.932 -22.685 -20.559
    4    HB1  ALA 840           HB2      ALA 840  44.753 -21.625 -21.340
    5    HB2  ALA 840           HB3      ALA 840  45.509 -21.139 -19.820

  No H/Q in entry =           5
  In of MODEL   23
    1    H    GLU 841           H        GLU 841  48.346 -19.080 -21.815
    2    HA   GLU 841           HA       GLU 841  46.278 -17.066 -21.769
    3    HB2  GLU 841           HB2      GLU 841  48.396 -15.507 -21.796
    4    HB3  GLU 841           HB3      GLU 841  47.906 -16.311 -20.320
    5    HG2  GLU 841           HG2      GLU 841  50.311 -16.409 -20.578
    6    HG3  GLU 841           HG3      GLU 841  49.623 -18.022 -20.687

  No H/Q in entry =           6
  In of MODEL   23
    1    H    THR 842           H        THR 842  47.579 -18.943 -23.984
    2    HA   THR 842           HA       THR 842  47.756 -17.093 -26.138
    3    HB   THR 842           HB       THR 842  47.827 -19.416 -27.334
    4    HG1  THR 842           HG1      THR 842  47.684 -21.029 -26.006
    5   HG22  THR 842          HG21      THR 842  50.237 -19.582 -26.834
    6   HG21  THR 842          HG22      THR 842  50.013 -18.490 -25.465
    7   HG23  THR 842          HG23      THR 842  49.746 -17.911 -27.109

  No H/Q in entry =           7
  In of MODEL   23
    1    H    GLN 843           H        GLN 843  46.080 -16.565 -27.358
    2    HA   GLN 843           HA       GLN 843  43.556 -17.986 -26.956
    3    HB2  GLN 843           HB2      GLN 843  44.099 -15.150 -27.849
    4    HB3  GLN 843           HB3      GLN 843  42.497 -15.875 -27.733
    5    HG2  GLN 843           HG2      GLN 843  42.716 -16.139 -25.365
    6    HG3  GLN 843           HG3      GLN 843  44.400 -15.637 -25.415
    7   HE21  GLN 843          HE21      GLN 843  44.008 -14.007 -23.937
    8   HE22  GLN 843          HE22      GLN 843  43.182 -12.556 -24.390

  No H/Q in entry =           8
  In of MODEL   24
    1    H1   GLY 689           H1       GLY 689  78.981   4.599 -11.690
    2    H2   GLY 689           H3       GLY 689  78.911   3.899 -13.216
    3    H3   GLY 689           H2       GLY 689  78.312   5.460 -12.995
    4    HA2  GLY 689           HA2      GLY 689  76.524   3.853 -13.113
    5    HA3  GLY 689           HA3      GLY 689  76.609   4.585 -11.512

  No H/Q in entry =           5
  In of MODEL   24
    1    H    SER 690           H        SER 690  75.346   2.395 -11.321
    2    HA   SER 690           HA       SER 690  76.931   0.731  -9.719
    3    HB2  SER 690           HB2      SER 690  74.157   0.292 -10.821
    4    HB3  SER 690           HB3      SER 690  74.863  -0.505  -9.415
    5    HG   SER 690           HG       SER 690  75.199   1.769  -8.683

  No H/Q in entry =           5
  In of MODEL   24
    1    H    HIS 691           H        HIS 691  78.497  -0.444 -10.718
    2    HA   HIS 691           HA       HIS 691  77.535  -2.319 -12.738
    3    HB2  HIS 691           HB2      HIS 691  78.891  -0.477 -13.801
    4    HB3  HIS 691           HB3      HIS 691  80.279  -1.016 -12.870
    5    HD1  HIS 691           HD1      HIS 691  78.053  -2.060 -15.715
    6    HD2  HIS 691           HD2      HIS 691  81.627  -3.230 -13.951
    7    HE1  HIS 691           HE1      HIS 691  79.004  -3.811 -17.228
    8    HE2  HIS 691           HE2      HIS 691  80.995  -4.695 -15.978

  No H/Q in entry =           8
  In of MODEL   24
    1    H    MET 692           H        MET 692  78.585  -2.069  -9.717
    2    HA   MET 692           HA       MET 692  80.533  -4.184  -9.643
    3    HB2  MET 692           HB2      MET 692  80.329  -2.455  -7.834
    4    HB3  MET 692           HB3      MET 692  78.772  -3.145  -7.405
    5    HG2  MET 692           HG2      MET 692  80.406  -3.930  -5.852
    6    HG3  MET 692           HG3      MET 692  79.904  -5.277  -6.871
    7    HE2  MET 692           HE1      MET 692  83.660  -6.135  -6.186
    8    HE1  MET 692           HE2      MET 692  81.995  -6.714  -6.121
    9    HE3  MET 692           HE3      MET 692  82.517  -5.405  -5.059

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ASN 693           H        ASN 693  77.105  -3.873  -8.933
    2    HA   ASN 693           HA       ASN 693  76.762  -6.773  -8.865
    3    HB2  ASN 693           HB2      ASN 693  74.889  -4.479  -8.212
    4    HB3  ASN 693           HB3      ASN 693  74.329  -6.132  -8.350
    5   HD21  ASN 693          HD21      ASN 693  77.408  -5.297  -6.921
    6   HD22  ASN 693          HD22      ASN 693  76.968  -5.702  -5.298

  No H/Q in entry =           6
  In of MODEL   24
    1    HA   PRO 694           HA       PRO 694  75.329  -6.400 -13.134
    2    HB2  PRO 694           HB2      PRO 694  74.424  -9.161 -12.912
    3    HB3  PRO 694           HB3      PRO 694  75.721  -8.512 -13.917
    4    HG2  PRO 694           HG2      PRO 694  76.176 -10.128 -11.786
    5    HG3  PRO 694           HG3      PRO 694  77.320  -8.888 -12.323
    6    HD2  PRO 694           HD2      PRO 694  75.380  -8.817 -10.045
    7    HD3  PRO 694           HD3      PRO 694  77.051  -8.208 -10.146

  No H/Q in entry =           7
  In of MODEL   24
    1    H    LEU 695           H        LEU 695  73.471  -5.324 -13.345
    2    HA   LEU 695           HA       LEU 695  71.067  -6.551 -12.245
    3    HB2  LEU 695           HB2      LEU 695  70.076  -4.380 -11.833
    4    HB3  LEU 695           HB3      LEU 695  71.597  -4.481 -10.996
    5    HG   LEU 695           HG       LEU 695  71.242  -2.987 -13.607
    6   HD11  LEU 695          HD11      LEU 695  71.126  -1.962 -10.772
    7   HD13  LEU 695          HD12      LEU 695  69.782  -2.029 -11.911
    8   HD12  LEU 695          HD13      LEU 695  71.152  -0.964 -12.222
    9   HD21  LEU 695          HD21      LEU 695  73.565  -3.586 -13.043
   10   HD23  LEU 695          HD22      LEU 695  73.367  -2.835 -11.460
   11   HD22  LEU 695          HD23      LEU 695  73.300  -1.849 -12.919

  No H/Q in entry =          11
  In of MODEL   24
    1    H    THR 696           H        THR 696  69.132  -6.118 -13.468
    2    HA   THR 696           HA       THR 696  69.750  -6.408 -16.246
    3    HB   THR 696           HB       THR 696  67.227  -6.618 -16.464
    4    HG1  THR 696           HG1      THR 696  67.312  -5.649 -13.974
    5   HG22  THR 696          HG21      THR 696  68.626  -8.459 -14.520
    6   HG21  THR 696          HG22      THR 696  68.688  -8.576 -16.279
    7   HG23  THR 696          HG23      THR 696  67.165  -8.845 -15.429

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLN 697           H        GLN 697  69.707  -4.873 -17.741
    2    HA   GLN 697           HA       GLN 697  68.775  -2.257 -16.935
    3    HB2  GLN 697           HB2      GLN 697  69.795  -1.361 -18.993
    4    HB3  GLN 697           HB3      GLN 697  70.945  -2.246 -18.019
    5    HG2  GLN 697           HG2      GLN 697  69.618  -3.276 -20.531
    6    HG3  GLN 697           HG3      GLN 697  71.228  -2.573 -20.450
    7   HE21  GLN 697          HE21      GLN 697  69.304  -5.364 -19.945
    8   HE22  GLN 697          HE22      GLN 697  70.578  -6.422 -19.457

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ALA 698           H        ALA 698  67.311  -4.775 -18.028
    2    HA   ALA 698           HA       ALA 698  65.424  -3.477 -19.906
    3    HB1  ALA 698           HB1      ALA 698  64.329  -5.665 -19.861
    4    HB3  ALA 698           HB2      ALA 698  65.477  -6.231 -18.645
    5    HB2  ALA 698           HB3      ALA 698  66.029  -5.847 -20.276

  No H/Q in entry =           5
  In of MODEL   24
    1    H    VAL 699           H        VAL 699  63.219  -3.406 -19.435
    2    HA   VAL 699           HA       VAL 699  62.957  -2.188 -16.957
    3    HB   VAL 699           HB       VAL 699  60.788  -1.682 -17.612
    4   HG12  VAL 699          HG11      VAL 699  62.612  -1.457 -19.973
    5   HG11  VAL 699          HG12      VAL 699  62.452  -0.334 -18.621
    6   HG13  VAL 699          HG13      VAL 699  61.127  -0.526 -19.766
    7   HG23  VAL 699          HG21      VAL 699  59.716  -2.479 -19.733
    8   HG22  VAL 699          HG22      VAL 699  59.937  -3.732 -18.512
    9   HG21  VAL 699          HG23      VAL 699  61.030  -3.650 -19.889

  No H/Q in entry =           9
  In of MODEL   24
    1    HA   PRO 700           HA       PRO 700  62.145  -5.887 -14.812
    2    HB2  PRO 700           HB2      PRO 700  61.366  -4.814 -12.445
    3    HB3  PRO 700           HB3      PRO 700  63.035  -5.046 -12.972
    4    HG2  PRO 700           HG2      PRO 700  61.421  -2.555 -12.852
    5    HG3  PRO 700           HG3      PRO 700  63.175  -2.757 -12.730
    6    HD2  PRO 700           HD2      PRO 700  61.779  -1.873 -14.983
    7    HD3  PRO 700           HD3      PRO 700  63.449  -2.470 -14.955

  No H/Q in entry =           7
  In of MODEL   24
    1    H    LYS 701           H        LYS 701  60.589  -7.077 -15.083
    2    HA   LYS 701           HA       LYS 701  57.828  -6.125 -14.948
    3    HB2  LYS 701           HB2      LYS 701  58.894  -8.816 -15.819
    4    HB3  LYS 701           HB3      LYS 701  57.238  -8.264 -15.966
    5    HG2  LYS 701           HG2      LYS 701  59.600  -7.057 -17.340
    6    HG3  LYS 701           HG3      LYS 701  58.451  -8.183 -18.090
    7    HD2  LYS 701           HD2      LYS 701  56.659  -6.529 -17.647
    8    HD3  LYS 701           HD3      LYS 701  57.878  -5.426 -17.007
    9    HE2  LYS 701           HE2      LYS 701  57.374  -4.837 -19.302
   10    HE3  LYS 701           HE3      LYS 701  59.016  -5.463 -19.183
   11    HZ1  LYS 701           HZ1      LYS 701  58.201  -7.605 -20.008
   12    HZ3  LYS 701           HZ2      LYS 701  57.945  -6.376 -21.094
   13    HZ2  LYS 701           HZ3      LYS 701  56.649  -6.964 -20.179

  No H/Q in entry =          13
  In of MODEL   24
    1    H    CYS 702           H        CYS 702  56.945  -6.287 -13.076
    2    HA   CYS 702           HA       CYS 702  57.953  -8.327 -11.227
    3    HB2  CYS 702           HB2      CYS 702  56.215  -5.973 -10.443
    4    HB3  CYS 702           HB3      CYS 702  57.239  -6.958  -9.435

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLN 703           H        GLN 703  56.532  -9.798 -10.417
    2    HA   GLN 703           HA       GLN 703  54.186 -10.325 -11.950
    3    HB2  GLN 703           HB2      GLN 703  55.197 -11.565  -9.401
    4    HB3  GLN 703           HB3      GLN 703  53.883 -12.199 -10.377
    5    HG2  GLN 703           HG2      GLN 703  56.715 -11.855 -11.348
    6    HG3  GLN 703           HG3      GLN 703  56.050 -13.356 -10.711
    7   HE21  GLN 703          HE21      GLN 703  56.378 -14.438 -12.606
    8   HE22  GLN 703          HE22      GLN 703  55.450 -14.184 -14.037

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ARG 704           H        ARG 704  52.132 -10.978 -10.629
    2    HA   ARG 704           HA       ARG 704  50.824  -8.648  -9.839
    3    HB2  ARG 704           HB2      ARG 704  50.155 -11.490  -9.166
    4    HB3  ARG 704           HB3      ARG 704  49.074 -10.136  -8.924
    5    HG2  ARG 704           HG2      ARG 704  50.184 -11.002 -11.569
    6    HG3  ARG 704           HG3      ARG 704  48.610 -11.459 -10.918
    7    HD2  ARG 704           HD2      ARG 704  47.990  -9.054 -10.855
    8    HD3  ARG 704           HD3      ARG 704  49.541  -8.682 -11.610
    9    HE   ARG 704           HE       ARG 704  48.301 -10.596 -13.178
   10   HH11  ARG 704          HH11      ARG 704  47.872  -7.145 -12.393
   11   HH12  ARG 704          HH12      ARG 704  46.965  -6.810 -13.780
   12   HH21  ARG 704          HH21      ARG 704  47.073 -10.113 -15.097
   13   HH22  ARG 704          HH22      ARG 704  46.529  -8.515 -15.376

  No H/Q in entry =          13
  In of MODEL   24
    1    H    TRP 705           H        TRP 705  52.529 -10.986  -7.876
    2    HA   TRP 705           HA       TRP 705  51.605  -9.819  -5.379
    3    HB2  TRP 705           HB2      TRP 705  52.941 -11.721  -4.377
    4    HB3  TRP 705           HB3      TRP 705  51.582 -12.178  -5.398
    5    HD1  TRP 705           HD1      TRP 705  55.374 -12.456  -5.154
    6    HE1  TRP 705           HE1      TRP 705  56.230 -13.996  -7.004
    7    HE3  TRP 705           HE3      TRP 705  51.054 -12.989  -7.858
    8    HZ2  TRP 705           HZ2      TRP 705  55.224 -15.302  -9.294
    9    HZ3  TRP 705           HZ3      TRP 705  51.096 -14.404  -9.870
   10    HH2  TRP 705           HH2      TRP 705  53.137 -15.538 -10.571

  No H/Q in entry =          10
  In of MODEL   24
    1    H    GLU 706           H        GLU 706  53.844  -9.092  -7.540
    2    HA   GLU 706           HA       GLU 706  55.836  -8.238  -5.599
    3    HB2  GLU 706           HB2      GLU 706  56.058  -8.680  -8.566
    4    HB3  GLU 706           HB3      GLU 706  57.324  -7.973  -7.557
    5    HG2  GLU 706           HG2      GLU 706  57.404 -10.124  -6.344
    6    HG3  GLU 706           HG3      GLU 706  56.241 -10.771  -7.508

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LYS 707           H        LYS 707  56.600  -6.166  -5.875
    2    HA   LYS 707           HA       LYS 707  55.107  -4.392  -7.620
    3    HB2  LYS 707           HB2      LYS 707  55.490  -4.048  -4.648
    4    HB3  LYS 707           HB3      LYS 707  55.048  -2.724  -5.713
    5    HG2  LYS 707           HG2      LYS 707  53.369  -5.158  -5.789
    6    HG3  LYS 707           HG3      LYS 707  53.234  -4.165  -4.354
    7    HD2  LYS 707           HD2      LYS 707  51.534  -3.464  -5.871
    8    HD3  LYS 707           HD3      LYS 707  52.753  -2.208  -5.867
    9    HE2  LYS 707           HE2      LYS 707  51.985  -2.568  -8.115
   10    HE3  LYS 707           HE3      LYS 707  53.648  -3.118  -8.007
   11    HZ2  LYS 707           HZ1      LYS 707  52.264  -4.634  -9.265
   12    HZ1  LYS 707           HZ2      LYS 707  51.231  -4.880  -7.969
   13    HZ3  LYS 707           HZ3      LYS 707  52.833  -5.411  -7.901

  No H/Q in entry =          13
  In of MODEL   24
    1    H    LEU 708           H        LEU 708  56.259  -2.512  -8.126
    2    HA   LEU 708           HA       LEU 708  59.109  -2.936  -8.048
    3    HB2  LEU 708           HB2      LEU 708  57.997  -2.448 -10.173
    4    HB3  LEU 708           HB3      LEU 708  57.393  -0.941  -9.519
    5    HG   LEU 708           HG       LEU 708  59.748  -0.144  -9.331
    6   HD12  LEU 708          HD11      LEU 708  61.487  -1.337 -10.559
    7   HD11  LEU 708          HD12      LEU 708  60.368  -2.674 -10.836
    8   HD13  LEU 708          HD13      LEU 708  60.880  -2.275  -9.198
    9   HD23  LEU 708          HD21      LEU 708  60.052   0.238 -11.722
   10   HD22  LEU 708          HD22      LEU 708  58.376   0.476 -11.227
   11   HD21  LEU 708          HD23      LEU 708  58.846  -1.000 -12.075

  No H/Q in entry =          11
  In of MODEL   24
    1    H    GLN 709           H        GLN 709  60.052  -2.180  -6.256
    2    HA   GLN 709           HA       GLN 709  59.703   0.649  -5.647
    3    HB2  GLN 709           HB2      GLN 709  59.469   0.368  -3.321
    4    HB3  GLN 709           HB3      GLN 709  58.441  -0.923  -3.921
    5    HG2  GLN 709           HG2      GLN 709  60.239  -2.548  -3.546
    6    HG3  GLN 709           HG3      GLN 709  61.295  -1.233  -3.018
    7   HE21  GLN 709          HE21      GLN 709  61.614  -2.214  -1.018
    8   HE22  GLN 709          HE22      GLN 709  60.386  -2.210   0.193

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ASN 710           H        ASN 710  61.673   1.470  -4.795
    2    HA   ASN 710           HA       ASN 710  63.940   1.577  -4.406
    3    HB2  ASN 710           HB2      ASN 710  63.219  -0.238  -2.774
    4    HB3  ASN 710           HB3      ASN 710  63.817  -1.420  -3.942
    5   HD21  ASN 710          HD21      ASN 710  64.958   1.660  -2.898
    6   HD22  ASN 710          HD22      ASN 710  66.501   1.118  -2.311

  No H/Q in entry =           6
  In of MODEL   24
    1    H    SER 711           H        SER 711  62.763   0.892  -7.047
    2    HA   SER 711           HA       SER 711  63.366   0.512  -9.160
    3    HB2  SER 711           HB2      SER 711  66.148   0.490  -8.006
    4    HB3  SER 711           HB3      SER 711  65.790   0.578  -9.739
    5    HG   SER 711           HG       SER 711  65.843   2.533  -7.889

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ARG 712           H        ARG 712  62.902  -1.780  -7.209
    2    HA   ARG 712           HA       ARG 712  63.816  -3.875  -9.010
    3    HB2  ARG 712           HB2      ARG 712  64.474  -5.275  -7.099
    4    HB3  ARG 712           HB3      ARG 712  65.482  -3.843  -7.255
    5    HG2  ARG 712           HG2      ARG 712  64.320  -2.804  -5.420
    6    HG3  ARG 712           HG3      ARG 712  63.188  -4.147  -5.333
    7    HD2  ARG 712           HD2      ARG 712  65.094  -5.666  -4.851
    8    HD3  ARG 712           HD3      ARG 712  66.181  -4.284  -4.868
    9    HE   ARG 712           HE       ARG 712  64.398  -3.584  -2.996
   10   HH11  ARG 712          HH11      ARG 712  66.254  -6.575  -3.479
   11   HH12  ARG 712          HH12      ARG 712  66.352  -6.964  -1.838
   12   HH21  ARG 712          HH21      ARG 712  64.491  -4.153  -0.722
   13   HH22  ARG 712          HH22      ARG 712  65.299  -5.546  -0.217

  No H/Q in entry =          13
  In of MODEL   24
    1    H    CYS 713           H        CYS 713  62.694  -6.001  -8.378
    2    HA   CYS 713           HA       CYS 713  59.902  -5.379  -7.741
    3    HB2  CYS 713           HB2      CYS 713  61.095  -7.876  -8.983
    4    HB3  CYS 713           HB3      CYS 713  59.382  -7.590  -8.723

  No H/Q in entry =           4
  In of MODEL   24
    1    H    VAL 714           H        VAL 714  59.299  -5.779  -5.746
    2    HA   VAL 714           HA       VAL 714  60.520  -8.038  -4.293
    3    HB   VAL 714           HB       VAL 714  60.178  -6.802  -2.191
    4   HG11  VAL 714          HG11      VAL 714  61.778  -5.220  -4.183
    5   HG13  VAL 714          HG12      VAL 714  62.351  -6.591  -3.238
    6   HG12  VAL 714          HG13      VAL 714  61.915  -5.083  -2.432
    7   HG23  VAL 714          HG21      VAL 714  59.569  -4.403  -2.205
    8   HG22  VAL 714          HG22      VAL 714  58.275  -5.417  -2.845
    9   HG21  VAL 714          HG23      VAL 714  59.294  -4.503  -3.946

  No H/Q in entry =           9
  In of MODEL   24
    1    H    CYS 715           H        CYS 715  58.921  -8.708  -2.472
    2    HA   CYS 715           HA       CYS 715  56.280  -8.802  -3.671
    3    HB2  CYS 715           HB2      CYS 715  57.384 -10.131  -1.167
    4    HB3  CYS 715           HB3      CYS 715  55.759 -10.342  -1.789

  No H/Q in entry =           4
  In of MODEL   24
    1    H    LYS 716           H        LYS 716  54.525  -7.857  -2.745
    2    HA   LYS 716           HA       LYS 716  55.156  -5.615  -1.037
    3    HB2  LYS 716           HB2      LYS 716  53.388  -5.801  -2.994
    4    HB3  LYS 716           HB3      LYS 716  52.343  -6.444  -1.744
    5    HG2  LYS 716           HG2      LYS 716  51.899  -4.064  -2.045
    6    HG3  LYS 716           HG3      LYS 716  52.618  -4.322  -0.459
    7    HD2  LYS 716           HD2      LYS 716  54.785  -3.596  -1.281
    8    HD3  LYS 716           HD3      LYS 716  54.154  -3.411  -2.895
    9    HE2  LYS 716           HE2      LYS 716  54.300  -1.256  -1.849
   10    HE3  LYS 716           HE3      LYS 716  52.613  -1.676  -2.086
   11    HZ3  LYS 716           HZ1      LYS 716  52.322  -2.025   0.228
   12    HZ2  LYS 716           HZ2      LYS 716  53.240  -0.639   0.080
   13    HZ1  LYS 716           HZ3      LYS 716  53.997  -2.076   0.511

  No H/Q in entry =          13
  In of MODEL   24
    1    H    MET 717           H        MET 717  52.746  -5.603   0.572
    2    HA   MET 717           HA       MET 717  53.507  -7.622   2.539
    3    HB2  MET 717           HB2      MET 717  51.797  -5.134   2.745
    4    HB3  MET 717           HB3      MET 717  52.106  -6.232   4.072
    5    HG2  MET 717           HG2      MET 717  54.393  -4.925   2.678
    6    HG3  MET 717           HG3      MET 717  53.422  -3.981   3.793
    7    HE2  MET 717           HE1      MET 717  56.164  -7.527   4.974
    8    HE1  MET 717           HE2      MET 717  55.955  -6.922   3.324
    9    HE3  MET 717           HE3      MET 717  54.676  -7.859   4.106

  No H/Q in entry =           9
  In of MODEL   24
    1    HA   PRO 718           HA       PRO 718  49.921  -9.956   1.419
    2    HB2  PRO 718           HB2      PRO 718  49.476 -11.415   3.648
    3    HB3  PRO 718           HB3      PRO 718  50.874 -11.691   2.599
    4    HG2  PRO 718           HG2      PRO 718  50.717 -10.186   5.185
    5    HG3  PRO 718           HG3      PRO 718  51.957 -11.319   4.624
    6    HD2  PRO 718           HD2      PRO 718  52.251  -8.613   4.517
    7    HD3  PRO 718           HD3      PRO 718  53.020  -9.724   3.364

  No H/Q in entry =           7
  In of MODEL   24
    1    H    TYR 719           H        TYR 719  49.625  -7.388   3.293
    2    HA   TYR 719           HA       TYR 719  46.765  -7.827   3.733
    3    HB2  TYR 719           HB2      TYR 719  46.897  -6.103   5.556
    4    HB3  TYR 719           HB3      TYR 719  47.743  -7.603   5.892
    5    HD1  TYR 719           HD1      TYR 719  48.099  -4.019   5.263
    6    HD2  TYR 719           HD2      TYR 719  50.182  -7.649   6.013
    7    HE1  TYR 719           HE1      TYR 719  50.114  -2.742   5.840
    8    HE2  TYR 719           HE2      TYR 719  52.193  -6.382   6.607
    9    HH   TYR 719           HH       TYR 719  53.180  -4.312   6.350

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLU 720           H        GLU 720  48.684  -6.520   1.615
    2    HA   GLU 720           HA       GLU 720  47.436  -3.874   1.308
    3    HB2  GLU 720           HB2      GLU 720  49.532  -5.338  -0.305
    4    HB3  GLU 720           HB3      GLU 720  49.065  -3.658  -0.520
    5    HG2  GLU 720           HG2      GLU 720  50.055  -4.616   2.095
    6    HG3  GLU 720           HG3      GLU 720  51.218  -4.266   0.820

  No H/Q in entry =           6
  In of MODEL   24
    1    H    CYS 721           H        CYS 721  46.441  -6.757   0.863
    2    HA   CYS 721           HA       CYS 721  45.905  -6.919  -1.947
    3    HB2  CYS 721           HB2      CYS 721  45.141  -8.701   0.336
    4    HB3  CYS 721           HB3      CYS 721  45.015  -9.084  -1.377

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLY 722           H        GLY 722  44.304  -5.726  -2.704
    2    HA3  GLY 722           HA2      GLY 722  41.807  -5.602  -1.186
    3    HA2  GLY 722           HA3      GLY 722  42.280  -4.481  -2.454

  No H/Q in entry =           3
  In of MODEL   24
    1    HA   PRO 723           HA       PRO 723  40.112  -7.011  -5.261
    2    HB2  PRO 723           HB2      PRO 723  41.762  -6.629  -7.543
    3    HB3  PRO 723           HB3      PRO 723  40.349  -5.687  -7.066
    4    HG2  PRO 723           HG2      PRO 723  42.981  -4.762  -7.103
    5    HG3  PRO 723           HG3      PRO 723  41.628  -3.999  -6.257
    6    HD2  PRO 723           HD2      PRO 723  43.781  -5.769  -5.193
    7    HD3  PRO 723           HD3      PRO 723  42.957  -4.395  -4.427

  No H/Q in entry =           7
  In of MODEL   24
    1    H    SER 724           H        SER 724  40.522  -9.118  -4.362
    2    HA   SER 724           HA       SER 724  41.801 -10.832  -6.270
    3    HB2  SER 724           HB2      SER 724  42.692 -10.737  -3.390
    4    HB3  SER 724           HB3      SER 724  43.068 -12.063  -4.491
    5    HG   SER 724           HG       SER 724  43.714  -9.910  -5.743

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU 725           H        LEU 725  41.114 -13.010  -6.132
    2    HA   LEU 725           HA       LEU 725  38.523 -13.489  -5.084
    3    HB2  LEU 725           HB2      LEU 725  40.631 -15.158  -6.393
    4    HB3  LEU 725           HB3      LEU 725  39.202 -15.908  -5.726
    5    HG   LEU 725           HG       LEU 725  39.014 -13.742  -7.813
    6   HD12  LEU 725          HD11      LEU 725  38.864 -15.548  -9.469
    7   HD11  LEU 725          HD12      LEU 725  39.222 -16.739  -8.219
    8   HD13  LEU 725          HD13      LEU 725  40.444 -15.556  -8.688
    9   HD23  LEU 725          HD21      LEU 725  36.881 -14.826  -8.259
   10   HD22  LEU 725          HD22      LEU 725  36.990 -14.303  -6.581
   11   HD21  LEU 725          HD23      LEU 725  37.204 -16.007  -6.990

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ASP 726           H        ASP 726  37.988 -14.149  -3.086
    2    HA   ASP 726           HA       ASP 726  40.034 -15.050  -1.301
    3    HB2  ASP 726           HB2      ASP 726  37.033 -14.868  -0.911
    4    HB3  ASP 726           HB3      ASP 726  38.138 -15.471   0.313

  No H/Q in entry =           4
  In of MODEL   24
    1    H    VAL 727           H        VAL 727  40.469 -16.994  -0.736
    2    HA   VAL 727           HA       VAL 727  38.999 -19.206  -1.987
    3    HB   VAL 727           HB       VAL 727  41.195 -20.288  -2.578
    4   HG11  VAL 727          HG11      VAL 727  40.666 -17.648  -3.961
    5   HG13  VAL 727          HG12      VAL 727  39.902 -19.189  -4.349
    6   HG12  VAL 727          HG13      VAL 727  41.622 -18.964  -4.637
    7   HG22  VAL 727          HG21      VAL 727  43.214 -18.879  -2.736
    8   HG21  VAL 727          HG22      VAL 727  42.629 -19.014  -1.073
    9   HG23  VAL 727          HG23      VAL 727  42.313 -17.549  -1.997

  No H/Q in entry =           9
  In of MODEL   24
    1    H    CYS 728           H        CYS 728  39.488 -21.281  -0.958
    2    HA   CYS 728           HA       CYS 728  40.260 -20.908   1.831
    3    HB2  CYS 728           HB2      CYS 728  38.953 -23.254   0.456
    4    HB3  CYS 728           HB3      CYS 728  39.347 -23.179   2.167

  No H/Q in entry =           4
  In of MODEL   24
    1    H    ALA 729           H        ALA 729  42.095 -21.641   2.578
    2    HA   ALA 729           HA       ALA 729  43.652 -23.425   0.868
    3    HB3  ALA 729           HB1      ALA 729  44.486 -21.148   0.669
    4    HB2  ALA 729           HB2      ALA 729  45.639 -22.171   1.532
    5    HB1  ALA 729           HB3      ALA 729  44.610 -21.046   2.426

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLN 730           H        GLN 730  45.285 -24.529   2.133
    2    HA   GLN 730           HA       GLN 730  44.383 -25.006   4.866
    3    HB2  GLN 730           HB2      GLN 730  44.320 -27.006   3.420
    4    HB3  GLN 730           HB3      GLN 730  46.006 -26.756   3.030
    5    HG2  GLN 730           HG2      GLN 730  46.672 -27.159   5.276
    6    HG3  GLN 730           HG3      GLN 730  45.012 -27.290   5.820
    7   HE21  GLN 730          HE21      GLN 730  45.212 -29.378   6.538
    8   HE22  GLN 730          HE22      GLN 730  45.477 -30.733   5.515

  No H/Q in entry =           8
  In of MODEL   24
    1    H    ASP 731           H        ASP 731  45.604 -24.325   6.360
    2    HA   ASP 731           HA       ASP 731  48.107 -23.016   5.866
    3    HB2  ASP 731           HB2      ASP 731  46.502 -22.302   7.672
    4    HB3  ASP 731           HB3      ASP 731  46.813 -23.814   8.494

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLU 732           H        GLU 732  50.054 -24.114   5.724
    2    HA   GLU 732           HA       GLU 732  50.027 -26.892   6.154
    3    HB2  GLU 732           HB2      GLU 732  52.202 -25.013   5.378
    4    HB3  GLU 732           HB3      GLU 732  52.557 -26.695   5.751
    5    HG2  GLU 732           HG2      GLU 732  50.604 -25.754   3.667
    6    HG3  GLU 732           HG3      GLU 732  52.245 -26.324   3.355

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ARG 733           H        ARG 733  50.695 -24.395   8.449
    2    HA   ARG 733           HA       ARG 733  52.324 -26.211   9.958
    3    HB2  ARG 733           HB2      ARG 733  51.419 -23.399  10.530
    4    HB3  ARG 733           HB3      ARG 733  52.550 -24.336  11.480
    5    HG2  ARG 733           HG2      ARG 733  52.947 -23.286   8.679
    6    HG3  ARG 733           HG3      ARG 733  53.779 -22.757  10.137
    7    HD2  ARG 733           HD2      ARG 733  54.033 -25.438   8.762
    8    HD3  ARG 733           HD3      ARG 733  55.246 -24.167   8.830
    9    HE   ARG 733           HE       ARG 733  54.541 -24.946  11.433
   10   HH11  ARG 733          HH11      ARG 733  56.490 -26.016   8.668
   11   HH12  ARG 733          HH12      ARG 733  57.396 -27.145   9.552
   12   HH21  ARG 733          HH21      ARG 733  55.786 -26.512  12.656
   13   HH22  ARG 733          HH22      ARG 733  56.990 -27.419  11.894

  No H/Q in entry =          13
  In of MODEL   24
    1    H    SER 734           H        SER 734  49.196 -24.632  10.041
    2    HA   SER 734           HA       SER 734  48.487 -25.876  12.585
    3    HB2  SER 734           HB2      SER 734  46.691 -24.204  10.834
    4    HB3  SER 734           HB3      SER 734  46.657 -24.383  12.589
    5    HG   SER 734           HG       SER 734  48.538 -23.029  10.979

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LYS 735           H        LYS 735  48.047 -26.393   9.188
    2    HA   LYS 735           HA       LYS 735  47.084 -27.798   7.910
    3    HB2  LYS 735           HB2      LYS 735  46.951 -29.497  10.371
    4    HB3  LYS 735           HB3      LYS 735  46.331 -30.062   8.827
    5    HG2  LYS 735           HG2      LYS 735  49.169 -29.305   9.503
    6    HG3  LYS 735           HG3      LYS 735  48.554 -30.903   9.068
    7    HD2  LYS 735           HD2      LYS 735  47.861 -29.817   6.837
    8    HD3  LYS 735           HD3      LYS 735  48.890 -28.476   7.323
    9    HE2  LYS 735           HE2      LYS 735  49.735 -31.329   6.899
   10    HE3  LYS 735           HE3      LYS 735  50.133 -29.947   5.884
   11    HZ3  LYS 735           HZ1      LYS 735  51.989 -30.510   7.320
   12    HZ2  LYS 735           HZ2      LYS 735  51.051 -30.387   8.677
   13    HZ1  LYS 735           HZ3      LYS 735  51.400 -29.013   7.790

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ARG 736           H        ARG 736  45.361 -25.869   9.414
    2    HA   ARG 736           HA       ARG 736  42.765 -27.160   8.959
    3    HB2  ARG 736           HB2      ARG 736  41.729 -25.263   9.992
    4    HB3  ARG 736           HB3      ARG 736  43.006 -25.874  11.038
    5    HG2  ARG 736           HG2      ARG 736  44.363 -24.059  10.654
    6    HG3  ARG 736           HG3      ARG 736  43.539 -23.639   9.151
    7    HD2  ARG 736           HD2      ARG 736  42.320 -23.432  11.899
    8    HD3  ARG 736           HD3      ARG 736  43.078 -22.131  10.968
    9    HE   ARG 736           HE       ARG 736  40.947 -23.435   9.532
   10   HH11  ARG 736          HH11      ARG 736  41.611 -20.872  11.886
   11   HH12  ARG 736          HH12      ARG 736  40.210 -19.989  11.527
   12   HH21  ARG 736          HH21      ARG 736  39.087 -22.218   8.993
   13   HH22  ARG 736          HH22      ARG 736  38.731 -20.744   9.794

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ILE 737           H        ILE 737  41.163 -26.105   7.714
    2    HA   ILE 737           HA       ILE 737  42.254 -24.800   5.390
    3    HB   ILE 737           HB       ILE 737  39.323 -25.212   6.014
    4   HG12  ILE 737          HG12      ILE 737  40.507 -27.407   6.264
    5   HG13  ILE 737          HG13      ILE 737  39.379 -27.383   4.920
    6   HG21  ILE 737          HG21      ILE 737  40.147 -23.768   4.121
    7   HG23  ILE 737          HG22      ILE 737  39.052 -25.067   3.663
    8   HG22  ILE 737          HG23      ILE 737  40.787 -25.234   3.377
    9   HD11  ILE 737          HD11      ILE 737  41.217 -27.037   3.396
   10   HD13  ILE 737          HD12      ILE 737  41.411 -28.535   4.317
   11   HD12  ILE 737          HD13      ILE 737  42.371 -27.103   4.731

  No H/Q in entry =          11
  In of MODEL   24
    1    H    LEU 738           H        LEU 738  42.405 -22.661   5.359
    2    HA   LEU 738           HA       LEU 738  40.588 -21.116   7.053
    3    HB2  LEU 738           HB2      LEU 738  42.249 -19.537   7.636
    4    HB3  LEU 738           HB3      LEU 738  42.963 -21.107   7.988
    5    HG   LEU 738           HG       LEU 738  43.581 -19.263   5.670
    6   HD11  LEU 738          HD11      LEU 738  44.414 -18.440   7.785
    7   HD13  LEU 738          HD12      LEU 738  45.742 -18.982   6.757
    8   HD12  LEU 738          HD13      LEU 738  45.194 -19.991   8.096
    9   HD23  LEU 738          HD21      LEU 738  45.408 -20.782   5.150
   10   HD22  LEU 738          HD22      LEU 738  43.828 -21.564   5.036
   11   HD21  LEU 738          HD23      LEU 738  44.856 -21.875   6.436

  No H/Q in entry =          11
  In of MODEL   24
    1    HA   PRO 739           HA       PRO 739  39.831 -18.894   3.332
    2    HB2  PRO 739           HB2      PRO 739  39.016 -16.532   4.323
    3    HB3  PRO 739           HB3      PRO 739  38.013 -17.995   4.430
    4    HG2  PRO 739           HG2      PRO 739  39.690 -16.678   6.516
    5    HG3  PRO 739           HG3      PRO 739  38.107 -17.460   6.677
    6    HD2  PRO 739           HD2      PRO 739  40.520 -18.667   7.318
    7    HD3  PRO 739           HD3      PRO 739  39.029 -19.543   6.892

  No H/Q in entry =           7
  In of MODEL   24
    1    H    LEU 740           H        LEU 740  41.308 -18.096   2.054
    2    HA   LEU 740           HA       LEU 740  42.985 -15.898   2.987
    3    HB2  LEU 740           HB2      LEU 740  43.816 -18.264   1.323
    4    HB3  LEU 740           HB3      LEU 740  44.718 -16.772   1.336
    5    HG   LEU 740           HG       LEU 740  44.308 -18.651   3.657
    6   HD13  LEU 740          HD11      LEU 740  45.845 -19.450   2.013
    7   HD12  LEU 740          HD12      LEU 740  46.745 -18.916   3.436
    8   HD11  LEU 740          HD13      LEU 740  46.687 -17.909   1.972
    9   HD21  LEU 740          HD21      LEU 740  45.814 -16.031   3.522
   10   HD23  LEU 740          HD22      LEU 740  45.870 -17.175   4.861
   11   HD22  LEU 740          HD23      LEU 740  44.364 -16.351   4.478

  No H/Q in entry =          11
  In of MODEL   24
    1    H    THR 741           H        THR 741  44.092 -15.149   0.731
    2    HA   THR 741           HA       THR 741  41.978 -14.976  -1.251
    3    HB   THR 741           HB       THR 741  43.580 -12.543  -0.452
    4    HG1  THR 741           HG1      THR 741  40.998 -13.133   0.617
    5   HG23  THR 741          HG21      THR 741  41.630 -11.371  -1.332
    6   HG22  THR 741          HG22      THR 741  40.815 -12.924  -1.549
    7   HG21  THR 741          HG23      THR 741  42.242 -12.548  -2.505

  No H/Q in entry =           7
  In of MODEL   24
    1    H    VAL 742           H        VAL 742  42.888 -14.619  -3.347
    2    HA   VAL 742           HA       VAL 742  45.137 -15.970  -4.058
    3    HB   VAL 742           HB       VAL 742  44.064 -13.551  -5.455
    4   HG11  VAL 742          HG11      VAL 742  45.817 -15.702  -6.551
    5   HG13  VAL 742          HG12      VAL 742  46.142 -13.973  -6.417
    6   HG12  VAL 742          HG13      VAL 742  44.905 -14.551  -7.525
    7   HG21  VAL 742          HG21      VAL 742  43.293 -16.429  -5.661
    8   HG23  VAL 742          HG22      VAL 742  42.833 -15.168  -6.818
    9   HG22  VAL 742          HG23      VAL 742  42.314 -15.051  -5.135

  No H/Q in entry =           9
  In of MODEL   24
    1    H    CYS 743           H        CYS 743  45.055 -12.408  -3.832
    2    HA   CYS 743           HA       CYS 743  47.729 -11.947  -4.184
    3    HB2  CYS 743           HB2      CYS 743  46.246 -10.109  -4.219
    4    HB3  CYS 743           HB3      CYS 743  45.681 -10.454  -2.589

  No H/Q in entry =           4
  In of MODEL   24
    1    H    LYS 744           H        LYS 744  46.033 -12.357  -1.063
    2    HA   LYS 744           HA       LYS 744  48.219 -12.056   0.617
    3    HB2  LYS 744           HB2      LYS 744  45.800 -13.817   1.016
    4    HB3  LYS 744           HB3      LYS 744  47.002 -13.489   2.252
    5    HG2  LYS 744           HG2      LYS 744  46.424 -11.070   2.083
    6    HG3  LYS 744           HG3      LYS 744  45.153 -11.492   0.939
    7    HD2  LYS 744           HD2      LYS 744  44.186 -11.222   3.154
    8    HD3  LYS 744           HD3      LYS 744  44.093 -12.913   2.672
    9    HE2  LYS 744           HE2      LYS 744  44.756 -12.768   4.993
   10    HE3  LYS 744           HE3      LYS 744  46.109 -13.385   4.061
   11    HZ2  LYS 744           HZ1      LYS 744  45.758 -10.692   5.260
   12    HZ1  LYS 744           HZ2      LYS 744  46.910 -10.943   4.082
   13    HZ3  LYS 744           HZ3      LYS 744  46.998 -11.798   5.530

  No H/Q in entry =          13
  In of MODEL   24
    1    H    MET 745           H        MET 745  46.887 -15.068  -0.655
    2    HA   MET 745           HA       MET 745  48.747 -16.850   0.364
    3    HB2  MET 745           HB2      MET 745  47.012 -17.878  -0.487
    4    HB3  MET 745           HB3      MET 745  46.825 -16.863  -1.902
    5    HG2  MET 745           HG2      MET 745  47.510 -18.884  -2.831
    6    HG3  MET 745           HG3      MET 745  49.017 -18.034  -2.664
    7    HE1  MET 745           HE1      MET 745  46.735 -20.769  -1.285
    8    HE3  MET 745           HE2      MET 745  46.934 -19.855   0.215
    9    HE2  MET 745           HE3      MET 745  47.639 -21.463   0.051

  No H/Q in entry =           9
  In of MODEL   24
    1    H    HIS 746           H        HIS 746  48.851 -15.069  -2.711
    2    HA   HIS 746           HA       HIS 746  51.223 -16.364  -3.628
    3    HB2  HIS 746           HB2      HIS 746  49.688 -14.018  -4.467
    4    HB3  HIS 746           HB3      HIS 746  51.362 -14.109  -5.052
    5    HD1  HIS 746           HD1      HIS 746  51.760 -16.597  -6.327
    6    HD2  HIS 746           HD2      HIS 746  47.918 -15.062  -6.058
    7    HE1  HIS 746           HE1      HIS 746  50.522 -17.589  -8.234
    8    HE2  HIS 746           HE2      HIS 746  48.152 -16.705  -8.022

  No H/Q in entry =           8
  In of MODEL   24
    1    H    VAL 747           H        VAL 747  50.687 -13.206  -2.117
    2    HA   VAL 747           HA       VAL 747  53.362 -12.347  -2.136
    3    HB   VAL 747           HB       VAL 747  51.005 -11.619  -0.364
    4   HG12  VAL 747          HG11      VAL 747  53.692 -10.232  -0.524
    5   HG11  VAL 747          HG12      VAL 747  53.116 -11.186   0.844
    6   HG13  VAL 747          HG13      VAL 747  52.293  -9.698   0.413
    7   HG23  VAL 747          HG21      VAL 747  52.393 -10.216  -2.603
    8   HG22  VAL 747          HG22      VAL 747  50.993  -9.586  -1.711
    9   HG21  VAL 747          HG23      VAL 747  50.839 -11.037  -2.720

  No H/Q in entry =           9
  In of MODEL   24
    1    H    LEU 748           H        LEU 748  51.422 -13.855   0.347
    2    HA   LEU 748           HA       LEU 748  53.457 -14.095   2.208
    3    HB2  LEU 748           HB2      LEU 748  51.507 -14.310   3.286
    4    HB3  LEU 748           HB3      LEU 748  50.678 -14.837   1.858
    5    HG   LEU 748           HG       LEU 748  52.222 -16.709   3.636
    6   HD11  LEU 748          HD11      LEU 748  49.304 -15.952   3.669
    7   HD13  LEU 748          HD12      LEU 748  50.486 -15.553   4.915
    8   HD12  LEU 748          HD13      LEU 748  50.040 -17.234   4.625
    9   HD21  LEU 748          HD21      LEU 748  51.648 -17.480   1.316
   10   HD23  LEU 748          HD22      LEU 748  49.941 -17.244   1.727
   11   HD22  LEU 748          HD23      LEU 748  50.905 -18.419   2.599

  No H/Q in entry =          11
  In of MODEL   24
    1    H    HIS 749           H        HIS 749  52.594 -16.099  -0.495
    2    HA   HIS 749           HA       HIS 749  54.161 -18.358   0.256
    3    HB2  HIS 749           HB2      HIS 749  52.254 -18.170  -1.543
    4    HB3  HIS 749           HB3      HIS 749  53.567 -17.698  -2.614
    5    HD1  HIS 749           HD1      HIS 749  55.184 -19.584  -3.386
    6    HD2  HIS 749           HD2      HIS 749  52.275 -20.776  -0.699
    7    HE1  HIS 749           HE1      HIS 749  55.327 -22.081  -3.330
    8    HE2  HIS 749           HE2      HIS 749  53.838 -22.740  -1.455

  No H/Q in entry =           8
  In of MODEL   24
    1    H    CYS 750           H        CYS 750  54.771 -15.453  -1.746
    2    HA   CYS 750           HA       CYS 750  57.388 -16.413  -2.381
    3    HB2  CYS 750           HB2      CYS 750  57.780 -14.256  -3.492
    4    HB3  CYS 750           HB3      CYS 750  56.261 -14.971  -4.006

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLN 751           H        GLN 751  55.979 -14.584   0.209
    2    HA   GLN 751           HA       GLN 751  58.450 -13.662   1.197
    3    HB2  GLN 751           HB2      GLN 751  55.856 -14.171   2.668
    4    HB3  GLN 751           HB3      GLN 751  57.236 -13.314   3.342
    5    HG2  GLN 751           HG2      GLN 751  57.043 -11.649   1.531
    6    HG3  GLN 751           HG3      GLN 751  55.616 -12.489   0.953
    7   HE21  GLN 751          HE21      GLN 751  55.895  -9.801   1.837
    8   HE22  GLN 751          HE22      GLN 751  54.805  -9.587   3.150

  No H/Q in entry =           8
  In of MODEL   24
    1    H    GLY 752           H        GLY 752  56.934 -16.730   1.150
    2    HA3  GLY 752           HA2      GLY 752  58.599 -18.542   1.395
    3    HA2  GLY 752           HA3      GLY 752  59.097 -17.758   2.880

  No H/Q in entry =           3
  In of MODEL   24
    1    H    ARG 753           H        ARG 753  55.742 -17.645   2.648
    2    HA   ARG 753           HA       ARG 753  55.501 -19.629   4.731
    3    HB2  ARG 753           HB2      ARG 753  53.430 -18.083   3.251
    4    HB3  ARG 753           HB3      ARG 753  53.146 -19.013   4.709
    5    HG2  ARG 753           HG2      ARG 753  54.949 -16.613   4.526
    6    HG3  ARG 753           HG3      ARG 753  53.304 -16.535   5.103
    7    HD2  ARG 753           HD2      ARG 753  53.955 -18.274   6.833
    8    HD3  ARG 753           HD3      ARG 753  55.629 -17.911   6.391
    9    HE   ARG 753           HE       ARG 753  54.720 -15.490   6.784
   10   HH11  ARG 753          HH11      ARG 753  54.386 -18.342   8.813
   11   HH12  ARG 753          HH12      ARG 753  54.076 -17.482  10.248
   12   HH21  ARG 753          HH21      ARG 753  54.277 -14.278   8.740
   13   HH22  ARG 753          HH22      ARG 753  54.037 -15.094  10.197

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ASN 754           H        ASN 754  54.256 -21.513   4.612
    2    HA   ASN 754           HA       ASN 754  53.884 -22.555   1.900
    3    HB2  ASN 754           HB2      ASN 754  54.418 -24.021   4.484
    4    HB3  ASN 754           HB3      ASN 754  54.110 -24.795   2.936
    5   HD21  ASN 754          HD21      ASN 754  56.440 -24.781   4.721
    6   HD22  ASN 754          HD22      ASN 754  57.759 -24.257   3.738

  No H/Q in entry =           6
  In of MODEL   24
    1    H    TYR 755           H        TYR 755  51.941 -22.964   1.272
    2    HA   TYR 755           HA       TYR 755  49.871 -23.744   3.140
    3    HB2  TYR 755           HB2      TYR 755  49.747 -21.313   1.368
    4    HB3  TYR 755           HB3      TYR 755  48.285 -22.167   1.830
    5    HD1  TYR 755           HD1      TYR 755  47.315 -21.814   3.930
    6    HD2  TYR 755           HD2      TYR 755  51.193 -20.308   3.166
    7    HE1  TYR 755           HE1      TYR 755  47.234 -20.553   6.029
    8    HE2  TYR 755           HE2      TYR 755  51.118 -19.028   5.259
    9    HH   TYR 755           HH       TYR 755  48.840 -19.715   7.610

  No H/Q in entry =           9
  In of MODEL   24
    1    H    THR 756           H        THR 756  48.080 -24.726   2.065
    2    HA   THR 756           HA       THR 756  48.709 -25.704  -0.633
    3    HB   THR 756           HB       THR 756  47.205 -27.073   1.626
    4    HG1  THR 756           HG1      THR 756  49.137 -27.609   2.292
    5   HG21  THR 756          HG21      THR 756  46.487 -27.756  -0.611
    6   HG23  THR 756          HG22      THR 756  47.337 -29.060   0.223
    7   HG22  THR 756          HG23      THR 756  48.160 -28.125  -1.035

  No H/Q in entry =           7
  In of MODEL   24
    1    H    LEU 757           H        LEU 757  46.760 -25.823  -2.028
    2    HA   LEU 757           HA       LEU 757  44.680 -24.158  -0.890
    3    HB2  LEU 757           HB2      LEU 757  45.324 -24.632  -3.776
    4    HB3  LEU 757           HB3      LEU 757  43.902 -23.766  -3.219
    5    HG   LEU 757           HG       LEU 757  45.849 -22.496  -1.874
    6   HD13  LEU 757          HD11      LEU 757  47.666 -21.974  -3.412
    7   HD12  LEU 757          HD12      LEU 757  47.067 -23.207  -4.520
    8   HD11  LEU 757          HD13      LEU 757  47.653 -23.667  -2.920
    9   HD23  LEU 757          HD21      LEU 757  44.912 -21.773  -4.628
   10   HD22  LEU 757          HD22      LEU 757  45.484 -20.676  -3.340
   11   HD21  LEU 757          HD23      LEU 757  43.990 -21.570  -3.140

  No H/Q in entry =          11
  In of MODEL   24
    1    H    THR 758           H        THR 758  42.523 -24.551  -1.216
    2    HA   THR 758           HA       THR 758  41.861 -27.325  -1.757
    3    HB   THR 758           HB       THR 758  40.432 -27.299   0.342
    4    HG1  THR 758           HG1      THR 758  41.390 -24.769   0.402
    5   HG23  THR 758          HG21      THR 758  42.601 -28.473   0.334
    6   HG22  THR 758          HG22      THR 758  42.303 -27.746   1.907
    7   HG21  THR 758          HG23      THR 758  43.420 -26.979   0.783

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLY 759           H        GLY 759  39.254 -27.387  -1.492
    2    HA3  GLY 759           HA2      GLY 759  38.218 -25.565  -3.404
    3    HA2  GLY 759           HA3      GLY 759  37.293 -26.741  -2.476

  No H/Q in entry =           3
  In of MODEL   24
    1    H    ARG 760           H        ARG 760  36.459 -24.090  -3.076
    2    HA   ARG 760           HA       ARG 760  36.987 -22.348  -0.833
    3    HB2  ARG 760           HB2      ARG 760  35.725 -20.700  -1.892
    4    HB3  ARG 760           HB3      ARG 760  36.239 -21.667  -3.260
    5    HG2  ARG 760           HG2      ARG 760  33.538 -21.810  -1.920
    6    HG3  ARG 760           HG3      ARG 760  33.882 -20.974  -3.435
    7    HD2  ARG 760           HD2      ARG 760  34.402 -23.085  -4.498
    8    HD3  ARG 760           HD3      ARG 760  34.243 -23.920  -2.948
    9    HE   ARG 760           HE       ARG 760  31.900 -22.493  -3.665
   10   HH11  ARG 760          HH11      ARG 760  33.619 -25.533  -4.180
   11   HH12  ARG 760          HH12      ARG 760  32.234 -26.426  -4.595
   12   HH21  ARG 760          HH21      ARG 760  29.976 -23.718  -4.191
   13   HH22  ARG 760          HH22      ARG 760  30.110 -25.359  -4.612

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ASP 761           H        ASP 761  35.111 -25.012  -1.148
    2    HA   ASP 761           HA       ASP 761  33.008 -24.167   0.637
    3    HB2  ASP 761           HB2      ASP 761  32.066 -26.401   0.159
    4    HB3  ASP 761           HB3      ASP 761  32.382 -25.484  -1.309

  No H/Q in entry =           4
  In of MODEL   24
    1    H    SER 762           H        SER 762  36.122 -25.245   0.902
    2    HA   SER 762           HA       SER 762  35.701 -27.098   3.063
    3    HB2  SER 762           HB2      SER 762  38.250 -25.957   1.910
    4    HB3  SER 762           HB3      SER 762  38.160 -27.279   3.076
    5    HG   SER 762           HG       SER 762  36.728 -28.275   1.457

  No H/Q in entry =           5
  In of MODEL   24
    1    H    CYS 763           H        CYS 763  36.258 -23.676   2.755
    2    HA   CYS 763           HA       CYS 763  36.448 -23.571   5.678
    3    HB2  CYS 763           HB2      CYS 763  37.843 -21.664   5.617
    4    HB3  CYS 763           HB3      CYS 763  38.569 -22.803   4.497

  No H/Q in entry =           4
  In of MODEL   24
    1    H    THR 764           H        THR 764  35.716 -21.351   6.433
    2    HA   THR 764           HA       THR 764  33.244 -20.667   5.098
    3    HB   THR 764           HB       THR 764  34.439 -19.601   7.676
    4    HG1  THR 764           HG1      THR 764  33.101 -21.984   7.054
    5   HG22  THR 764          HG21      THR 764  31.589 -19.749   6.672
    6   HG21  THR 764          HG22      THR 764  32.584 -18.294   6.730
    7   HG23  THR 764          HG23      THR 764  32.102 -19.096   8.228

  No H/Q in entry =           7
  In of MODEL   24
    1    H    LEU 765           H        LEU 765  33.608 -19.296   3.429
    2    HA   LEU 765           HA       LEU 765  35.937 -17.660   3.305
    3    HB2  LEU 765           HB2      LEU 765  34.439 -18.903   1.463
    4    HB3  LEU 765           HB3      LEU 765  33.661 -17.337   1.403
    5    HG   LEU 765           HG       LEU 765  35.754 -16.289   0.717
    6   HD13  LEU 765          HD11      LEU 765  37.348 -17.684   1.940
    7   HD12  LEU 765          HD12      LEU 765  37.718 -17.744   0.218
    8   HD11  LEU 765          HD13      LEU 765  36.869 -19.083   0.985
    9   HD21  LEU 765          HD21      LEU 765  35.154 -18.791  -0.850
   10   HD23  LEU 765          HD22      LEU 765  36.050 -17.403  -1.436
   11   HD22  LEU 765          HD23      LEU 765  34.330 -17.237  -1.037

  No H/Q in entry =          11
  In of MODEL   24
    1    HA   PRO 766           HA       PRO 766  34.329 -14.132   5.380
    2    HB2  PRO 766           HB2      PRO 766  35.897 -12.155   4.435
    3    HB3  PRO 766           HB3      PRO 766  36.510 -13.423   5.504
    4    HG2  PRO 766           HG2      PRO 766  36.632 -13.233   2.528
    5    HG3  PRO 766           HG3      PRO 766  37.944 -13.618   3.665
    6    HD2  PRO 766           HD2      PRO 766  36.654 -15.554   2.331
    7    HD3  PRO 766           HD3      PRO 766  37.178 -15.786   4.009

  No H/Q in entry =           7
  In of MODEL   24
    1    H    ALA 767           H        ALA 767  34.013 -11.618   4.804
    2    HA   ALA 767           HA       ALA 767  32.568 -10.125   4.113
    3    HB1  ALA 767           HB1      ALA 767  32.822 -11.396   1.403
    4    HB2  ALA 767           HB2      ALA 767  33.921 -10.190   2.087
    5    HB3  ALA 767           HB3      ALA 767  32.224  -9.770   1.767

  No H/Q in entry =           5
  In of MODEL   24
    1    H    SER 768           H        SER 768  30.864 -10.560   5.258
    2    HA   SER 768           HA       SER 768  28.576 -11.658   3.993
    3    HB2  SER 768           HB2      SER 768  29.883 -13.696   4.832
    4    HB3  SER 768           HB3      SER 768  29.619 -12.977   6.439
    5    HG   SER 768           HG       SER 768  28.019 -14.596   5.200

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA 769           H        ALA 769  27.350 -10.043   4.606
    2    HA   ALA 769           HA       ALA 769  26.634  -9.655   7.332
    3    HB2  ALA 769           HB1      ALA 769  28.005  -7.397   5.875
    4    HB1  ALA 769           HB2      ALA 769  28.663  -8.341   7.215
    5    HB3  ALA 769           HB3      ALA 769  27.240  -7.306   7.478

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLU 770           H        GLU 770  25.020  -7.555   7.266
    2    HA   GLU 770           HA       GLU 770  23.386  -8.285   5.049
    3    HB2  GLU 770           HB2      GLU 770  21.553  -6.927   6.113
    4    HB3  GLU 770           HB3      GLU 770  22.158  -8.290   7.040
    5    HG2  GLU 770           HG2      GLU 770  23.455  -6.765   8.429
    6    HG3  GLU 770           HG3      GLU 770  22.826  -5.394   7.507

  No H/Q in entry =           6
  In of MODEL   24
    1    H    LYS 771           H        LYS 771  24.677  -7.560   3.554
    2    HA   LYS 771           HA       LYS 771  24.302  -4.728   2.823
    3    HB2  LYS 771           HB2      LYS 771  26.736  -6.406   2.098
    4    HB3  LYS 771           HB3      LYS 771  26.513  -4.686   1.837
    5    HG2  LYS 771           HG2      LYS 771  26.771  -6.036   4.512
    6    HG3  LYS 771           HG3      LYS 771  28.033  -5.124   3.687
    7    HD2  LYS 771           HD2      LYS 771  26.961  -3.091   4.031
    8    HD3  LYS 771           HD3      LYS 771  25.385  -3.849   4.275
    9    HE2  LYS 771           HE2      LYS 771  26.117  -4.813   6.296
   10    HE3  LYS 771           HE3      LYS 771  27.727  -4.093   6.150
   11    HZ3  LYS 771           HZ1      LYS 771  26.658  -1.888   6.277
   12    HZ2  LYS 771           HZ2      LYS 771  26.286  -2.797   7.644
   13    HZ1  LYS 771           HZ3      LYS 771  25.155  -2.610   6.421

  No H/Q in entry =          13
  In of MODEL   24
    1    H    ALA 772           H        ALA 772  25.073  -4.778   0.255
    2    HA   ALA 772           HA       ALA 772  23.085  -6.074  -1.243
    3    HB1  ALA 772           HB1      ALA 772  25.816  -5.241  -2.203
    4    HB2  ALA 772           HB2      ALA 772  24.469  -4.131  -1.928
    5    HB3  ALA 772           HB3      ALA 772  24.317  -5.405  -3.135

  No H/Q in entry =           5
  In of MODEL   24
    1    H    CYS 773           H        CYS 773  22.763  -8.092  -1.302
    2    HA   CYS 773           HA       CYS 773  22.936 -10.273  -1.138
    3    HB2  CYS 773           HB2      CYS 773  25.140  -9.752  -3.087
    4    HB3  CYS 773           HB3      CYS 773  24.422 -11.329  -2.735

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLY 774           H        GLY 774  24.697  -8.766   0.784
    2    HA3  GLY 774           HA2      GLY 774  25.650  -9.660   2.721
    3    HA2  GLY 774           HA3      GLY 774  25.897 -11.177   1.873

  No H/Q in entry =           3
  In of MODEL   24
    1    H    ALA 775           H        ALA 775  27.152  -9.528  -0.372
    2    HA   ALA 775           HA       ALA 775  29.625  -8.673   0.783
    3    HB1  ALA 775           HB1      ALA 775  29.506 -11.191  -0.871
    4    HB3  ALA 775           HB2      ALA 775  29.935 -11.090   0.835
    5    HB2  ALA 775           HB3      ALA 775  30.977 -10.354  -0.382

  No H/Q in entry =           5
  In of MODEL   24
    1    H    CYS 776           H        CYS 776  30.425  -7.197  -0.493
    2    HA   CYS 776           HA       CYS 776  29.540  -7.099  -3.281
    3    HB2  CYS 776           HB2      CYS 776  30.572  -4.853  -1.526
    4    HB3  CYS 776           HB3      CYS 776  30.013  -4.687  -3.187

  No H/Q in entry =           4
  In of MODEL   24
    1    HA   PRO 777           HA       PRO 777  34.024  -7.795  -3.533
    2    HB2  PRO 777           HB2      PRO 777  33.975  -9.952  -5.136
    3    HB3  PRO 777           HB3      PRO 777  33.681 -10.069  -3.400
    4    HG2  PRO 777           HG2      PRO 777  31.794 -10.370  -5.628
    5    HG3  PRO 777           HG3      PRO 777  31.645 -10.904  -3.949
    6    HD2  PRO 777           HD2      PRO 777  30.533  -8.528  -5.191
    7    HD3  PRO 777           HD3      PRO 777  30.273  -9.152  -3.550

  No H/Q in entry =           7
  In of MODEL   24
    1    H    LEU 778           H        LEU 778  35.261  -8.424  -5.695
    2    HA   LEU 778           HA       LEU 778  35.215  -6.206  -7.417
    3    HB2  LEU 778           HB2      LEU 778  36.321  -8.952  -8.012
    4    HB3  LEU 778           HB3      LEU 778  36.707  -7.476  -8.848
    5    HG   LEU 778           HG       LEU 778  38.065  -6.714  -6.967
    6   HD13  LEU 778          HD11      LEU 778  36.801  -7.643  -5.070
    7   HD12  LEU 778          HD12      LEU 778  38.486  -8.167  -5.023
    8   HD11  LEU 778          HD13      LEU 778  37.232  -9.267  -5.586
    9   HD21  LEU 778          HD21      LEU 778  39.018  -8.175  -8.667
   10   HD23  LEU 778          HD22      LEU 778  38.519  -9.567  -7.710
   11   HD22  LEU 778          HD23      LEU 778  39.739  -8.464  -7.073

  No H/Q in entry =          11
  In of MODEL   24
    1    H    TRP 779           H        TRP 779  34.451  -9.578  -8.080
    2    HA   TRP 779           HA       TRP 779  33.380  -9.190 -10.675
    3    HB2  TRP 779           HB2      TRP 779  32.862 -11.675 -10.421
    4    HB3  TRP 779           HB3      TRP 779  34.554 -11.220 -10.277
    5    HD1  TRP 779           HD1      TRP 779  31.674 -12.684  -8.261
    6    HE1  TRP 779           HE1      TRP 779  32.541 -13.422  -5.943
    7    HE3  TRP 779           HE3      TRP 779  36.409 -10.815  -8.532
    8    HZ2  TRP 779           HZ2      TRP 779  34.971 -13.213  -4.442
    9    HZ3  TRP 779           HZ3      TRP 779  37.916 -11.130  -6.608
   10    HH2  TRP 779           HH2      TRP 779  37.174 -12.300  -4.616

  No H/Q in entry =          10
  In of MODEL   24
    1    H    GLY 780           H        GLY 780  32.042  -8.862  -7.615
    2    HA3  GLY 780           HA2      GLY 780  29.870  -8.257  -7.079
    3    HA2  GLY 780           HA3      GLY 780  29.417  -8.596  -8.738

  No H/Q in entry =           3
  In of MODEL   24
    1    H    LYS 781           H        LYS 781  27.742  -9.372  -6.853
    2    HA   LYS 781           HA       LYS 781  27.633 -12.209  -7.167
    3    HB2  LYS 781           HB2      LYS 781  27.877 -10.935  -4.466
    4    HB3  LYS 781           HB3      LYS 781  27.085 -12.494  -4.683
    5    HG2  LYS 781           HG2      LYS 781  29.284 -13.331  -5.604
    6    HG3  LYS 781           HG3      LYS 781  29.992 -11.790  -5.140
    7    HD2  LYS 781           HD2      LYS 781  30.474 -13.411  -3.407
    8    HD3  LYS 781           HD3      LYS 781  29.299 -12.254  -2.781
    9    HE2  LYS 781           HE2      LYS 781  27.488 -13.839  -3.186
   10    HE3  LYS 781           HE3      LYS 781  28.624 -14.979  -3.904
   11    HZ3  LYS 781           HZ1      LYS 781  28.130 -15.604  -1.671
   12    HZ2  LYS 781           HZ2      LYS 781  28.530 -14.109  -1.058
   13    HZ1  LYS 781           HZ3      LYS 781  29.735 -15.098  -1.700

  No H/Q in entry =          13
  In of MODEL   24
    1    H    CYS 782           H        CYS 782  25.505 -12.825  -7.058
    2    HA   CYS 782           HA       CYS 782  23.606 -10.860  -6.022
    3    HB2  CYS 782           HB2      CYS 782  23.496 -11.061  -8.532
    4    HB3  CYS 782           HB3      CYS 782  23.220 -12.790  -8.369

  No H/Q in entry =           4
  In of MODEL   24
    1    H    ASP 783           H        ASP 783  22.578 -12.014  -4.208
    2    HA   ASP 783           HA       ASP 783  22.287 -14.869  -4.218
    3    HB2  ASP 783           HB2      ASP 783  24.686 -14.850  -3.951
    4    HB3  ASP 783           HB3      ASP 783  24.575 -13.700  -2.633

  No H/Q in entry =           4
  In of MODEL   24
    1    H    ALA 784           H        ALA 784  23.112 -12.656  -1.542
    2    HA   ALA 784           HA       ALA 784  20.824 -13.620  -0.086
    3    HB1  ALA 784           HB1      ALA 784  22.808 -11.478   0.697
    4    HB3  ALA 784           HB2      ALA 784  22.941 -13.191   1.090
    5    HB2  ALA 784           HB3      ALA 784  21.623 -12.231   1.762

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLU 785           H        GLU 785  19.187 -12.291   0.813
    2    HA   GLU 785           HA       GLU 785  18.208 -10.361  -1.140
    3    HB2  GLU 785           HB2      GLU 785  16.855 -11.685   1.199
    4    HB3  GLU 785           HB3      GLU 785  16.077 -10.602   0.065
    5    HG2  GLU 785           HG2      GLU 785  16.462 -12.180  -1.734
    6    HG3  GLU 785           HG3      GLU 785  17.297 -13.264  -0.615

  No H/Q in entry =           6
  In of MODEL   24
    1    H    SER 786           H        SER 786  19.877 -10.272   1.746
    2    HA   SER 786           HA       SER 786  18.782  -8.353   3.348
    3    HB2  SER 786           HB2      SER 786  21.705  -8.598   2.623
    4    HB3  SER 786           HB3      SER 786  21.054  -7.871   4.097
    5    HG   SER 786           HG       SER 786  19.967 -10.024   4.294

  No H/Q in entry =           5
  In of MODEL   24
    1    H    SER 787           H        SER 787  20.625  -7.825   0.413
    2    HA   SER 787           HA       SER 787  19.227  -5.501  -0.265
    3    HB2  SER 787           HB2      SER 787  22.230  -5.275   0.280
    4    HB3  SER 787           HB3      SER 787  21.251  -4.035  -0.511
    5    HG   SER 787           HG       SER 787  20.171  -4.770   1.814

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LYS 788           H        LYS 788  20.086  -4.936  -2.536
    2    HA   LYS 788           HA       LYS 788  20.401  -7.511  -3.841
    3    HB2  LYS 788           HB2      LYS 788  18.500  -6.098  -4.321
    4    HB3  LYS 788           HB3      LYS 788  19.597  -4.815  -4.803
    5    HG2  LYS 788           HG2      LYS 788  19.571  -7.447  -6.287
    6    HG3  LYS 788           HG3      LYS 788  18.370  -6.215  -6.650
    7    HD2  LYS 788           HD2      LYS 788  20.136  -4.640  -7.264
    8    HD3  LYS 788           HD3      LYS 788  21.366  -5.808  -6.795
    9    HE2  LYS 788           HE2      LYS 788  21.096  -5.771  -9.220
   10    HE3  LYS 788           HE3      LYS 788  20.605  -7.327  -8.560
   11    HZ3  LYS 788           HZ1      LYS 788  18.298  -6.622  -8.751
   12    HZ2  LYS 788           HZ2      LYS 788  19.068  -6.541 -10.244
   13    HZ1  LYS 788           HZ3      LYS 788  18.782  -5.127  -9.361

  No H/Q in entry =          13
  In of MODEL   24
    1    H    CYS 789           H        CYS 789  22.029  -8.036  -5.143
    2    HA   CYS 789           HA       CYS 789  23.860  -6.045  -6.076
    3    HB2  CYS 789           HB2      CYS 789  24.808  -7.106  -3.888
    4    HB3  CYS 789           HB3      CYS 789  24.905  -8.576  -4.830

  No H/Q in entry =           4
  In of MODEL   24
    1    H    VAL 790           H        VAL 790  25.593  -7.838  -7.370
    2    HA   VAL 790           HA       VAL 790  23.904  -9.115  -9.297
    3    HB   VAL 790           HB       VAL 790  23.486  -6.739  -9.778
    4   HG13  VAL 790          HG11      VAL 790  25.494  -5.755  -8.904
    5   HG12  VAL 790          HG12      VAL 790  25.302  -5.262 -10.596
    6   HG11  VAL 790          HG13      VAL 790  26.458  -6.523 -10.157
    7   HG21  VAL 790          HG21      VAL 790  25.191  -8.089 -11.862
    8   HG23  VAL 790          HG22      VAL 790  24.169  -6.685 -12.159
    9   HG22  VAL 790          HG23      VAL 790  23.440  -8.220 -11.673

  No H/Q in entry =           9
  In of MODEL   24
    1    H    CYS 791           H        CYS 791  25.254 -10.187 -10.873
    2    HA   CYS 791           HA       CYS 791  28.074 -10.384 -10.072
    3    HB2  CYS 791           HB2      CYS 791  26.689 -12.070 -12.181
    4    HB3  CYS 791           HB3      CYS 791  28.158 -12.421 -11.279

  No H/Q in entry =           4
  In of MODEL   24
    1    H    ARG 792           H        ARG 792  29.536  -9.382 -11.334
    2    HA   ARG 792           HA       ARG 792  28.574  -7.793 -13.545
    3    HB2  ARG 792           HB2      ARG 792  31.352  -8.000 -12.343
    4    HB3  ARG 792           HB3      ARG 792  30.794  -6.753 -13.453
    5    HG2  ARG 792           HG2      ARG 792  29.280  -5.876 -11.817
    6    HG3  ARG 792           HG3      ARG 792  29.603  -7.226 -10.735
    7    HD2  ARG 792           HD2      ARG 792  30.822  -5.389  -9.886
    8    HD3  ARG 792           HD3      ARG 792  31.996  -6.439 -10.661
    9    HE   ARG 792           HE       ARG 792  31.018  -4.325 -12.340
   10   HH11  ARG 792          HH11      ARG 792  33.560  -5.345 -10.113
   11   HH12  ARG 792          HH12      ARG 792  34.572  -4.010 -10.322
   12   HH21  ARG 792          HH21      ARG 792  32.355  -2.393 -12.654
   13   HH22  ARG 792          HH22      ARG 792  33.787  -2.184 -11.772

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLU 793           H        GLU 793  29.877  -7.796 -15.586
    2    HA   GLU 793           HA       GLU 793  30.319 -10.517 -16.418
    3    HB2  GLU 793           HB2      GLU 793  30.599  -7.936 -17.989
    4    HB3  GLU 793           HB3      GLU 793  30.717  -9.553 -18.653
    5    HG2  GLU 793           HG2      GLU 793  28.267  -8.356 -17.379
    6    HG3  GLU 793           HG3      GLU 793  28.546  -8.582 -19.107

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ALA 794           H        ALA 794  32.328 -10.995 -17.740
    2    HA   ALA 794           HA       ALA 794  34.535 -10.882 -16.001
    3    HB2  ALA 794           HB1      ALA 794  34.041 -12.694 -17.646
    4    HB3  ALA 794           HB2      ALA 794  35.698 -12.150 -17.663
    5    HB1  ALA 794           HB3      ALA 794  34.586 -11.618 -18.937

  No H/Q in entry =           5
  In of MODEL   24
    1    H    SER 795           H        SER 795  33.701  -9.055 -18.870
    2    HA   SER 795           HA       SER 795  36.214  -7.689 -18.671
    3    HB2  SER 795           HB2      SER 795  34.063  -7.351 -20.770
    4    HB3  SER 795           HB3      SER 795  35.715  -6.739 -20.858
    5    HG   SER 795           HG       SER 795  34.813  -9.409 -20.908

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLU 796           H        GLU 796  33.628  -7.345 -16.928
    2    HA   GLU 796           HA       GLU 796  32.979  -4.547 -17.452
    3    HB2  GLU 796           HB2      GLU 796  31.216  -6.277 -17.126
    4    HB3  GLU 796           HB3      GLU 796  31.755  -6.469 -15.466
    5    HG2  GLU 796           HG2      GLU 796  29.760  -5.098 -15.624
    6    HG3  GLU 796           HG3      GLU 796  31.125  -4.165 -15.011

  No H/Q in entry =           6
  In of MODEL   24
    1    H    CYS 797           H        CYS 797  34.921  -6.427 -15.360
    2    HA   CYS 797           HA       CYS 797  34.838  -4.588 -13.202
    3    HB2  CYS 797           HB2      CYS 797  36.580  -6.960 -13.722
    4    HB3  CYS 797           HB3      CYS 797  36.770  -5.922 -12.306

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLU 798           H        GLU 798  36.766  -3.657 -12.269
    2    HA   GLU 798           HA       GLU 798  38.206  -2.115 -14.355
    3    HB2  GLU 798           HB2      GLU 798  37.693  -0.120 -13.023
    4    HB3  GLU 798           HB3      GLU 798  36.234  -0.924 -13.591
    5    HG2  GLU 798           HG2      GLU 798  36.184  -2.100 -11.322
    6    HG3  GLU 798           HG3      GLU 798  37.386  -0.924 -10.815

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU 799           H        GLU 799  38.234  -3.654 -11.266
    2    HA   GLU 799           HA       GLU 799  40.476  -2.243 -10.258
    3    HB2  GLU 799           HB2      GLU 799  40.258  -3.937  -8.340
    4    HB3  GLU 799           HB3      GLU 799  38.974  -2.763  -8.564
    5    HG2  GLU 799           HG2      GLU 799  38.858  -5.517  -9.671
    6    HG3  GLU 799           HG3      GLU 799  38.363  -5.142  -8.013

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLU 800           H        GLU 800  42.321  -3.421  -9.310
    2    HA   GLU 800           HA       GLU 800  43.447  -4.883 -11.518
    3    HB2  GLU 800           HB2      GLU 800  45.654  -4.499 -10.503
    4    HB3  GLU 800           HB3      GLU 800  44.796  -3.021 -10.918
    5    HG2  GLU 800           HG2      GLU 800  44.353  -2.563  -8.613
    6    HG3  GLU 800           HG3      GLU 800  44.899  -4.171  -8.133

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLY 801           H        GLY 801  42.159  -6.574 -10.891
    2    HA3  GLY 801           HA2      GLY 801  43.023  -8.243  -8.722
    3    HA2  GLY 801           HA3      GLY 801  41.922  -8.744 -10.011

  No H/Q in entry =           3
  In of MODEL   24
    1    H    PHE 802           H        PHE 802  43.800 -10.498  -9.104
    2    HA   PHE 802           HA       PHE 802  46.202 -10.396 -10.647
    3    HB2  PHE 802           HB2      PHE 802  44.936 -12.422  -8.822
    4    HB3  PHE 802           HB3      PHE 802  46.368 -12.799  -9.759
    5    HD1  PHE 802           HD1      PHE 802  47.716 -13.258  -7.854
    6    HD2  PHE 802           HD2      PHE 802  45.817  -9.469  -8.258
    7    HE1  PHE 802           HE1      PHE 802  49.114 -12.403  -6.127
    8    HE2  PHE 802           HE2      PHE 802  47.241  -8.574  -6.492
    9    HZ   PHE 802           HZ       PHE 802  48.914 -10.029  -5.402

  No H/Q in entry =           9
  In of MODEL   24
    1    H    SER 803           H        SER 803  46.671 -12.694 -11.615
    2    HA   SER 803           HA       SER 803  44.472 -13.424 -13.379
    3    HB2  SER 803           HB2      SER 803  47.442 -13.617 -13.935
    4    HB3  SER 803           HB3      SER 803  46.110 -13.930 -15.056
    5    HG   SER 803           HG       SER 803  45.590 -11.627 -14.157

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ILE 804           H        ILE 804  43.801 -15.417 -13.091
    2    HA   ILE 804           HA       ILE 804  45.462 -17.267 -11.542
    3    HB   ILE 804           HB       ILE 804  43.568 -18.091 -10.294
    4   HG12  ILE 804          HG12      ILE 804  41.723 -17.817 -11.942
    5   HG13  ILE 804          HG13      ILE 804  41.301 -17.150 -10.374
    6   HG23  ILE 804          HG21      ILE 804  42.962 -16.140  -8.923
    7   HG22  ILE 804          HG22      ILE 804  43.647 -15.090 -10.160
    8   HG21  ILE 804          HG23      ILE 804  44.686 -16.222  -9.294
    9   HD12  ILE 804          HD11      ILE 804  42.033 -15.630 -12.856
   10   HD11  ILE 804          HD12      ILE 804  41.830 -14.896 -11.270
   11   HD13  ILE 804          HD13      ILE 804  40.470 -15.699 -12.050

  No H/Q in entry =          11
  In of MODEL   24
    1    H    CYS 805           H        CYS 805  44.809 -19.569 -11.815
    2    HA   CYS 805           HA       CYS 805  44.157 -20.022 -14.637
    3    HB2  CYS 805           HB2      CYS 805  46.330 -20.824 -13.847
    4    HB3  CYS 805           HB3      CYS 805  45.524 -21.771 -12.603

  No H/Q in entry =           4
  In of MODEL   24
    1    H    VAL 806           H        VAL 806  42.316 -20.970 -15.128
    2    HA   VAL 806           HA       VAL 806  41.122 -22.658 -13.121
    3    HB   VAL 806           HB       VAL 806  40.078 -20.474 -12.906
    4   HG12  VAL 806          HG11      VAL 806  38.755 -19.466 -14.693
    5   HG11  VAL 806          HG12      VAL 806  39.392 -20.690 -15.799
    6   HG13  VAL 806          HG13      VAL 806  40.484 -19.534 -15.041
    7   HG22  VAL 806          HG21      VAL 806  37.736 -21.060 -13.219
    8   HG21  VAL 806          HG22      VAL 806  38.653 -22.404 -12.537
    9   HG23  VAL 806          HG23      VAL 806  38.212 -22.415 -14.242

  No H/Q in entry =           9
  In of MODEL   24
    1    H    GLU 807           H        GLU 807  40.394 -24.522 -13.900
    2    HA   GLU 807           HA       GLU 807  40.838 -25.152 -16.686
    3    HB2  GLU 807           HB2      GLU 807  41.567 -26.690 -14.890
    4    HB3  GLU 807           HB3      GLU 807  39.901 -26.844 -14.364
    5    HG2  GLU 807           HG2      GLU 807  39.333 -27.828 -16.544
    6    HG3  GLU 807           HG3      GLU 807  41.033 -27.735 -17.006

  No H/Q in entry =           6
  In of MODEL   24
    1    H    VAL 808           H        VAL 808  39.334 -24.692 -18.034
    2    HA   VAL 808           HA       VAL 808  36.529 -25.108 -17.305
    3    HB   VAL 808           HB       VAL 808  37.593 -22.780 -18.859
    4   HG13  VAL 808          HG11      VAL 808  35.416 -21.805 -18.636
    5   HG12  VAL 808          HG12      VAL 808  34.851 -23.287 -17.831
    6   HG11  VAL 808          HG13      VAL 808  35.426 -23.342 -19.508
    7   HG21  VAL 808          HG21      VAL 808  36.723 -22.779 -16.002
    8   HG23  VAL 808          HG22      VAL 808  37.047 -21.333 -16.963
    9   HG22  VAL 808          HG23      VAL 808  38.347 -22.480 -16.622

  No H/Q in entry =           9
  In of MODEL   24
    1    H    ASN 809           H        ASN 809  35.463 -26.100 -18.981
    2    HA   ASN 809           HA       ASN 809  35.057 -27.104 -20.954
    3    HB2  ASN 809           HB2      ASN 809  36.988 -25.024 -21.916
    4    HB3  ASN 809           HB3      ASN 809  36.330 -26.198 -23.022
    5   HD21  ASN 809          HD21      ASN 809  35.872 -23.276 -21.352
    6   HD22  ASN 809          HD22      ASN 809  34.260 -22.939 -21.871

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLY 810           H        GLY 810  37.304 -27.761 -19.146
    2    HA3  GLY 810           HA2      GLY 810  38.667 -29.614 -19.021
    3    HA2  GLY 810           HA3      GLY 810  38.384 -29.895 -20.738

  No H/Q in entry =           3
  In of MODEL   24
    1    H    LYS 811           H        LYS 811  39.257 -26.728 -20.369
    2    HA   LYS 811           HA       LYS 811  42.101 -27.407 -20.576
    3    HB2  LYS 811           HB2      LYS 811  40.601 -25.315 -22.145
    4    HB3  LYS 811           HB3      LYS 811  42.345 -25.571 -22.186
    5    HG2  LYS 811           HG2      LYS 811  42.008 -27.820 -23.055
    6    HG3  LYS 811           HG3      LYS 811  40.264 -27.591 -22.992
    7    HD2  LYS 811           HD2      LYS 811  41.051 -27.282 -25.242
    8    HD3  LYS 811           HD3      LYS 811  40.476 -25.753 -24.580
    9    HE2  LYS 811           HE2      LYS 811  42.729 -25.018 -24.167
   10    HE3  LYS 811           HE3      LYS 811  43.370 -26.583 -24.625
   11    HZ2  LYS 811           HZ1      LYS 811  43.589 -24.972 -26.444
   12    HZ1  LYS 811           HZ2      LYS 811  41.915 -24.753 -26.483
   13    HZ3  LYS 811           HZ3      LYS 811  42.574 -26.235 -26.873

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLU 812           H        GLU 812  43.510 -26.083 -19.605
    2    HA   GLU 812           HA       GLU 812  42.394 -24.406 -17.510
    3    HB2  GLU 812           HB2      GLU 812  45.328 -24.594 -18.060
    4    HB3  GLU 812           HB3      GLU 812  44.498 -24.406 -16.526
    5    HG2  GLU 812           HG2      GLU 812  45.192 -26.537 -16.297
    6    HG3  GLU 812           HG3      GLU 812  43.666 -26.850 -17.122

  No H/Q in entry =           6
  In of MODEL   24
    1    H    GLN 813           H        GLN 813  41.863 -22.427 -17.921
    2    HA   GLN 813           HA       GLN 813  43.617 -20.924 -19.712
    3    HB2  GLN 813           HB2      GLN 813  41.441 -21.144 -20.722
    4    HB3  GLN 813           HB3      GLN 813  40.641 -20.639 -19.235
    5    HG2  GLN 813           HG2      GLN 813  41.560 -18.428 -19.474
    6    HG3  GLN 813           HG3      GLN 813  42.459 -18.916 -20.905
    7   HE21  GLN 813          HE21      GLN 813  39.202 -20.006 -20.319
    8   HE22  GLN 813          HE22      GLN 813  38.449 -19.084 -21.557

  No H/Q in entry =           8
  In of MODEL   24
    1    H    THR 814           H        THR 814  44.329 -18.964 -19.008
    2    HA   THR 814           HA       THR 814  44.047 -18.454 -16.157
    3    HB   THR 814           HB       THR 814  45.704 -17.054 -18.243
    4    HG1  THR 814           HG1      THR 814  47.019 -18.563 -18.127
    5   HG23  THR 814          HG21      THR 814  45.392 -15.751 -16.205
    6   HG22  THR 814          HG22      THR 814  47.064 -16.303 -16.321
    7   HG21  THR 814          HG23      THR 814  45.941 -17.113 -15.228

  No H/Q in entry =           7
  In of MODEL   24
    1    H    MET 815           H        MET 815  42.697 -16.904 -15.485
    2    HA   MET 815           HA       MET 815  41.788 -14.922 -17.480
    3    HB2  MET 815           HB2      MET 815  40.057 -15.901 -15.214
    4    HB3  MET 815           HB3      MET 815  39.575 -14.918 -16.580
    5    HG2  MET 815           HG2      MET 815  40.178 -16.938 -18.034
    6    HG3  MET 815           HG3      MET 815  40.329 -17.798 -16.522
    7    HE3  MET 815           HE1      MET 815  38.410 -18.715 -18.877
    8    HE2  MET 815           HE2      MET 815  37.106 -19.347 -17.854
    9    HE1  MET 815           HE3      MET 815  38.802 -19.541 -17.381

  No H/Q in entry =           9
  In of MODEL   24
    1    H    SER 816           H        SER 816  40.757 -13.075 -16.265
    2    HA   SER 816           HA       SER 816  42.599 -12.185 -14.273
    3    HB2  SER 816           HB2      SER 816  40.176 -11.096 -15.585
    4    HB3  SER 816           HB3      SER 816  41.138 -10.136 -14.426
    5    HG   SER 816           HG       SER 816  42.334 -11.366 -16.685

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLU 817           H        GLU 817  41.919 -11.511 -12.239
    2    HA   GLU 817           HA       GLU 817  40.776 -13.176 -10.480
    3    HB2  GLU 817           HB2      GLU 817  41.997 -10.954 -10.240
    4    HB3  GLU 817           HB3      GLU 817  40.387 -10.244 -10.257
    5    HG2  GLU 817           HG2      GLU 817  40.643 -10.500  -8.028
    6    HG3  GLU 817           HG3      GLU 817  39.991 -12.091  -8.457

  No H/Q in entry =           6
  In of MODEL   24
    1    H    CYS 818           H        CYS 818  39.048 -10.632 -12.281
    2    HA   CYS 818           HA       CYS 818  36.651 -10.896 -10.716
    3    HB2  CYS 818           HB2      CYS 818  37.055  -8.702 -11.507
    4    HB3  CYS 818           HB3      CYS 818  37.413  -9.271 -13.133

  No H/Q in entry =           4
  In of MODEL   24
    1    H    GLU 819           H        GLU 819  37.892 -11.659 -13.791
    2    HA   GLU 819           HA       GLU 819  35.646 -12.430 -15.163
    3    HB2  GLU 819           HB2      GLU 819  38.490 -13.206 -15.274
    4    HB3  GLU 819           HB3      GLU 819  37.446 -13.614 -16.567
    5    HG2  GLU 819           HG2      GLU 819  36.937 -11.153 -16.655
    6    HG3  GLU 819           HG3      GLU 819  38.334 -11.004 -15.588

  No H/Q in entry =           6
  In of MODEL   24
    1    H    ALA 820           H        ALA 820  38.056 -14.509 -13.611
    2    HA   ALA 820           HA       ALA 820  36.701 -16.892 -13.976
    3    HB2  ALA 820           HB1      ALA 820  38.094 -17.823 -12.189
    4    HB3  ALA 820           HB2      ALA 820  38.521 -16.186 -11.688
    5    HB1  ALA 820           HB3      ALA 820  39.030 -16.785 -13.270

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLY 821           H        GLY 821  36.507 -14.534 -11.368
    2    HA3  GLY 821           HA2      GLY 821  34.844 -16.048  -9.627
    3    HA2  GLY 821           HA3      GLY 821  35.135 -14.317  -9.537

  No H/Q in entry =           3
  In of MODEL   24
    1    H    ALA 822           H        ALA 822  34.212 -13.633 -12.079
    2    HA   ALA 822           HA       ALA 822  31.474 -13.232 -11.613
    3    HB1  ALA 822           HB1      ALA 822  32.878 -11.697 -12.904
    4    HB3  ALA 822           HB2      ALA 822  31.468 -12.211 -13.830
    5    HB2  ALA 822           HB3      ALA 822  33.050 -12.918 -14.164

  No H/Q in entry =           5
  In of MODEL   24
    1    H    LEU 823           H        LEU 823  33.220 -15.373 -13.877
    2    HA   LEU 823           HA       LEU 823  30.922 -16.414 -14.955
    3    HB2  LEU 823           HB2      LEU 823  33.728 -17.358 -14.902
    4    HB3  LEU 823           HB3      LEU 823  32.496 -18.431 -15.506
    5    HG   LEU 823           HG       LEU 823  31.772 -16.598 -17.082
    6   HD13  LEU 823          HD11      LEU 823  32.747 -14.678 -16.122
    7   HD12  LEU 823          HD12      LEU 823  33.383 -14.909 -17.750
    8   HD11  LEU 823          HD13      LEU 823  34.375 -15.309 -16.347
    9   HD23  LEU 823          HD21      LEU 823  33.690 -17.013 -18.651
   10   HD22  LEU 823          HD22      LEU 823  32.773 -18.358 -18.004
   11   HD21  LEU 823          HD23      LEU 823  34.383 -17.988 -17.325

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ARG 824           H        ARG 824  32.461 -17.178 -11.981
    2    HA   ARG 824           HA       ARG 824  31.124 -19.650 -11.463
    3    HB2  ARG 824           HB2      ARG 824  31.951 -17.565  -9.452
    4    HB3  ARG 824           HB3      ARG 824  31.609 -19.253  -9.112
    5    HG2  ARG 824           HG2      ARG 824  33.635 -19.855 -10.421
    6    HG3  ARG 824           HG3      ARG 824  33.943 -18.128 -10.652
    7    HD2  ARG 824           HD2      ARG 824  33.803 -19.640  -8.071
    8    HD3  ARG 824           HD3      ARG 824  35.260 -19.006  -8.836
    9    HE   ARG 824           HE       ARG 824  33.673 -16.841  -8.507
   10   HH11  ARG 824          HH11      ARG 824  34.739 -19.385  -6.309
   11   HH12  ARG 824          HH12      ARG 824  34.923 -18.401  -4.947
   12   HH21  ARG 824          HH21      ARG 824  33.859 -15.399  -6.598
   13   HH22  ARG 824          HH22      ARG 824  34.329 -16.055  -5.108

  No H/Q in entry =          13
  In of MODEL   24
    1    H    CYS 825           H        CYS 825  30.423 -16.286 -10.791
    2    HA   CYS 825           HA       CYS 825  28.128 -16.648  -9.181
    3    HB2  CYS 825           HB2      CYS 825  29.711 -14.618  -9.422
    4    HB3  CYS 825           HB3      CYS 825  28.749 -14.201 -10.825

  No H/Q in entry =           4
  In of MODEL   24
    1    H    ARG 826           H        ARG 826  28.607 -16.275 -12.644
    2    HA   ARG 826           HA       ARG 826  25.821 -15.839 -13.169
    3    HB2  ARG 826           HB2      ARG 826  26.396 -16.037 -15.531
    4    HB3  ARG 826           HB3      ARG 826  27.406 -14.845 -14.691
    5    HG2  ARG 826           HG2      ARG 826  29.128 -16.595 -14.594
    6    HG3  ARG 826           HG3      ARG 826  28.095 -17.624 -15.576
    7    HD2  ARG 826           HD2      ARG 826  29.182 -14.928 -16.375
    8    HD3  ARG 826           HD3      ARG 826  29.696 -16.495 -16.995
    9    HE   ARG 826           HE       ARG 826  27.381 -16.756 -17.800
   10   HH11  ARG 826          HH11      ARG 826  28.720 -13.545 -17.311
   11   HH12  ARG 826          HH12      ARG 826  27.862 -12.758 -18.522
   12   HH21  ARG 826          HH21      ARG 826  26.064 -15.706 -19.507
   13   HH22  ARG 826          HH22      ARG 826  26.305 -14.040 -19.832

  No H/Q in entry =          13
  In of MODEL   24
    1    H    GLY 827           H        GLY 827  27.902 -18.690 -13.228
    2    HA3  GLY 827           HA2      GLY 827  26.498 -20.742 -12.863
    3    HA2  GLY 827           HA3      GLY 827  25.552 -20.144 -14.223

  No H/Q in entry =           3
  In of MODEL   24
    1    H    GLN 828           H        GLN 828  28.684 -19.435 -14.878
    2    HA   GLN 828           HA       GLN 828  29.007 -21.476 -16.841
    3    HB2  GLN 828           HB2      GLN 828  30.130 -19.290 -16.995
    4    HB3  GLN 828           HB3      GLN 828  31.068 -19.714 -15.568
    5    HG2  GLN 828           HG2      GLN 828  32.478 -20.071 -17.484
    6    HG3  GLN 828           HG3      GLN 828  32.037 -21.603 -16.787
    7   HE21  GLN 828          HE21      GLN 828  29.783 -19.835 -18.780
    8   HE22  GLN 828          HE22      GLN 828  29.810 -20.943 -20.090

  No H/Q in entry =           8
  In of MODEL   24
    1    H    SER 829           H        SER 829  30.322 -23.337 -16.769
    2    HA   SER 829           HA       SER 829  30.962 -24.300 -14.101
    3    HB2  SER 829           HB2      SER 829  31.054 -25.765 -16.742
    4    HB3  SER 829           HB3      SER 829  31.129 -26.478 -15.131
    5    HG   SER 829           HG       SER 829  28.948 -24.986 -16.157

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ILE 830           H        ILE 830  32.885 -23.801 -13.428
    2    HA   ILE 830           HA       ILE 830  35.293 -23.934 -15.137
    3    HB   ILE 830           HB       ILE 830  36.157 -21.848 -14.206
    4   HG12  ILE 830          HG12      ILE 830  34.897 -21.907 -11.995
    5   HG13  ILE 830          HG13      ILE 830  35.021 -20.329 -12.746
    6   HG23  ILE 830          HG21      ILE 830  34.769 -20.155 -15.255
    7   HG22  ILE 830          HG22      ILE 830  33.437 -21.302 -15.325
    8   HG21  ILE 830          HG23      ILE 830  34.901 -21.602 -16.262
    9   HD11  ILE 830          HD11      ILE 830  32.608 -22.114 -12.885
   10   HD13  ILE 830          HD12      ILE 830  32.729 -20.469 -13.497
   11   HD12  ILE 830          HD13      ILE 830  32.797 -20.779 -11.767

  No H/Q in entry =          11
  In of MODEL   24
    1    H    SER 831           H        SER 831  36.990 -24.785 -14.008
    2    HA   SER 831           HA       SER 831  36.516 -25.344 -11.186
    3    HB2  SER 831           HB2      SER 831  37.854 -26.939 -13.331
    4    HB3  SER 831           HB3      SER 831  38.089 -27.257 -11.615
    5    HG   SER 831           HG       SER 831  35.618 -27.203 -13.009

  No H/Q in entry =           5
  In of MODEL   24
    1    H    VAL 832           H        VAL 832  37.790 -24.063  -9.975
    2    HA   VAL 832           HA       VAL 832  40.156 -22.905 -11.073
    3    HB   VAL 832           HB       VAL 832  38.846 -21.581  -9.498
    4   HG13  VAL 832          HG11      VAL 832  37.930 -23.281  -8.070
    5   HG12  VAL 832          HG12      VAL 832  38.765 -22.075  -7.091
    6   HG11  VAL 832          HG13      VAL 832  39.527 -23.633  -7.413
    7   HG22  VAL 832          HG21      VAL 832  41.208 -21.054  -9.631
    8   HG21  VAL 832          HG22      VAL 832  41.570 -22.247  -8.386
    9   HG23  VAL 832          HG23      VAL 832  40.637 -20.806  -7.979

  No H/Q in entry =           9
  In of MODEL   24
    1    H    THR 833           H        THR 833  42.047 -23.776 -11.251
    2    HA   THR 833           HA       THR 833  42.606 -26.256  -9.926
    3    HB   THR 833           HB       THR 833  44.689 -26.035 -11.428
    4    HG1  THR 833           HG1      THR 833  44.374 -24.497 -13.126
    5   HG23  THR 833          HG21      THR 833  42.769 -27.485 -11.956
    6   HG22  THR 833          HG22      THR 833  43.394 -26.715 -13.415
    7   HG21  THR 833          HG23      THR 833  41.922 -26.105 -12.654

  No H/Q in entry =           7
  In of MODEL   24
    1    H    SER 834           H        SER 834  43.751 -22.933  -9.988
    2    HA   SER 834           HA       SER 834  44.750 -23.001  -7.378
    3    HB2  SER 834           HB2      SER 834  46.609 -24.243  -8.497
    4    HB3  SER 834           HB3      SER 834  46.820 -22.880  -9.594
    5    HG   SER 834           HG       SER 834  47.738 -23.227  -7.091

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ILE 835           H        ILE 835  45.784 -20.842  -6.955
    2    HA   ILE 835           HA       ILE 835  44.335 -18.906  -8.533
    3    HB   ILE 835           HB       ILE 835  44.616 -17.307  -6.903
    4   HG12  ILE 835          HG12      ILE 835  47.023 -17.444  -6.428
    5   HG13  ILE 835          HG13      ILE 835  46.113 -17.409  -4.933
    6   HG23  ILE 835          HG21      ILE 835  43.037 -18.934  -6.256
    7   HG22  ILE 835          HG22      ILE 835  43.872 -18.366  -4.807
    8   HG21  ILE 835          HG23      ILE 835  44.283 -19.930  -5.509
    9   HD11  ILE 835          HD11      ILE 835  47.342 -19.802  -6.215
   10   HD13  ILE 835          HD12      ILE 835  46.443 -19.732  -4.675
   11   HD12  ILE 835          HD13      ILE 835  47.973 -18.847  -4.857

  No H/Q in entry =          11
  In of MODEL   24
    1    H    ARG 836           H        ARG 836  47.147 -20.338  -8.887
    2    HA   ARG 836           HA       ARG 836  48.632 -17.975  -9.673
    3    HB2  ARG 836           HB2      ARG 836  50.532 -19.490 -10.068
    4    HB3  ARG 836           HB3      ARG 836  49.946 -19.487  -8.420
    5    HG2  ARG 836           HG2      ARG 836  48.811 -21.603  -8.841
    6    HG3  ARG 836           HG3      ARG 836  49.498 -21.617 -10.475
    7    HD2  ARG 836           HD2      ARG 836  51.679 -21.453  -9.605
    8    HD3  ARG 836           HD3      ARG 836  51.074 -21.342  -7.963
    9    HE   ARG 836           HE       ARG 836  50.091 -23.708  -9.029
   10   HH11  ARG 836          HH11      ARG 836  53.293 -22.402  -8.292
   11   HH12  ARG 836          HH12      ARG 836  53.937 -23.874  -7.750
   12   HH21  ARG 836          HH21      ARG 836  50.980 -25.743  -8.332
   13   HH22  ARG 836          HH22      ARG 836  52.588 -25.841  -7.786

  No H/Q in entry =          13
  In of MODEL   24
    1    HA   PRO 837           HA       PRO 837  47.304 -18.229 -13.801
    2    HB2  PRO 837           HB2      PRO 837  49.457 -17.115 -15.071
    3    HB3  PRO 837           HB3      PRO 837  48.248 -16.177 -14.192
    4    HG2  PRO 837           HG2      PRO 837  50.951 -17.099 -13.291
    5    HG3  PRO 837           HG3      PRO 837  50.172 -15.525 -13.052
    6    HD2  PRO 837           HD2      PRO 837  50.256 -17.362 -11.105
    7    HD3  PRO 837           HD3      PRO 837  48.849 -16.300 -11.327

  No H/Q in entry =           7
  In of MODEL   24
    1    H    CYS 838           H        CYS 838  47.480 -19.529 -15.608
    2    HA   CYS 838           HA       CYS 838  49.485 -21.576 -15.393
    3    HB2  CYS 838           HB2      CYS 838  46.815 -21.465 -16.714
    4    HB3  CYS 838           HB3      CYS 838  48.006 -22.599 -17.338

  No H/Q in entry =           4
  In of MODEL   24
    1    H    ALA 839           H        ALA 839  49.948 -22.487 -17.851
    2    HA   ALA 839           HA       ALA 839  51.401 -20.399 -19.190
    3    HB2  ALA 839           HB1      ALA 839  51.024 -23.315 -19.880
    4    HB1  ALA 839           HB2      ALA 839  52.337 -22.647 -18.908
    5    HB3  ALA 839           HB3      ALA 839  52.200 -22.224 -20.613

  No H/Q in entry =           5
  In of MODEL   24
    1    H    ALA 840           H        ALA 840  48.502 -20.352 -19.136
    2    HA   ALA 840           HA       ALA 840  47.823 -20.401 -21.977
    3    HB1  ALA 840           HB1      ALA 840  46.073 -20.355 -19.511
    4    HB2  ALA 840           HB2      ALA 840  46.305 -21.730 -20.591
    5    HB3  ALA 840           HB3      ALA 840  45.483 -20.282 -21.170

  No H/Q in entry =           5
  In of MODEL   24
    1    H    GLU 841           H        GLU 841  48.498 -18.469 -22.605
    2    HA   GLU 841           HA       GLU 841  47.860 -16.183 -20.895
    3    HB2  GLU 841           HB2      GLU 841  50.129 -16.513 -22.851
    4    HB3  GLU 841           HB3      GLU 841  49.754 -15.019 -22.000
    5    HG2  GLU 841           HG2      GLU 841  50.120 -16.175 -19.859
    6    HG3  GLU 841           HG3      GLU 841  50.557 -17.635 -20.742

  No H/Q in entry =           6
  In of MODEL   24
    1    H    THR 842           H        THR 842  46.007 -17.289 -22.713
    2    HA   THR 842           HA       THR 842  45.834 -15.370 -24.866
    3    HB   THR 842           HB       THR 842  43.716 -17.194 -23.772
    4    HG1  THR 842           HG1      THR 842  45.860 -17.615 -25.551
    5   HG21  THR 842          HG21      THR 842  42.878 -15.440 -25.266
    6   HG23  THR 842          HG22      THR 842  42.715 -17.019 -26.030
    7   HG22  THR 842          HG23      THR 842  44.020 -15.939 -26.517

  No H/Q in entry =           7
  In of MODEL   24
    1    H    GLN 843           H        GLN 843  45.872 -13.496 -23.792
    2    HA   GLN 843           HA       GLN 843  43.507 -12.695 -22.305
    3    HB2  GLN 843           HB2      GLN 843  45.283 -13.612 -20.683
    4    HB3  GLN 843           HB3      GLN 843  46.264 -12.233 -21.148
    5    HG2  GLN 843           HG2      GLN 843  45.254 -11.531 -19.184
    6    HG3  GLN 843           HG3      GLN 843  44.243 -10.817 -20.433
    7   HE21  GLN 843          HE21      GLN 843  43.013 -13.563 -20.959
    8   HE22  GLN 843          HE22      GLN 843  41.900 -13.755 -19.669

  No H/Q in entry =           8
  In of MODEL   25
    1    H1   GLY 689           H2       GLY 689  47.933  14.330 -28.161
    2    H2   GLY 689           H1       GLY 689  47.838  15.125 -29.637
    3    H3   GLY 689           H3       GLY 689  47.590  13.459 -29.567
    4    HA2  GLY 689           HA2      GLY 689  50.106  14.876 -28.988
    5    HA3  GLY 689           HA3      GLY 689  49.737  13.924 -30.430

  No H/Q in entry =           5
  In of MODEL   25
    1    H    SER 690           H        SER 690  49.617  11.660 -30.261
    2    HA   SER 690           HA       SER 690  49.901  10.415 -27.706
    3    HB2  SER 690           HB2      SER 690  48.503   9.440 -29.561
    4    HB3  SER 690           HB3      SER 690  49.993   9.126 -30.438
    5    HG   SER 690           HG       SER 690  50.642   7.875 -28.573

  No H/Q in entry =           5
  In of MODEL   25
    1    H    HIS 691           H        HIS 691  52.001  11.809 -29.643
    2    HA   HIS 691           HA       HIS 691  54.262  10.035 -29.147
    3    HB2  HIS 691           HB2      HIS 691  54.084  11.299 -31.288
    4    HB3  HIS 691           HB3      HIS 691  54.181  12.798 -30.382
    5    HD1  HIS 691           HD1      HIS 691  56.436  13.810 -30.645
    6    HD2  HIS 691           HD2      HIS 691  56.574   9.666 -30.641
    7    HE1  HIS 691           HE1      HIS 691  58.849  13.217 -30.936
    8    HE2  HIS 691           HE2      HIS 691  58.927  10.719 -30.671

  No H/Q in entry =           8
  In of MODEL   25
    1    H    MET 692           H        MET 692  52.579  12.386 -27.500
    2    HA   MET 692           HA       MET 692  54.858  13.340 -25.947
    3    HB2  MET 692           HB2      MET 692  51.917  14.005 -25.798
    4    HB3  MET 692           HB3      MET 692  53.145  14.705 -24.757
    5    HG2  MET 692           HG2      MET 692  52.976  15.000 -27.749
    6    HG3  MET 692           HG3      MET 692  52.517  16.218 -26.562
    7    HE1  MET 692           HE1      MET 692  54.034  18.033 -27.681
    8    HE3  MET 692           HE2      MET 692  54.483  16.880 -28.936
    9    HE2  MET 692           HE3      MET 692  55.731  17.790 -28.084

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ASN 693           H        ASN 693  52.089  11.260 -25.720
    2    HA   ASN 693           HA       ASN 693  52.239  10.888 -22.883
    3    HB2  ASN 693           HB2      ASN 693  50.083  10.756 -24.038
    4    HB3  ASN 693           HB3      ASN 693  50.662   9.417 -25.018
    5   HD21  ASN 693          HD21      ASN 693  49.616  10.404 -21.861
    6   HD22  ASN 693          HD22      ASN 693  49.340   8.812 -21.239

  No H/Q in entry =           6
  In of MODEL   25
    1    HA   PRO 694           HA       PRO 694  55.186   7.555 -23.130
    2    HB2  PRO 694           HB2      PRO 694  55.022   6.710 -20.555
    3    HB3  PRO 694           HB3      PRO 694  55.889   8.177 -21.019
    4    HG2  PRO 694           HG2      PRO 694  53.191   7.865 -19.796
    5    HG3  PRO 694           HG3      PRO 694  54.413   9.114 -19.511
    6    HD2  PRO 694           HD2      PRO 694  52.192   9.443 -21.099
    7    HD3  PRO 694           HD3      PRO 694  53.686  10.384 -21.253

  No H/Q in entry =           7
  In of MODEL   25
    1    H    LEU 695           H        LEU 695  54.106   6.109 -24.481
    2    HA   LEU 695           HA       LEU 695  51.981   4.477 -23.429
    3    HB2  LEU 695           HB2      LEU 695  53.383   4.483 -26.096
    4    HB3  LEU 695           HB3      LEU 695  52.310   3.187 -25.639
    5    HG   LEU 695           HG       LEU 695  51.126   4.658 -27.071
    6   HD11  LEU 695          HD11      LEU 695  49.817   3.740 -25.285
    7   HD13  LEU 695          HD12      LEU 695  49.234   5.338 -25.741
    8   HD12  LEU 695          HD13      LEU 695  50.182   5.139 -24.271
    9   HD21  LEU 695          HD21      LEU 695  51.868   6.905 -25.210
   10   HD23  LEU 695          HD22      LEU 695  50.748   7.027 -26.567
   11   HD22  LEU 695          HD23      LEU 695  52.449   6.671 -26.858

  No H/Q in entry =          11
  In of MODEL   25
    1    H    THR 696           H        THR 696  52.169   2.713 -22.404
    2    HA   THR 696           HA       THR 696  52.950   0.963 -21.340
    3    HB   THR 696           HB       THR 696  54.312  -0.739 -22.673
    4    HG1  THR 696           HG1      THR 696  54.672   1.390 -24.187
    5   HG23  THR 696          HG21      THR 696  52.422  -1.277 -24.154
    6   HG22  THR 696          HG22      THR 696  51.767   0.339 -23.892
    7   HG21  THR 696          HG23      THR 696  51.872  -0.798 -22.547

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLN 697           H        GLN 697  54.084   2.812 -20.228
    2    HA   GLN 697           HA       GLN 697  56.903   2.067 -19.998
    3    HB2  GLN 697           HB2      GLN 697  55.494   4.562 -19.032
    4    HB3  GLN 697           HB3      GLN 697  57.186   4.191 -18.736
    5    HG2  GLN 697           HG2      GLN 697  55.913   4.647 -21.432
    6    HG3  GLN 697           HG3      GLN 697  56.944   5.776 -20.558
    7   HE21  GLN 697          HE21      GLN 697  57.302   4.631 -23.201
    8   HE22  GLN 697          HE22      GLN 697  58.813   3.808 -23.157

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ALA 698           H        ALA 698  53.876   2.040 -18.488
    2    HA   ALA 698           HA       ALA 698  54.995   1.296 -15.916
    3    HB1  ALA 698           HB1      ALA 698  53.095   2.853 -15.942
    4    HB3  ALA 698           HB2      ALA 698  52.707   1.352 -15.103
    5    HB2  ALA 698           HB3      ALA 698  52.110   1.625 -16.738

  No H/Q in entry =           5
  In of MODEL   25
    1    H    VAL 699           H        VAL 699  55.932  -0.621 -16.664
    2    HA   VAL 699           HA       VAL 699  54.012  -2.776 -16.744
    3    HB   VAL 699           HB       VAL 699  54.610  -2.472 -19.078
    4   HG11  VAL 699          HG11      VAL 699  57.493  -2.741 -18.273
    5   HG13  VAL 699          HG12      VAL 699  56.698  -1.293 -18.891
    6   HG12  VAL 699          HG13      VAL 699  56.893  -2.705 -19.932
    7   HG23  VAL 699          HG21      VAL 699  56.002  -4.891 -17.932
    8   HG22  VAL 699          HG22      VAL 699  55.523  -4.694 -19.618
    9   HG21  VAL 699          HG23      VAL 699  54.295  -4.766 -18.351

  No H/Q in entry =           9
  In of MODEL   25
    1    HA   PRO 700           HA       PRO 700  56.968  -3.876 -13.552
    2    HB2  PRO 700           HB2      PRO 700  54.962  -5.800 -12.697
    3    HB3  PRO 700           HB3      PRO 700  55.561  -4.379 -11.841
    4    HG2  PRO 700           HG2      PRO 700  53.033  -4.559 -12.843
    5    HG3  PRO 700           HG3      PRO 700  53.909  -3.030 -12.662
    6    HD2  PRO 700           HD2      PRO 700  53.473  -4.675 -15.128
    7    HD3  PRO 700           HD3      PRO 700  53.451  -2.911 -14.900

  No H/Q in entry =           7
  In of MODEL   25
    1    H    LYS 701           H        LYS 701  58.461  -5.369 -13.686
    2    HA   LYS 701           HA       LYS 701  58.097  -7.790 -15.326
    3    HB2  LYS 701           HB2      LYS 701  60.544  -6.537 -14.086
    4    HB3  LYS 701           HB3      LYS 701  60.540  -7.899 -15.201
    5    HG2  LYS 701           HG2      LYS 701  59.685  -6.553 -16.948
    6    HG3  LYS 701           HG3      LYS 701  59.475  -5.177 -15.864
    7    HD2  LYS 701           HD2      LYS 701  61.847  -5.170 -15.463
    8    HD3  LYS 701           HD3      LYS 701  62.047  -6.499 -16.616
    9    HE2  LYS 701           HE2      LYS 701  60.935  -3.751 -17.240
   10    HE3  LYS 701           HE3      LYS 701  62.528  -4.353 -17.693
   11    HZ3  LYS 701           HZ1      LYS 701  61.518  -5.986 -19.090
   12    HZ2  LYS 701           HZ2      LYS 701  60.891  -4.491 -19.519
   13    HZ1  LYS 701           HZ3      LYS 701  59.973  -5.561 -18.592

  No H/Q in entry =          13
  In of MODEL   25
    1    H    CYS 702           H        CYS 702  57.015  -7.286 -12.821
    2    HA   CYS 702           HA       CYS 702  58.427  -9.014 -10.932
    3    HB2  CYS 702           HB2      CYS 702  56.049  -7.252 -10.368
    4    HB3  CYS 702           HB3      CYS 702  57.268  -7.844  -9.245

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLN 703           H        GLN 703  57.186 -10.646  -9.840
    2    HA   GLN 703           HA       GLN 703  55.142 -11.866 -11.399
    3    HB2  GLN 703           HB2      GLN 703  56.233 -12.382  -8.646
    4    HB3  GLN 703           HB3      GLN 703  54.927 -13.329  -9.333
    5    HG2  GLN 703           HG2      GLN 703  57.656 -13.023 -10.533
    6    HG3  GLN 703           HG3      GLN 703  57.136 -14.400  -9.555
    7   HE21  GLN 703          HE21      GLN 703  56.914 -12.841 -12.632
    8   HE22  GLN 703          HE22      GLN 703  56.064 -14.100 -13.452

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ARG 704           H        ARG 704  53.073 -12.515 -10.083
    2    HA   ARG 704           HA       ARG 704  51.626 -10.108  -9.932
    3    HB2  ARG 704           HB2      ARG 704  50.862 -12.908  -9.193
    4    HB3  ARG 704           HB3      ARG 704  49.746 -11.560  -9.062
    5    HG2  ARG 704           HG2      ARG 704  51.091 -12.493 -11.586
    6    HG3  ARG 704           HG3      ARG 704  49.427 -12.833 -11.113
    7    HD2  ARG 704           HD2      ARG 704  48.993 -10.379 -11.082
    8    HD3  ARG 704           HD3      ARG 704  50.615 -10.120 -11.709
    9    HE   ARG 704           HE       ARG 704  49.133 -11.933 -13.332
   10   HH11  ARG 704          HH11      ARG 704  49.585  -8.438 -12.690
   11   HH12  ARG 704          HH12      ARG 704  49.107  -7.960 -14.233
   12   HH21  ARG 704          HH21      ARG 704  48.399 -11.213 -15.466
   13   HH22  ARG 704          HH22      ARG 704  48.406  -9.558 -15.831

  No H/Q in entry =          13
  In of MODEL   25
    1    H    TRP 705           H        TRP 705  53.195 -11.907  -7.451
    2    HA   TRP 705           HA       TRP 705  51.750 -10.496  -5.334
    3    HB2  TRP 705           HB2      TRP 705  53.093 -11.998  -3.820
    4    HB3  TRP 705           HB3      TRP 705  52.007 -12.819  -4.940
    5    HD1  TRP 705           HD1      TRP 705  55.710 -12.330  -4.173
    6    HE1  TRP 705           HE1      TRP 705  57.076 -14.026  -5.531
    7    HE3  TRP 705           HE3      TRP 705  51.988 -14.214  -7.113
    8    HZ2  TRP 705           HZ2      TRP 705  56.636 -15.923  -7.557
    9    HZ3  TRP 705           HZ3      TRP 705  52.552 -15.969  -8.738
   10    HH2  TRP 705           HH2      TRP 705  54.828 -16.808  -8.947

  No H/Q in entry =          10
  In of MODEL   25
    1    H    GLU 706           H        GLU 706  54.150  -9.813  -7.269
    2    HA   GLU 706           HA       GLU 706  55.780  -8.444  -5.286
    3    HB2  GLU 706           HB2      GLU 706  56.411  -9.179  -8.112
    4    HB3  GLU 706           HB3      GLU 706  57.511  -8.354  -7.012
    5    HG2  GLU 706           HG2      GLU 706  57.485 -10.406  -5.613
    6    HG3  GLU 706           HG3      GLU 706  56.513 -11.184  -6.861

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LYS 707           H        LYS 707  55.748  -6.366  -5.403
    2    HA   LYS 707           HA       LYS 707  54.273  -5.193  -7.655
    3    HB2  LYS 707           HB2      LYS 707  54.391  -3.980  -4.888
    4    HB3  LYS 707           HB3      LYS 707  53.369  -3.481  -6.225
    5    HG2  LYS 707           HG2      LYS 707  53.133  -5.971  -4.543
    6    HG3  LYS 707           HG3      LYS 707  52.006  -4.638  -4.617
    7    HD2  LYS 707           HD2      LYS 707  52.590  -6.553  -6.907
    8    HD3  LYS 707           HD3      LYS 707  51.199  -6.654  -5.848
    9    HE2  LYS 707           HE2      LYS 707  51.789  -4.295  -7.648
   10    HE3  LYS 707           HE3      LYS 707  50.756  -5.646  -8.099
   11    HZ3  LYS 707           HZ1      LYS 707  49.310  -4.013  -7.343
   12    HZ2  LYS 707           HZ2      LYS 707  50.257  -3.561  -6.052
   13    HZ1  LYS 707           HZ3      LYS 707  49.431  -5.024  -6.009

  No H/Q in entry =          13
  In of MODEL   25
    1    H    LEU 708           H        LEU 708  55.002  -3.189  -8.406
    2    HA   LEU 708           HA       LEU 708  57.872  -3.050  -8.250
    3    HB2  LEU 708           HB2      LEU 708  56.733  -3.031 -10.428
    4    HB3  LEU 708           HB3      LEU 708  55.882  -1.572  -9.981
    5    HG   LEU 708           HG       LEU 708  58.029  -0.345  -9.959
    6   HD13  LEU 708          HD11      LEU 708  59.530  -2.165  -9.396
    7   HD12  LEU 708          HD12      LEU 708  60.026  -1.401 -10.906
    8   HD11  LEU 708          HD13      LEU 708  59.180  -2.949 -10.935
    9   HD21  LEU 708          HD21      LEU 708  56.659  -0.411 -11.996
   10   HD23  LEU 708          HD22      LEU 708  57.511  -1.863 -12.513
   11   HD22  LEU 708          HD23      LEU 708  58.380  -0.335 -12.371

  No H/Q in entry =          11
  In of MODEL   25
    1    H    GLN 709           H        GLN 709  58.669  -1.943  -6.621
    2    HA   GLN 709           HA       GLN 709  57.889   0.813  -6.320
    3    HB2  GLN 709           HB2      GLN 709  57.432   0.751  -3.990
    4    HB3  GLN 709           HB3      GLN 709  56.544  -0.610  -4.649
    5    HG2  GLN 709           HG2      GLN 709  58.268  -2.111  -3.939
    6    HG3  GLN 709           HG3      GLN 709  59.194  -0.805  -3.212
    7   HE21  GLN 709          HE21      GLN 709  58.945  -1.384  -1.047
    8   HE22  GLN 709          HE22      GLN 709  57.419  -1.520  -0.250

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ASN 710           H        ASN 710  59.584   2.040  -5.493
    2    HA   ASN 710           HA       ASN 710  61.813   2.630  -5.163
    3    HB2  ASN 710           HB2      ASN 710  61.317   0.895  -3.211
    4    HB3  ASN 710           HB3      ASN 710  62.335  -0.175  -4.157
    5   HD21  ASN 710          HD21      ASN 710  62.182   2.524  -2.110
    6   HD22  ASN 710          HD22      ASN 710  63.880   2.769  -1.879

  No H/Q in entry =           6
  In of MODEL   25
    1    H    SER 711           H        SER 711  60.833   1.462  -7.503
    2    HA   SER 711           HA       SER 711  61.308   0.767  -9.526
    3    HB2  SER 711           HB2      SER 711  63.535   1.292 -10.486
    4    HB3  SER 711           HB3      SER 711  62.899   2.577  -9.455
    5    HG   SER 711           HG       SER 711  64.291   1.218  -7.815

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ARG 712           H        ARG 712  61.515  -1.201  -7.260
    2    HA   ARG 712           HA       ARG 712  62.781  -3.299  -8.853
    3    HB2  ARG 712           HB2      ARG 712  63.617  -4.384  -6.874
    4    HB3  ARG 712           HB3      ARG 712  64.243  -2.747  -6.932
    5    HG2  ARG 712           HG2      ARG 712  62.735  -2.034  -5.182
    6    HG3  ARG 712           HG3      ARG 712  61.841  -3.517  -5.292
    7    HD2  ARG 712           HD2      ARG 712  64.749  -3.395  -4.504
    8    HD3  ARG 712           HD3      ARG 712  63.407  -3.516  -3.352
    9    HE   ARG 712           HE       ARG 712  63.505  -5.589  -5.379
   10   HH11  ARG 712          HH11      ARG 712  64.532  -4.764  -2.066
   11   HH12  ARG 712          HH12      ARG 712  64.777  -6.369  -1.592
   12   HH21  ARG 712          HH21      ARG 712  63.824  -7.795  -4.700
   13   HH22  ARG 712          HH22      ARG 712  64.346  -8.128  -3.108

  No H/Q in entry =          13
  In of MODEL   25
    1    H    CYS 713           H        CYS 713  62.075  -5.454  -7.877
    2    HA   CYS 713           HA       CYS 713  59.182  -5.347  -7.512
    3    HB2  CYS 713           HB2      CYS 713  60.969  -7.637  -8.374
    4    HB3  CYS 713           HB3      CYS 713  59.215  -7.681  -8.285

  No H/Q in entry =           4
  In of MODEL   25
    1    H    VAL 714           H        VAL 714  58.532  -5.650  -5.504
    2    HA   VAL 714           HA       VAL 714  60.109  -7.410  -3.745
    3    HB   VAL 714           HB       VAL 714  59.276  -6.083  -1.812
    4   HG11  VAL 714          HG11      VAL 714  61.481  -5.616  -2.660
    5   HG13  VAL 714          HG12      VAL 714  60.716  -4.134  -2.073
    6   HG12  VAL 714          HG13      VAL 714  60.810  -4.455  -3.805
    7   HG23  VAL 714          HG21      VAL 714  58.313  -3.838  -2.181
    8   HG22  VAL 714          HG22      VAL 714  57.273  -5.118  -2.799
    9   HG21  VAL 714          HG23      VAL 714  58.248  -4.164  -3.910

  No H/Q in entry =           9
  In of MODEL   25
    1    H    CYS 715           H        CYS 715  58.782  -8.622  -2.247
    2    HA   CYS 715           HA       CYS 715  56.132  -9.049  -3.349
    3    HB2  CYS 715           HB2      CYS 715  57.533 -10.454  -1.008
    4    HB3  CYS 715           HB3      CYS 715  56.021 -10.939  -1.740

  No H/Q in entry =           4
  In of MODEL   25
    1    H    LYS 716           H        LYS 716  54.421  -8.138  -2.490
    2    HA   LYS 716           HA       LYS 716  55.086  -6.114  -0.594
    3    HB2  LYS 716           HB2      LYS 716  53.592  -5.868  -2.657
    4    HB3  LYS 716           HB3      LYS 716  52.289  -6.468  -1.631
    5    HG2  LYS 716           HG2      LYS 716  52.358  -4.584  -0.252
    6    HG3  LYS 716           HG3      LYS 716  53.981  -4.132  -0.780
    7    HD2  LYS 716           HD2      LYS 716  53.086  -3.577  -2.986
    8    HD3  LYS 716           HD3      LYS 716  51.472  -4.040  -2.441
    9    HE2  LYS 716           HE2      LYS 716  51.791  -1.607  -2.410
   10    HE3  LYS 716           HE3      LYS 716  51.497  -2.243  -0.801
   11    HZ1  LYS 716           HZ1      LYS 716  54.191  -1.503  -1.873
   12    HZ3  LYS 716           HZ2      LYS 716  53.846  -2.008  -0.292
   13    HZ2  LYS 716           HZ3      LYS 716  53.212  -0.581  -0.889

  No H/Q in entry =          13
  In of MODEL   25
    1    H    MET 717           H        MET 717  52.355  -5.969   0.746
    2    HA   MET 717           HA       MET 717  52.912  -8.098   2.674
    3    HB2  MET 717           HB2      MET 717  51.400  -5.509   3.083
    4    HB3  MET 717           HB3      MET 717  51.756  -6.695   4.327
    5    HG2  MET 717           HG2      MET 717  53.723  -4.956   2.850
    6    HG3  MET 717           HG3      MET 717  53.277  -4.860   4.549
    7    HE2  MET 717           HE1      MET 717  53.261  -7.973   5.389
    8    HE1  MET 717           HE2      MET 717  53.992  -6.705   6.366
    9    HE3  MET 717           HE3      MET 717  54.916  -8.155   5.970

  No H/Q in entry =           9
  In of MODEL   25
    1    HA   PRO 718           HA       PRO 718  49.246 -10.154   1.458
    2    HB2  PRO 718           HB2      PRO 718  48.437 -11.277   3.836
    3    HB3  PRO 718           HB3      PRO 718  49.730 -11.925   2.823
    4    HG2  PRO 718           HG2      PRO 718  49.918 -10.215   5.269
    5    HG3  PRO 718           HG3      PRO 718  50.925 -11.589   4.785
    6    HD2  PRO 718           HD2      PRO 718  51.737  -9.041   4.497
    7    HD3  PRO 718           HD3      PRO 718  52.190 -10.303   3.333

  No H/Q in entry =           7
  In of MODEL   25
    1    H    TYR 719           H        TYR 719  49.017  -7.996   4.192
    2    HA   TYR 719           HA       TYR 719  46.133  -7.975   4.130
    3    HB2  TYR 719           HB2      TYR 719  46.217  -6.406   5.969
    4    HB3  TYR 719           HB3      TYR 719  47.383  -7.679   6.267
    5    HD1  TYR 719           HD1      TYR 719  49.865  -7.159   5.949
    6    HD2  TYR 719           HD2      TYR 719  46.855  -4.148   5.846
    7    HE1  TYR 719           HE1      TYR 719  51.564  -5.421   6.371
    8    HE2  TYR 719           HE2      TYR 719  48.538  -2.433   6.252
    9    HH   TYR 719           HH       TYR 719  50.698  -2.307   7.291

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLU 720           H        GLU 720  48.436  -6.578   2.256
    2    HA   GLU 720           HA       GLU 720  47.256  -4.007   1.727
    3    HB2  GLU 720           HB2      GLU 720  49.656  -4.526   1.431
    4    HB3  GLU 720           HB3      GLU 720  49.245  -5.692   0.193
    5    HG2  GLU 720           HG2      GLU 720  50.042  -3.748  -0.881
    6    HG3  GLU 720           HG3      GLU 720  48.302  -3.809  -1.144

  No H/Q in entry =           6
  In of MODEL   25
    1    H    CYS 721           H        CYS 721  47.035  -7.281   0.615
    2    HA   CYS 721           HA       CYS 721  45.801  -6.808  -1.881
    3    HB2  CYS 721           HB2      CYS 721  45.698  -9.273  -0.159
    4    HB3  CYS 721           HB3      CYS 721  45.383  -9.158  -1.888

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLY 722           H        GLY 722  43.880  -5.822  -1.956
    2    HA3  GLY 722           HA2      GLY 722  41.845  -6.537   0.011
    3    HA2  GLY 722           HA3      GLY 722  41.767  -5.166  -1.090

  No H/Q in entry =           3
  In of MODEL   25
    1    HA   PRO 723           HA       PRO 723  39.535  -7.754  -3.893
    2    HB2  PRO 723           HB2      PRO 723  40.575  -6.547  -6.267
    3    HB3  PRO 723           HB3      PRO 723  39.071  -6.170  -5.423
    4    HG2  PRO 723           HG2      PRO 723  41.220  -4.443  -5.604
    5    HG3  PRO 723           HG3      PRO 723  39.984  -4.376  -4.337
    6    HD2  PRO 723           HD2      PRO 723  42.717  -5.583  -4.267
    7    HD3  PRO 723           HD3      PRO 723  41.863  -4.633  -3.032

  No H/Q in entry =           7
  In of MODEL   25
    1    H    SER 724           H        SER 724  40.310  -9.887  -3.882
    2    HA   SER 724           HA       SER 724  41.873 -10.732  -6.096
    3    HB2  SER 724           HB2      SER 724  42.704 -11.298  -3.229
    4    HB3  SER 724           HB3      SER 724  43.477 -11.934  -4.688
    5    HG   SER 724           HG       SER 724  43.445  -9.387  -4.988

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU 725           H        LEU 725  41.556 -13.072  -6.254
    2    HA   LEU 725           HA       LEU 725  38.877 -13.779  -5.577
    3    HB2  LEU 725           HB2      LEU 725  40.917 -14.753  -7.318
    4    HB3  LEU 725           HB3      LEU 725  40.286 -16.096  -6.391
    5    HG   LEU 725           HG       LEU 725  38.016 -15.547  -7.187
    6   HD13  LEU 725          HD11      LEU 725  37.682 -14.010  -8.973
    7   HD12  LEU 725          HD12      LEU 725  39.370 -13.520  -8.895
    8   HD11  LEU 725          HD13      LEU 725  38.292 -13.184  -7.540
    9   HD21  LEU 725          HD21      LEU 725  39.350 -17.188  -8.415
   10   HD23  LEU 725          HD22      LEU 725  40.018 -15.863  -9.390
   11   HD22  LEU 725          HD23      LEU 725  38.303 -16.245  -9.486

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ASP 726           H        ASP 726  38.122 -14.711  -3.798
    2    HA   ASP 726           HA       ASP 726  39.928 -15.669  -1.813
    3    HB2  ASP 726           HB2      ASP 726  36.910 -15.623  -1.878
    4    HB3  ASP 726           HB3      ASP 726  37.829 -16.275  -0.532

  No H/Q in entry =           4
  In of MODEL   25
    1    H    VAL 727           H        VAL 727  40.299 -17.615  -1.098
    2    HA   VAL 727           HA       VAL 727  39.154 -19.972  -2.413
    3    HB   VAL 727           HB       VAL 727  41.473 -20.941  -2.757
    4   HG11  VAL 727          HG11      VAL 727  40.897 -18.443  -4.361
    5   HG13  VAL 727          HG12      VAL 727  40.285 -20.058  -4.700
    6   HG12  VAL 727          HG13      VAL 727  42.004 -19.719  -4.851
    7   HG23  VAL 727          HG21      VAL 727  43.394 -19.401  -2.876
    8   HG22  VAL 727          HG22      VAL 727  42.728 -19.500  -1.244
    9   HG21  VAL 727          HG23      VAL 727  42.376 -18.101  -2.260

  No H/Q in entry =           9
  In of MODEL   25
    1    H    CYS 728           H        CYS 728  39.805 -22.043  -1.172
    2    HA   CYS 728           HA       CYS 728  40.213 -21.381   1.643
    3    HB2  CYS 728           HB2      CYS 728  39.341 -23.977   0.343
    4    HB3  CYS 728           HB3      CYS 728  39.599 -23.765   2.061

  No H/Q in entry =           4
  In of MODEL   25
    1    H    ALA 729           H        ALA 729  41.995 -22.023   2.697
    2    HA   ALA 729           HA       ALA 729  43.899 -23.539   1.115
    3    HB2  ALA 729           HB1      ALA 729  45.660 -22.119   1.977
    4    HB1  ALA 729           HB2      ALA 729  44.447 -21.124   2.797
    5    HB3  ALA 729           HB3      ALA 729  44.481 -21.214   1.032

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLN 730           H        GLN 730  45.559 -24.440   2.409
    2    HA   GLN 730           HA       GLN 730  44.657 -25.101   5.113
    3    HB2  GLN 730           HB2      GLN 730  44.402 -27.053   3.596
    4    HB3  GLN 730           HB3      GLN 730  46.093 -26.916   3.186
    5    HG2  GLN 730           HG2      GLN 730  46.775 -27.438   5.425
    6    HG3  GLN 730           HG3      GLN 730  45.110 -27.430   5.983
    7   HE21  GLN 730          HE21      GLN 730  45.234 -29.525   6.717
    8   HE22  GLN 730          HE22      GLN 730  45.315 -30.876   5.651

  No H/Q in entry =           8
  In of MODEL   25
    1    H    ASP 731           H        ASP 731  45.998 -24.685   6.571
    2    HA   ASP 731           HA       ASP 731  48.546 -23.485   6.067
    3    HB2  ASP 731           HB2      ASP 731  47.252 -22.664   7.891
    4    HB3  ASP 731           HB3      ASP 731  47.064 -24.279   8.556

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLU 732           H        GLU 732  50.565 -24.402   6.366
    2    HA   GLU 732           HA       GLU 732  50.510 -27.278   6.442
    3    HB2  GLU 732           HB2      GLU 732  52.603 -25.346   5.517
    4    HB3  GLU 732           HB3      GLU 732  52.924 -27.066   5.716
    5    HG2  GLU 732           HG2      GLU 732  50.808 -25.866   3.952
    6    HG3  GLU 732           HG3      GLU 732  52.318 -26.620   3.424

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ARG 733           H        ARG 733  50.686 -25.208   8.828
    2    HA   ARG 733           HA       ARG 733  52.699 -26.761  10.272
    3    HB2  ARG 733           HB2      ARG 733  53.126 -24.433  10.494
    4    HB3  ARG 733           HB3      ARG 733  51.432 -24.081  10.796
    5    HG2  ARG 733           HG2      ARG 733  52.820 -23.902  12.812
    6    HG3  ARG 733           HG3      ARG 733  51.556 -25.121  12.953
    7    HD2  ARG 733           HD2      ARG 733  53.254 -26.853  12.385
    8    HD3  ARG 733           HD3      ARG 733  54.490 -25.590  12.436
    9    HE   ARG 733           HE       ARG 733  53.356 -25.260  14.771
   10   HH11  ARG 733          HH11      ARG 733  54.270 -28.380  13.247
   11   HH12  ARG 733          HH12      ARG 733  54.649 -29.091  14.741
   12   HH21  ARG 733          HH21      ARG 733  53.856 -26.318  16.758
   13   HH22  ARG 733          HH22      ARG 733  54.437 -27.934  16.746

  No H/Q in entry =          13
  In of MODEL   25
    1    H    SER 734           H        SER 734  49.483 -25.410  10.859
    2    HA   SER 734           HA       SER 734  49.024 -27.470  12.868
    3    HB2  SER 734           HB2      SER 734  47.277 -25.139  12.047
    4    HB3  SER 734           HB3      SER 734  47.080 -26.144  13.484
    5    HG   SER 734           HG       SER 734  48.720 -24.008  13.068

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LYS 735           H        LYS 735  48.622 -27.077   9.588
    2    HA   LYS 735           HA       LYS 735  47.497 -28.124   7.934
    3    HB2  LYS 735           HB2      LYS 735  46.899 -30.185  10.065
    4    HB3  LYS 735           HB3      LYS 735  46.760 -30.434   8.333
    5    HG2  LYS 735           HG2      LYS 735  49.321 -29.843   9.823
    6    HG3  LYS 735           HG3      LYS 735  48.811 -31.423   9.230
    7    HD2  LYS 735           HD2      LYS 735  49.356 -29.010   7.496
    8    HD3  LYS 735           HD3      LYS 735  50.490 -30.322   7.774
    9    HE2  LYS 735           HE2      LYS 735  48.786 -31.894   6.831
   10    HE3  LYS 735           HE3      LYS 735  47.791 -30.497   6.437
   11    HZ1  LYS 735           HZ1      LYS 735  49.657 -29.707   4.984
   12    HZ3  LYS 735           HZ2      LYS 735  49.006 -31.193   4.545
   13    HZ2  LYS 735           HZ3      LYS 735  50.469 -31.146   5.348

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ARG 736           H        ARG 736  46.148 -26.220   9.582
    2    HA   ARG 736           HA       ARG 736  43.383 -27.077   9.706
    3    HB2  ARG 736           HB2      ARG 736  42.956 -24.871  10.675
    4    HB3  ARG 736           HB3      ARG 736  44.274 -25.668  11.514
    5    HG2  ARG 736           HG2      ARG 736  45.901 -24.302  10.346
    6    HG3  ARG 736           HG3      ARG 736  44.625 -23.555   9.386
    7    HD2  ARG 736           HD2      ARG 736  43.648 -22.648  11.454
    8    HD3  ARG 736           HD3      ARG 736  44.973 -23.358  12.376
    9    HE   ARG 736           HE       ARG 736  46.281 -21.835  10.587
   10   HH11  ARG 736          HH11      ARG 736  43.543 -21.062  12.717
   11   HH12  ARG 736          HH12      ARG 736  43.996 -19.438  12.907
   12   HH21  ARG 736          HH21      ARG 736  46.877 -19.640  10.846
   13   HH22  ARG 736          HH22      ARG 736  45.944 -18.589  11.799

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ILE 737           H        ILE 737  41.729 -26.107   8.475
    2    HA   ILE 737           HA       ILE 737  42.596 -25.003   5.944
    3    HB   ILE 737           HB       ILE 737  39.780 -25.632   6.852
    4   HG12  ILE 737          HG12      ILE 737  41.210 -27.677   6.976
    5   HG13  ILE 737          HG13      ILE 737  39.952 -27.799   5.754
    6   HG21  ILE 737          HG21      ILE 737  40.089 -24.138   4.945
    7   HG23  ILE 737          HG22      ILE 737  39.277 -25.636   4.492
    8   HG22  ILE 737          HG23      ILE 737  40.984 -25.397   4.096
    9   HD13  ILE 737          HD11      ILE 737  42.035 -28.731   4.970
   10   HD12  ILE 737          HD12      ILE 737  42.859 -27.201   5.284
   11   HD11  ILE 737          HD13      ILE 737  41.595 -27.294   4.047

  No H/Q in entry =          11
  In of MODEL   25
    1    H    LEU 738           H        LEU 738  42.469 -22.880   5.601
    2    HA   LEU 738           HA       LEU 738  40.612 -21.319   7.197
    3    HB2  LEU 738           HB2      LEU 738  42.149 -19.566   7.669
    4    HB3  LEU 738           HB3      LEU 738  42.902 -21.048   8.222
    5    HG   LEU 738           HG       LEU 738  43.599 -19.458   5.746
    6   HD12  LEU 738          HD11      LEU 738  45.683 -18.982   6.924
    7   HD11  LEU 738          HD12      LEU 738  45.075 -19.844   8.337
    8   HD13  LEU 738          HD13      LEU 738  44.282 -18.367   7.792
    9   HD21  LEU 738          HD21      LEU 738  43.933 -21.822   5.421
   10   HD23  LEU 738          HD22      LEU 738  44.927 -21.908   6.884
   11   HD22  LEU 738          HD23      LEU 738  45.472 -20.966   5.476

  No H/Q in entry =          11
  In of MODEL   25
    1    HA   PRO 739           HA       PRO 739  39.755 -19.434   3.262
    2    HB2  PRO 739           HB2      PRO 739  38.768 -17.068   4.068
    3    HB3  PRO 739           HB3      PRO 739  37.871 -18.578   4.318
    4    HG2  PRO 739           HG2      PRO 739  39.456 -16.952   6.245
    5    HG3  PRO 739           HG3      PRO 739  37.944 -17.840   6.501
    6    HD2  PRO 739           HD2      PRO 739  40.470 -18.761   7.210
    7    HD3  PRO 739           HD3      PRO 739  39.050 -19.793   6.953

  No H/Q in entry =           7
  In of MODEL   25
    1    H    LEU 740           H        LEU 740  41.165 -18.606   1.901
    2    HA   LEU 740           HA       LEU 740  42.700 -16.301   2.748
    3    HB2  LEU 740           HB2      LEU 740  43.795 -18.756   1.406
    4    HB3  LEU 740           HB3      LEU 740  44.572 -17.203   1.236
    5    HG   LEU 740           HG       LEU 740  44.219 -18.764   3.795
    6   HD13  LEU 740          HD11      LEU 740  45.895 -19.660   2.367
    7   HD12  LEU 740          HD12      LEU 740  46.694 -18.814   3.699
    8   HD11  LEU 740          HD13      LEU 740  46.588 -18.068   2.091
    9   HD22  LEU 740          HD21      LEU 740  44.039 -16.380   4.276
   10   HD21  LEU 740          HD22      LEU 740  45.482 -16.061   3.316
   11   HD23  LEU 740          HD23      LEU 740  45.606 -16.988   4.813

  No H/Q in entry =          11
  In of MODEL   25
    1    H    THR 741           H        THR 741  43.900 -15.596   0.598
    2    HA   THR 741           HA       THR 741  41.895 -15.573  -1.500
    3    HB   THR 741           HB       THR 741  43.256 -13.074  -0.494
    4    HG1  THR 741           HG1      THR 741  40.598 -13.854   0.248
    5   HG21  THR 741          HG21      THR 741  42.167 -13.103  -2.680
    6   HG23  THR 741          HG22      THR 741  41.389 -11.981  -1.550
    7   HG22  THR 741          HG23      THR 741  40.662 -13.557  -1.894

  No H/Q in entry =           7
  In of MODEL   25
    1    H    VAL 742           H        VAL 742  42.888 -15.187  -3.540
    2    HA   VAL 742           HA       VAL 742  45.233 -16.375  -4.204
    3    HB   VAL 742           HB       VAL 742  44.044 -13.971  -5.606
    4   HG13  VAL 742          HG11      VAL 742  46.273 -14.319  -6.384
    5   HG12  VAL 742          HG12      VAL 742  45.108 -14.804  -7.615
    6   HG11  VAL 742          HG13      VAL 742  45.957 -16.035  -6.661
    7   HG21  VAL 742          HG21      VAL 742  43.605 -16.909  -5.998
    8   HG23  VAL 742          HG22      VAL 742  43.017 -15.607  -7.052
    9   HG22  VAL 742          HG23      VAL 742  42.459 -15.699  -5.385

  No H/Q in entry =           9
  In of MODEL   25
    1    H    CYS 743           H        CYS 743  45.096 -12.811  -4.136
    2    HA   CYS 743           HA       CYS 743  47.805 -12.374  -4.398
    3    HB2  CYS 743           HB2      CYS 743  46.101 -10.625  -4.629
    4    HB3  CYS 743           HB3      CYS 743  45.789 -10.710  -2.906

  No H/Q in entry =           4
  In of MODEL   25
    1    H    LYS 744           H        LYS 744  45.876 -12.568  -1.444
    2    HA   LYS 744           HA       LYS 744  47.850 -12.012   0.414
    3    HB2  LYS 744           HB2      LYS 744  45.427 -13.774   0.691
    4    HB3  LYS 744           HB3      LYS 744  46.414 -13.172   2.019
    5    HG2  LYS 744           HG2      LYS 744  45.840 -10.868   1.412
    6    HG3  LYS 744           HG3      LYS 744  44.912 -11.451   0.036
    7    HD2  LYS 744           HD2      LYS 744  43.406 -10.857   1.825
    8    HD3  LYS 744           HD3      LYS 744  43.385 -12.604   1.619
    9    HE2  LYS 744           HE2      LYS 744  44.859 -12.865   3.521
   10    HE3  LYS 744           HE3      LYS 744  44.975 -11.113   3.699
   11    HZ3  LYS 744           HZ1      LYS 744  43.383 -12.040   5.265
   12    HZ2  LYS 744           HZ2      LYS 744  42.486 -12.729   4.021
   13    HZ1  LYS 744           HZ3      LYS 744  42.582 -11.068   4.155

  No H/Q in entry =          13
  In of MODEL   25
    1    H    MET 745           H        MET 745  46.696 -15.182  -0.641
    2    HA   MET 745           HA       MET 745  48.481 -16.856   0.735
    3    HB2  MET 745           HB2      MET 745  46.766 -17.993  -0.248
    4    HB3  MET 745           HB3      MET 745  46.800 -17.050  -1.716
    5    HG2  MET 745           HG2      MET 745  47.542 -19.107  -2.430
    6    HG3  MET 745           HG3      MET 745  49.005 -18.217  -2.197
    7    HE2  MET 745           HE1      MET 745  47.454 -21.568   0.530
    8    HE1  MET 745           HE2      MET 745  46.735 -21.047  -0.994
    9    HE3  MET 745           HE3      MET 745  46.654 -20.003   0.421

  No H/Q in entry =           9
  In of MODEL   25
    1    H    HIS 746           H        HIS 746  48.785 -15.447  -2.499
    2    HA   HIS 746           HA       HIS 746  51.295 -16.697  -3.081
    3    HB2  HIS 746           HB2      HIS 746  49.862 -14.361  -4.225
    4    HB3  HIS 746           HB3      HIS 746  51.534 -14.671  -4.727
    5    HD1  HIS 746           HD1      HIS 746  51.797 -17.062  -5.994
    6    HD2  HIS 746           HD2      HIS 746  47.954 -15.582  -5.597
    7    HE1  HIS 746           HE1      HIS 746  50.491 -18.099  -7.852
    8    HE2  HIS 746           HE2      HIS 746  48.215 -17.082  -7.701

  No H/Q in entry =           8
  In of MODEL   25
    1    H    VAL 747           H        VAL 747  50.425 -13.545  -1.790
    2    HA   VAL 747           HA       VAL 747  53.038 -12.555  -1.632
    3    HB   VAL 747           HB       VAL 747  50.466 -11.708  -0.281
    4   HG12  VAL 747          HG11      VAL 747  53.159 -10.349  -0.205
    5   HG11  VAL 747          HG12      VAL 747  52.380 -11.146   1.162
    6   HG13  VAL 747          HG13      VAL 747  51.653  -9.709   0.453
    7   HG23  VAL 747          HG21      VAL 747  52.179 -10.503  -2.422
    8   HG22  VAL 747          HG22      VAL 747  50.666  -9.816  -1.812
    9   HG21  VAL 747          HG23      VAL 747  50.660 -11.352  -2.690

  No H/Q in entry =           9
  In of MODEL   25
    1    H    LEU 748           H        LEU 748  50.944 -14.070   0.838
    2    HA   LEU 748           HA       LEU 748  52.942 -13.881   2.774
    3    HB2  LEU 748           HB2      LEU 748  51.596 -15.499   4.150
    4    HB3  LEU 748           HB3      LEU 748  50.703 -14.111   3.582
    5    HG   LEU 748           HG       LEU 748  49.693 -15.602   1.839
    6   HD13  LEU 748          HD11      LEU 748  49.715 -18.000   2.232
    7   HD12  LEU 748          HD12      LEU 748  50.907 -17.778   3.509
    8   HD11  LEU 748          HD13      LEU 748  51.323 -17.393   1.839
    9   HD21  LEU 748          HD21      LEU 748  49.219 -16.271   4.733
   10   HD23  LEU 748          HD22      LEU 748  48.111 -16.619   3.407
   11   HD22  LEU 748          HD23      LEU 748  48.487 -14.947   3.825

  No H/Q in entry =          11
  In of MODEL   25
    1    H    HIS 749           H        HIS 749  52.385 -16.137   0.277
    2    HA   HIS 749           HA       HIS 749  54.063 -18.214   1.139
    3    HB2  HIS 749           HB2      HIS 749  52.499 -18.358  -0.805
    4    HB3  HIS 749           HB3      HIS 749  53.569 -17.289  -1.702
    5    HD1  HIS 749           HD1      HIS 749  55.726 -18.330  -2.671
    6    HD2  HIS 749           HD2      HIS 749  53.394 -20.923  -0.456
    7    HE1  HIS 749           HE1      HIS 749  56.705 -20.583  -3.078
    8    HE2  HIS 749           HE2      HIS 749  55.060 -22.134  -2.042

  No H/Q in entry =           8
  In of MODEL   25
    1    H    CYS 750           H        CYS 750  54.670 -15.215  -0.668
    2    HA   CYS 750           HA       CYS 750  57.466 -15.796  -0.945
    3    HB2  CYS 750           HB2      CYS 750  56.278 -14.335  -2.591
    4    HB3  CYS 750           HB3      CYS 750  56.058 -13.131  -1.327

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLN 751           H        GLN 751  55.426 -14.249   1.390
    2    HA   GLN 751           HA       GLN 751  57.401 -12.862   2.780
    3    HB2  GLN 751           HB2      GLN 751  54.705 -13.917   3.578
    4    HB3  GLN 751           HB3      GLN 751  55.732 -13.079   4.720
    5    HG2  GLN 751           HG2      GLN 751  54.966 -11.849   2.100
    6    HG3  GLN 751           HG3      GLN 751  53.964 -11.687   3.540
    7   HE21  GLN 751          HE21      GLN 751  55.340  -9.554   2.087
    8   HE22  GLN 751          HE22      GLN 751  56.443  -8.877   3.225

  No H/Q in entry =           8
  In of MODEL   25
    1    H    GLY 752           H        GLY 752  56.754 -16.197   2.512
    2    HA3  GLY 752           HA2      GLY 752  58.650 -17.589   3.298
    3    HA2  GLY 752           HA3      GLY 752  58.518 -16.732   4.822

  No H/Q in entry =           3
  In of MODEL   25
    1    H    ARG 753           H        ARG 753  55.419 -17.240   3.758
    2    HA   ARG 753           HA       ARG 753  55.124 -19.399   5.680
    3    HB2  ARG 753           HB2      ARG 753  53.005 -17.915   4.127
    4    HB3  ARG 753           HB3      ARG 753  52.757 -18.988   5.494
    5    HG2  ARG 753           HG2      ARG 753  54.171 -16.336   5.560
    6    HG3  ARG 753           HG3      ARG 753  52.528 -16.624   6.112
    7    HD2  ARG 753           HD2      ARG 753  53.490 -18.312   7.750
    8    HD3  ARG 753           HD3      ARG 753  55.085 -17.709   7.306
    9    HE   ARG 753           HE       ARG 753  53.155 -15.738   8.186
   10   HH11  ARG 753          HH11      ARG 753  56.051 -17.609   9.037
   11   HH12  ARG 753          HH12      ARG 753  56.309 -16.772  10.492
   12   HH21  ARG 753          HH21      ARG 753  53.521 -14.635  10.202
   13   HH22  ARG 753          HH22      ARG 753  54.835 -15.082  11.193

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ASN 754           H        ASN 754  53.899 -21.321   5.189
    2    HA   ASN 754           HA       ASN 754  53.862 -22.094   2.343
    3    HB2  ASN 754           HB2      ASN 754  54.363 -23.888   4.742
    4    HB3  ASN 754           HB3      ASN 754  54.233 -24.427   3.079
    5   HD21  ASN 754          HD21      ASN 754  56.173 -22.901   5.432
    6   HD22  ASN 754          HD22      ASN 754  57.658 -22.894   4.531

  No H/Q in entry =           6
  In of MODEL   25
    1    H    TYR 755           H        TYR 755  51.915 -22.684   1.615
    2    HA   TYR 755           HA       TYR 755  49.940 -23.724   3.440
    3    HB2  TYR 755           HB2      TYR 755  49.607 -21.219   1.799
    4    HB3  TYR 755           HB3      TYR 755  48.230 -22.190   2.267
    5    HD1  TYR 755           HD1      TYR 755  47.348 -22.043   4.485
    6    HD2  TYR 755           HD2      TYR 755  50.955 -20.036   3.531
    7    HE1  TYR 755           HE1      TYR 755  47.196 -20.764   6.582
    8    HE2  TYR 755           HE2      TYR 755  50.799 -18.754   5.628
    9    HH   TYR 755           HH       TYR 755  49.143 -18.047   7.242

  No H/Q in entry =           9
  In of MODEL   25
    1    H    THR 756           H        THR 756  48.299 -24.810   2.348
    2    HA   THR 756           HA       THR 756  48.884 -25.593  -0.420
    3    HB   THR 756           HB       THR 756  47.581 -27.096   1.880
    4    HG1  THR 756           HG1      THR 756  49.514 -27.576   2.401
    5   HG22  THR 756          HG21      THR 756  47.738 -29.081   0.429
    6   HG21  THR 756          HG22      THR 756  48.352 -28.059  -0.884
    7   HG23  THR 756          HG23      THR 756  46.713 -27.822  -0.258

  No H/Q in entry =           7
  In of MODEL   25
    1    H    LEU 757           H        LEU 757  46.690 -26.113  -1.575
    2    HA   LEU 757           HA       LEU 757  44.643 -24.467  -0.360
    3    HB2  LEU 757           HB2      LEU 757  45.109 -25.026  -3.263
    4    HB3  LEU 757           HB3      LEU 757  43.615 -24.346  -2.654
    5    HG   LEU 757           HG       LEU 757  45.210 -22.600  -1.567
    6   HD11  LEU 757          HD11      LEU 757  46.890 -23.539  -3.862
    7   HD13  LEU 757          HD12      LEU 757  47.290 -23.598  -2.145
    8   HD12  LEU 757          HD13      LEU 757  47.127 -22.041  -2.960
    9   HD23  LEU 757          HD21      LEU 757  44.912 -21.188  -3.509
   10   HD22  LEU 757          HD22      LEU 757  43.482 -22.125  -3.060
   11   HD21  LEU 757          HD23      LEU 757  44.449 -22.614  -4.461

  No H/Q in entry =          11
  In of MODEL   25
    1    H    THR 758           H        THR 758  42.458 -25.077  -0.564
    2    HA   THR 758           HA       THR 758  42.126 -27.948  -0.849
    3    HB   THR 758           HB       THR 758  40.790 -27.866   1.351
    4    HG1  THR 758           HG1      THR 758  42.361 -25.989   2.456
    5   HG21  THR 758          HG21      THR 758  42.968 -29.033   1.097
    6   HG23  THR 758          HG22      THR 758  42.810 -28.302   2.688
    7   HG22  THR 758          HG23      THR 758  43.802 -27.521   1.459

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLY 759           H        GLY 759  39.656 -28.416  -0.268
    2    HA3  GLY 759           HA2      GLY 759  38.200 -27.304  -2.395
    3    HA2  GLY 759           HA3      GLY 759  37.590 -28.396  -1.164

  No H/Q in entry =           3
  In of MODEL   25
    1    H    ARG 760           H        ARG 760  36.204 -26.316  -2.338
    2    HA   ARG 760           HA       ARG 760  36.169 -23.863  -1.072
    3    HB2  ARG 760           HB2      ARG 760  35.102 -24.026  -3.123
    4    HB3  ARG 760           HB3      ARG 760  34.112 -25.386  -2.626
    5    HG2  ARG 760           HG2      ARG 760  33.681 -23.031  -1.044
    6    HG3  ARG 760           HG3      ARG 760  33.283 -22.758  -2.767
    7    HD2  ARG 760           HD2      ARG 760  31.858 -24.811  -2.587
    8    HD3  ARG 760           HD3      ARG 760  32.245 -24.863  -0.867
    9    HE   ARG 760           HE       ARG 760  31.264 -22.446  -1.004
   10   HH11  ARG 760          HH11      ARG 760  29.986 -25.369  -2.532
   11   HH12  ARG 760          HH12      ARG 760  28.366 -24.830  -2.508
   12   HH21  ARG 760          HH21      ARG 760  29.044 -21.736  -0.974
   13   HH22  ARG 760          HH22      ARG 760  27.831 -22.746  -1.627

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ASP 761           H        ASP 761  34.421 -26.744  -0.152
    2    HA   ASP 761           HA       ASP 761  33.113 -25.197   1.898
    3    HB2  ASP 761           HB2      ASP 761  31.774 -27.162   2.453
    4    HB3  ASP 761           HB3      ASP 761  31.770 -26.808   0.726

  No H/Q in entry =           4
  In of MODEL   25
    1    H    SER 762           H        SER 762  36.101 -26.489   1.817
    2    HA   SER 762           HA       SER 762  36.123 -27.690   4.386
    3    HB2  SER 762           HB2      SER 762  38.413 -26.681   2.691
    4    HB3  SER 762           HB3      SER 762  38.557 -27.717   4.111
    5    HG   SER 762           HG       SER 762  37.071 -29.151   2.925

  No H/Q in entry =           5
  In of MODEL   25
    1    H    CYS 763           H        CYS 763  36.635 -24.433   3.123
    2    HA   CYS 763           HA       CYS 763  37.075 -23.570   5.892
    3    HB2  CYS 763           HB2      CYS 763  38.101 -21.600   5.112
    4    HB3  CYS 763           HB3      CYS 763  38.881 -22.878   4.180

  No H/Q in entry =           4
  In of MODEL   25
    1    H    THR 764           H        THR 764  36.106 -21.224   6.098
    2    HA   THR 764           HA       THR 764  33.451 -21.359   4.913
    3    HB   THR 764           HB       THR 764  34.414 -19.551   7.146
    4    HG1  THR 764           HG1      THR 764  34.139 -22.140   7.196
    5   HG23  THR 764          HG21      THR 764  32.394 -18.845   5.978
    6   HG22  THR 764          HG22      THR 764  32.012 -19.371   7.624
    7   HG21  THR 764          HG23      THR 764  31.676 -20.432   6.246

  No H/Q in entry =           7
  In of MODEL   25
    1    H    LEU 765           H        LEU 765  33.765 -20.546   2.931
    2    HA   LEU 765           HA       LEU 765  35.333 -18.142   2.667
    3    HB2  LEU 765           HB2      LEU 765  35.248 -20.323   1.141
    4    HB3  LEU 765           HB3      LEU 765  33.947 -19.425   0.380
    5    HG   LEU 765           HG       LEU 765  35.585 -17.520   0.101
    6   HD13  LEU 765          HD11      LEU 765  37.163 -18.071   1.764
    7   HD12  LEU 765          HD12      LEU 765  37.979 -18.153   0.190
    8   HD11  LEU 765          HD13      LEU 765  37.479 -19.623   1.015
    9   HD23  LEU 765          HD21      LEU 765  36.673 -18.533  -1.831
   10   HD22  LEU 765          HD22      LEU 765  34.973 -18.997  -1.744
   11   HD21  LEU 765          HD23      LEU 765  36.227 -20.141  -1.251

  No H/Q in entry =          11
  In of MODEL   25
    1    HA   PRO 766           HA       PRO 766  31.480 -15.910   2.750
    2    HB2  PRO 766           HB2      PRO 766  32.479 -13.490   2.954
    3    HB3  PRO 766           HB3      PRO 766  33.026 -14.696   4.123
    4    HG2  PRO 766           HG2      PRO 766  34.264 -13.962   1.533
    5    HG3  PRO 766           HG3      PRO 766  35.032 -13.794   3.145
    6    HD2  PRO 766           HD2      PRO 766  35.422 -16.030   1.620
    7    HD3  PRO 766           HD3      PRO 766  35.246 -16.133   3.388

  No H/Q in entry =           7
  In of MODEL   25
    1    H    ALA 767           H        ALA 767  31.484 -13.350   1.506
    2    HA   ALA 767           HA       ALA 767  31.457 -13.947  -1.379
    3    HB1  ALA 767           HB1      ALA 767  29.285 -13.478  -0.393
    4    HB2  ALA 767           HB2      ALA 767  29.823 -12.104  -1.397
    5    HB3  ALA 767           HB3      ALA 767  29.982 -12.051   0.370

  No H/Q in entry =           5
  In of MODEL   25
    1    H    SER 768           H        SER 768  31.910 -12.025  -2.673
    2    HA   SER 768           HA       SER 768  34.309 -10.853  -1.730
    3    HB2  SER 768           HB2      SER 768  32.804 -10.477  -4.319
    4    HB3  SER 768           HB3      SER 768  34.479 -10.028  -3.977
    5    HG   SER 768           HG       SER 768  34.985 -12.136  -3.638

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA 769           H        ALA 769  31.017  -9.994  -1.534
    2    HA   ALA 769           HA       ALA 769  31.665  -7.583  -0.213
    3    HB1  ALA 769           HB1      ALA 769  30.226  -6.140  -1.467
    4    HB3  ALA 769           HB2      ALA 769  30.007  -7.366  -2.725
    5    HB2  ALA 769           HB3      ALA 769  31.606  -6.632  -2.454

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLU 770           H        GLU 770  29.699  -6.557   0.528
    2    HA   GLU 770           HA       GLU 770  27.392  -8.335   0.735
    3    HB2  GLU 770           HB2      GLU 770  27.283  -7.629   3.172
    4    HB3  GLU 770           HB3      GLU 770  28.583  -8.748   2.759
    5    HG2  GLU 770           HG2      GLU 770  30.190  -7.067   2.779
    6    HG3  GLU 770           HG3      GLU 770  28.987  -5.798   2.773

  No H/Q in entry =           6
  In of MODEL   25
    1    H    LYS 771           H        LYS 771  28.200  -5.877  -0.646
    2    HA   LYS 771           HA       LYS 771  26.349  -3.916   0.482
    3    HB2  LYS 771           HB2      LYS 771  28.694  -3.702  -1.345
    4    HB3  LYS 771           HB3      LYS 771  27.614  -2.334  -1.060
    5    HG2  LYS 771           HG2      LYS 771  29.375  -3.739   0.961
    6    HG3  LYS 771           HG3      LYS 771  29.684  -2.143   0.261
    7    HD2  LYS 771           HD2      LYS 771  28.678  -1.422   2.182
    8    HD3  LYS 771           HD3      LYS 771  27.198  -1.779   1.294
    9    HE2  LYS 771           HE2      LYS 771  26.841  -2.882   3.325
   10    HE3  LYS 771           HE3      LYS 771  27.475  -4.141   2.256
   11    HZ1  LYS 771           HZ1      LYS 771  29.700  -3.735   3.228
   12    HZ3  LYS 771           HZ2      LYS 771  28.601  -4.300   4.360
   13    HZ2  LYS 771           HZ3      LYS 771  29.005  -2.671   4.325

  No H/Q in entry =          13
  In of MODEL   25
    1    H    ALA 772           H        ALA 772  24.625  -3.377  -0.668
    2    HA   ALA 772           HA       ALA 772  23.699  -5.052  -2.732
    3    HB2  ALA 772           HB1      ALA 772  22.690  -2.354  -1.859
    4    HB1  ALA 772           HB2      ALA 772  22.220  -3.918  -1.182
    5    HB3  ALA 772           HB3      ALA 772  21.800  -3.513  -2.846

  No H/Q in entry =           5
  In of MODEL   25
    1    H    CYS 773           H        CYS 773  23.001  -4.322  -4.881
    2    HA   CYS 773           HA       CYS 773  24.934  -3.478  -6.596
    3    HB2  CYS 773           HB2      CYS 773  21.990  -2.956  -6.964
    4    HB3  CYS 773           HB3      CYS 773  23.212  -3.126  -8.222

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLY 774           H        GLY 774  25.855  -1.618  -7.185
    2    HA3  GLY 774           HA2      GLY 774  25.449   0.782  -7.723
    3    HA2  GLY 774           HA3      GLY 774  24.729   0.887  -6.116

  No H/Q in entry =           3
  In of MODEL   25
    1    H    ALA 775           H        ALA 775  26.672  -1.053  -5.102
    2    HA   ALA 775           HA       ALA 775  29.237   0.290  -5.329
    3    HB1  ALA 775           HB1      ALA 775  28.194   1.272  -3.321
    4    HB2  ALA 775           HB2      ALA 775  29.508   0.189  -2.859
    5    HB3  ALA 775           HB3      ALA 775  27.832  -0.344  -2.710

  No H/Q in entry =           5
  In of MODEL   25
    1    H    CYS 776           H        CYS 776  30.267  -1.394  -6.255
    2    HA   CYS 776           HA       CYS 776  30.191  -3.935  -4.873
    3    HB2  CYS 776           HB2      CYS 776  28.309  -4.031  -6.408
    4    HB3  CYS 776           HB3      CYS 776  29.343  -3.544  -7.741

  No H/Q in entry =           4
  In of MODEL   25
    1    HA   PRO 777           HA       PRO 777  34.561  -3.886  -6.064
    2    HB2  PRO 777           HB2      PRO 777  34.176  -6.830  -5.895
    3    HB3  PRO 777           HB3      PRO 777  35.408  -5.825  -5.132
    4    HG2  PRO 777           HG2      PRO 777  33.426  -6.761  -3.687
    5    HG3  PRO 777           HG3      PRO 777  33.938  -5.075  -3.477
    6    HD2  PRO 777           HD2      PRO 777  31.566  -6.157  -4.958
    7    HD3  PRO 777           HD3      PRO 777  31.696  -4.751  -3.877

  No H/Q in entry =           7
  In of MODEL   25
    1    H    LEU 778           H        LEU 778  35.976  -5.114  -7.541
    2    HA   LEU 778           HA       LEU 778  35.419  -4.711 -10.130
    3    HB2  LEU 778           HB2      LEU 778  37.400  -5.969 -10.751
    4    HB3  LEU 778           HB3      LEU 778  37.680  -5.000  -9.332
    5    HG   LEU 778           HG       LEU 778  37.212  -7.980  -9.317
    6   HD13  LEU 778          HD11      LEU 778  39.567  -8.233  -8.904
    7   HD12  LEU 778          HD12      LEU 778  39.792  -6.496  -8.884
    8   HD11  LEU 778          HD13      LEU 778  39.368  -7.305 -10.395
    9   HD22  LEU 778          HD21      LEU 778  36.560  -6.989  -7.212
   10   HD21  LEU 778          HD22      LEU 778  38.074  -6.092  -7.146
   11   HD23  LEU 778          HD23      LEU 778  38.089  -7.853  -7.001

  No H/Q in entry =          11
  In of MODEL   25
    1    H    TRP 779           H        TRP 779  35.166  -8.056  -8.776
    2    HA   TRP 779           HA       TRP 779  33.575  -8.632 -11.183
    3    HB2  TRP 779           HB2      TRP 779  33.950 -11.037 -10.769
    4    HB3  TRP 779           HB3      TRP 779  35.493 -10.192 -10.820
    5    HD1  TRP 779           HD1      TRP 779  33.052 -11.784  -8.339
    6    HE1  TRP 779           HE1      TRP 779  34.301 -12.316  -6.168
    7    HE3  TRP 779           HE3      TRP 779  37.602  -9.870  -9.539
    8    HZ2  TRP 779           HZ2      TRP 779  36.866 -12.011  -5.153
    9    HZ3  TRP 779           HZ3      TRP 779  39.398 -10.047  -7.903
   10    HH2  TRP 779           HH2      TRP 779  39.032 -11.091  -5.773

  No H/Q in entry =          10
  In of MODEL   25
    1    H    GLY 780           H        GLY 780  33.371  -8.041  -7.928
    2    HA3  GLY 780           HA2      GLY 780  31.657  -7.935  -6.417
    3    HA2  GLY 780           HA3      GLY 780  30.585  -8.026  -7.794

  No H/Q in entry =           3
  In of MODEL   25
    1    H    LYS 781           H        LYS 781  29.157  -9.159  -6.439
    2    HA   LYS 781           HA       LYS 781  29.328 -11.992  -6.723
    3    HB2  LYS 781           HB2      LYS 781  30.522 -11.379  -4.485
    4    HB3  LYS 781           HB3      LYS 781  28.903 -10.937  -3.953
    5    HG2  LYS 781           HG2      LYS 781  29.433 -13.218  -3.244
    6    HG3  LYS 781           HG3      LYS 781  28.111 -13.206  -4.417
    7    HD2  LYS 781           HD2      LYS 781  29.648 -13.825  -6.206
    8    HD3  LYS 781           HD3      LYS 781  31.013 -13.735  -5.095
    9    HE2  LYS 781           HE2      LYS 781  30.409 -15.988  -5.479
   10    HE3  LYS 781           HE3      LYS 781  30.014 -15.564  -3.805
   11    HZ1  LYS 781           HZ1      LYS 781  27.653 -15.264  -4.631
   12    HZ3  LYS 781           HZ2      LYS 781  28.234 -16.832  -4.679
   13    HZ2  LYS 781           HZ3      LYS 781  28.159 -15.955  -6.095

  No H/Q in entry =          13
  In of MODEL   25
    1    H    CYS 782           H        CYS 782  27.058 -12.579  -6.993
    2    HA   CYS 782           HA       CYS 782  25.373 -10.292  -6.409
    3    HB2  CYS 782           HB2      CYS 782  23.662 -11.286  -7.749
    4    HB3  CYS 782           HB3      CYS 782  25.162 -11.181  -8.650

  No H/Q in entry =           4
  In of MODEL   25
    1    H    ASP 783           H        ASP 783  23.055 -10.844  -5.759
    2    HA   ASP 783           HA       ASP 783  22.994 -11.664  -3.091
    3    HB2  ASP 783           HB2      ASP 783  21.282 -10.222  -4.095
    4    HB3  ASP 783           HB3      ASP 783  20.772 -11.529  -5.144

  No H/Q in entry =           4
  In of MODEL   25
    1    H    ALA 784           H        ALA 784  23.473 -13.629  -2.418
    2    HA   ALA 784           HA       ALA 784  22.089 -15.928  -3.596
    3    HB1  ALA 784           HB1      ALA 784  25.072 -15.850  -3.171
    4    HB2  ALA 784           HB2      ALA 784  24.249 -15.794  -4.729
    5    HB3  ALA 784           HB3      ALA 784  24.136 -17.238  -3.724

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLU 785           H        GLU 785  23.576 -14.399  -0.882
    2    HA   GLU 785           HA       GLU 785  22.962 -16.734   0.776
    3    HB2  GLU 785           HB2      GLU 785  25.349 -16.215   0.680
    4    HB3  GLU 785           HB3      GLU 785  25.025 -14.566   1.176
    5    HG2  GLU 785           HG2      GLU 785  25.892 -15.844   3.027
    6    HG3  GLU 785           HG3      GLU 785  24.220 -15.384   3.337

  No H/Q in entry =           6
  In of MODEL   25
    1    H    SER 786           H        SER 786  23.321 -13.202   1.122
    2    HA   SER 786           HA       SER 786  20.699 -12.948   2.248
    3    HB2  SER 786           HB2      SER 786  21.924 -13.894   4.174
    4    HB3  SER 786           HB3      SER 786  23.099 -12.589   4.070
    5    HG   SER 786           HG       SER 786  20.613 -12.637   5.185

  No H/Q in entry =           5
  In of MODEL   25
    1    H    SER 787           H        SER 787  23.915 -11.540   1.795
    2    HA   SER 787           HA       SER 787  22.991  -8.852   1.857
    3    HB2  SER 787           HB2      SER 787  25.544  -9.914   0.682
    4    HB3  SER 787           HB3      SER 787  25.244  -8.331   1.401
    5    HG   SER 787           HG       SER 787  25.067  -9.269   3.397

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LYS 788           H        LYS 788  22.342  -7.634   0.119
    2    HA   LYS 788           HA       LYS 788  22.049  -8.889  -2.497
    3    HB2  LYS 788           HB2      LYS 788  20.536  -7.066  -1.177
    4    HB3  LYS 788           HB3      LYS 788  21.615  -5.993  -2.051
    5    HG2  LYS 788           HG2      LYS 788  19.926  -8.125  -3.277
    6    HG3  LYS 788           HG3      LYS 788  19.487  -6.401  -3.238
    7    HD2  LYS 788           HD2      LYS 788  21.519  -6.004  -4.632
    8    HD3  LYS 788           HD3      LYS 788  21.783  -7.743  -4.672
    9    HE2  LYS 788           HE2      LYS 788  19.420  -6.240  -5.805
   10    HE3  LYS 788           HE3      LYS 788  20.706  -7.052  -6.691
   11    HZ1  LYS 788           HZ1      LYS 788  19.917  -9.188  -5.830
   12    HZ3  LYS 788           HZ2      LYS 788  18.720  -8.385  -6.668
   13    HZ2  LYS 788           HZ3      LYS 788  18.663  -8.413  -4.986

  No H/Q in entry =          13
  In of MODEL   25
    1    H    CYS 789           H        CYS 789  23.314  -8.585  -4.163
    2    HA   CYS 789           HA       CYS 789  25.030  -6.440  -4.435
    3    HB2  CYS 789           HB2      CYS 789  26.177  -7.818  -2.643
    4    HB3  CYS 789           HB3      CYS 789  26.328  -9.108  -3.829

  No H/Q in entry =           4
  In of MODEL   25
    1    H    VAL 790           H        VAL 790  26.746  -7.649  -6.360
    2    HA   VAL 790           HA       VAL 790  25.010  -8.922  -8.230
    3    HB   VAL 790           HB       VAL 790  24.316  -6.517  -8.253
    4   HG12  VAL 790          HG11      VAL 790  27.065  -6.017  -9.331
    5   HG11  VAL 790          HG12      VAL 790  26.403  -5.465  -7.801
    6   HG13  VAL 790          HG13      VAL 790  25.744  -4.837  -9.324
    7   HG21  VAL 790          HG21      VAL 790  25.484  -7.590 -10.800
    8   HG23  VAL 790          HG22      VAL 790  24.312  -6.263 -10.708
    9   HG22  VAL 790          HG23      VAL 790  23.864  -7.884 -10.164

  No H/Q in entry =           9
  In of MODEL   25
    1    H    CYS 791           H        CYS 791  26.356  -9.303 -10.339
    2    HA   CYS 791           HA       CYS 791  29.218  -9.459  -9.616
    3    HB2  CYS 791           HB2      CYS 791  27.872 -10.933 -11.896
    4    HB3  CYS 791           HB3      CYS 791  29.403 -11.256 -11.118

  No H/Q in entry =           4
  In of MODEL   25
    1    H    ARG 792           H        ARG 792  30.496  -8.084 -10.528
    2    HA   ARG 792           HA       ARG 792  29.687  -6.642 -12.926
    3    HB2  ARG 792           HB2      ARG 792  31.988  -6.297 -10.985
    4    HB3  ARG 792           HB3      ARG 792  31.879  -5.390 -12.486
    5    HG2  ARG 792           HG2      ARG 792  29.866  -4.336 -11.784
    6    HG3  ARG 792           HG3      ARG 792  29.761  -5.361 -10.353
    7    HD2  ARG 792           HD2      ARG 792  30.568  -3.077  -9.854
    8    HD3  ARG 792           HD3      ARG 792  31.728  -4.322  -9.413
    9    HE   ARG 792           HE       ARG 792  32.626  -3.652 -11.804
   10   HH11  ARG 792          HH11      ARG 792  31.565  -1.500  -9.174
   11   HH12  ARG 792          HH12      ARG 792  32.669  -0.268  -9.561
   12   HH21  ARG 792          HH21      ARG 792  34.130  -1.986 -12.283
   13   HH22  ARG 792          HH22      ARG 792  34.162  -0.526 -11.377

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLU 793           H        GLU 793  30.506  -7.174 -14.874
    2    HA   GLU 793           HA       GLU 793  31.968  -9.628 -14.841
    3    HB2  GLU 793           HB2      GLU 793  30.670  -8.180 -17.121
    4    HB3  GLU 793           HB3      GLU 793  31.437  -9.761 -17.231
    5    HG2  GLU 793           HG2      GLU 793  29.889 -10.718 -15.689
    6    HG3  GLU 793           HG3      GLU 793  29.179  -9.144 -15.350

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ALA 794           H        ALA 794  33.332  -9.748 -17.149
    2    HA   ALA 794           HA       ALA 794  35.823  -8.903 -16.156
    3    HB3  ALA 794           HB1      ALA 794  35.451 -11.007 -17.365
    4    HB1  ALA 794           HB2      ALA 794  36.770 -10.048 -18.035
    5    HB2  ALA 794           HB3      ALA 794  35.206 -10.085 -18.849

  No H/Q in entry =           5
  In of MODEL   25
    1    H    SER 795           H        SER 795  33.632  -7.266 -18.105
    2    HA   SER 795           HA       SER 795  35.761  -5.715 -19.252
    3    HB2  SER 795           HB2      SER 795  32.781  -5.493 -19.667
    4    HB3  SER 795           HB3      SER 795  34.008  -4.636 -20.601
    5    HG   SER 795           HG       SER 795  33.206  -7.270 -20.672

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLU 796           H        GLU 796  33.732  -5.709 -16.537
    2    HA   GLU 796           HA       GLU 796  33.690  -2.773 -16.215
    3    HB2  GLU 796           HB2      GLU 796  31.968  -4.888 -14.918
    4    HB3  GLU 796           HB3      GLU 796  31.783  -3.150 -14.757
    5    HG2  GLU 796           HG2      GLU 796  31.411  -4.741 -17.284
    6    HG3  GLU 796           HG3      GLU 796  30.126  -4.119 -16.251

  No H/Q in entry =           6
  In of MODEL   25
    1    H    CYS 797           H        CYS 797  35.844  -4.811 -15.476
    2    HA   CYS 797           HA       CYS 797  35.724  -5.365 -12.724
    3    HB2  CYS 797           HB2      CYS 797  38.290  -5.140 -14.293
    4    HB3  CYS 797           HB3      CYS 797  37.926  -6.127 -12.879

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLU 798           H        GLU 798  37.915  -3.095 -14.340
    2    HA   GLU 798           HA       GLU 798  39.205  -1.413 -13.591
    3    HB2  GLU 798           HB2      GLU 798  37.153  -0.162 -13.641
    4    HB3  GLU 798           HB3      GLU 798  36.660  -0.801 -12.085
    5    HG2  GLU 798           HG2      GLU 798  37.340   1.512 -11.914
    6    HG3  GLU 798           HG3      GLU 798  38.423   0.478 -10.987

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU 799           H        GLU 799  40.603  -2.931 -12.685
    2    HA   GLU 799           HA       GLU 799  41.755  -2.307 -10.294
    3    HB2  GLU 799           HB2      GLU 799  39.653  -3.336  -9.280
    4    HB3  GLU 799           HB3      GLU 799  40.103  -4.852 -10.044
    5    HG2  GLU 799           HG2      GLU 799  40.653  -4.699  -7.627
    6    HG3  GLU 799           HG3      GLU 799  42.043  -5.038  -8.662

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLU 800           H        GLU 800  43.547  -3.956  -9.824
    2    HA   GLU 800           HA       GLU 800  44.709  -4.753 -12.268
    3    HB2  GLU 800           HB2      GLU 800  45.505  -5.602  -9.466
    4    HB3  GLU 800           HB3      GLU 800  46.448  -5.946 -10.903
    5    HG2  GLU 800           HG2      GLU 800  46.626  -3.462 -11.249
    6    HG3  GLU 800           HG3      GLU 800  45.883  -3.259  -9.666

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLY 801           H        GLY 801  44.070  -7.146  -9.619
    2    HA3  GLY 801           HA2      GLY 801  43.149  -9.155  -9.748
    3    HA2  GLY 801           HA3      GLY 801  42.706  -8.850 -11.420

  No H/Q in entry =           3
  In of MODEL   25
    1    H    PHE 802           H        PHE 802  44.366 -10.829  -9.635
    2    HA   PHE 802           HA       PHE 802  46.866 -11.103 -10.959
    3    HB2  PHE 802           HB2      PHE 802  45.254 -12.892  -9.171
    4    HB3  PHE 802           HB3      PHE 802  46.701 -13.490  -9.965
    5    HD1  PHE 802           HD1      PHE 802  46.330 -10.038  -8.688
    6    HD2  PHE 802           HD2      PHE 802  47.948 -13.913  -7.995
    7    HE1  PHE 802           HE1      PHE 802  47.707  -9.152  -6.888
    8    HE2  PHE 802           HE2      PHE 802  49.306 -13.053  -6.226
    9    HZ   PHE 802           HZ       PHE 802  49.211 -10.649  -5.633

  No H/Q in entry =           9
  In of MODEL   25
    1    H    SER 803           H        SER 803  47.346 -13.401 -11.878
    2    HA   SER 803           HA       SER 803  45.322 -14.058 -13.847
    3    HB2  SER 803           HB2      SER 803  47.471 -14.890 -15.124
    4    HB3  SER 803           HB3      SER 803  47.032 -13.186 -15.158
    5    HG   SER 803           HG       SER 803  49.306 -14.229 -14.344

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ILE 804           H        ILE 804  44.473 -15.973 -13.527
    2    HA   ILE 804           HA       ILE 804  46.008 -17.885 -11.929
    3    HB   ILE 804           HB       ILE 804  44.052 -18.654 -10.753
    4   HG12  ILE 804          HG12      ILE 804  42.342 -18.252 -12.562
    5   HG13  ILE 804          HG13      ILE 804  41.813 -17.766 -10.964
    6   HG23  ILE 804          HG21      ILE 804  45.202 -16.814  -9.724
    7   HG22  ILE 804          HG22      ILE 804  43.470 -16.679  -9.406
    8   HG21  ILE 804          HG23      ILE 804  44.226 -15.659 -10.631
    9   HD13  ILE 804          HD11      ILE 804  41.089 -16.151 -12.570
   10   HD12  ILE 804          HD12      ILE 804  42.707 -15.973 -13.213
   11   HD11  ILE 804          HD13      ILE 804  42.346 -15.417 -11.574

  No H/Q in entry =          11
  In of MODEL   25
    1    H    CYS 805           H        CYS 805  44.864 -20.138 -12.035
    2    HA   CYS 805           HA       CYS 805  44.673 -20.745 -14.904
    3    HB2  CYS 805           HB2      CYS 805  46.626 -21.603 -13.426
    4    HB3  CYS 805           HB3      CYS 805  45.409 -22.620 -12.663

  No H/Q in entry =           4
  In of MODEL   25
    1    H    VAL 806           H        VAL 806  42.615 -21.286 -15.451
    2    HA   VAL 806           HA       VAL 806  41.160 -22.781 -13.425
    3    HB   VAL 806           HB       VAL 806  40.440 -20.411 -13.464
    4   HG13  VAL 806          HG11      VAL 806  40.999 -19.886 -15.651
    5   HG12  VAL 806          HG12      VAL 806  39.295 -19.528 -15.354
    6   HG11  VAL 806          HG13      VAL 806  39.760 -20.961 -16.278
    7   HG23  VAL 806          HG21      VAL 806  38.352 -22.251 -14.594
    8   HG22  VAL 806          HG22      VAL 806  38.063 -20.745 -13.710
    9   HG21  VAL 806          HG23      VAL 806  38.785 -22.128 -12.892

  No H/Q in entry =           9
  In of MODEL   25
    1    H    GLU 807           H        GLU 807  40.173 -24.550 -14.126
    2    HA   GLU 807           HA       GLU 807  40.561 -25.361 -16.848
    3    HB2  GLU 807           HB2      GLU 807  40.954 -26.947 -15.032
    4    HB3  GLU 807           HB3      GLU 807  39.294 -26.786 -14.499
    5    HG2  GLU 807           HG2      GLU 807  38.575 -27.655 -16.712
    6    HG3  GLU 807           HG3      GLU 807  40.275 -27.923 -17.082

  No H/Q in entry =           6
  In of MODEL   25
    1    H    VAL 808           H        VAL 808  39.299 -24.580 -18.206
    2    HA   VAL 808           HA       VAL 808  36.408 -24.617 -17.821
    3    HB   VAL 808           HB       VAL 808  37.994 -22.470 -19.207
    4   HG13  VAL 808          HG11      VAL 808  35.918 -21.298 -19.528
    5   HG12  VAL 808          HG12      VAL 808  35.043 -22.656 -18.798
    6   HG11  VAL 808          HG13      VAL 808  35.927 -22.882 -20.314
    7   HG21  VAL 808          HG21      VAL 808  38.217 -22.253 -16.851
    8   HG23  VAL 808          HG22      VAL 808  36.470 -22.313 -16.661
    9   HG22  VAL 808          HG23      VAL 808  37.219 -20.951 -17.497

  No H/Q in entry =           9
  In of MODEL   25
    1    H    ASN 809           H        ASN 809  35.545 -25.812 -19.442
    2    HA   ASN 809           HA       ASN 809  35.204 -26.858 -21.424
    3    HB2  ASN 809           HB2      ASN 809  37.424 -25.022 -22.357
    4    HB3  ASN 809           HB3      ASN 809  36.757 -26.231 -23.426
    5   HD21  ASN 809          HD21      ASN 809  34.775 -24.543 -21.121
    6   HD22  ASN 809          HD22      ASN 809  33.930 -23.553 -22.238

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLY 810           H        GLY 810  37.123 -27.578 -19.295
    2    HA3  GLY 810           HA2      GLY 810  38.163 -29.628 -18.869
    3    HA2  GLY 810           HA3      GLY 810  38.192 -29.922 -20.608

  No H/Q in entry =           3
  In of MODEL   25
    1    H    LYS 811           H        LYS 811  39.285 -27.007 -20.552
    2    HA   LYS 811           HA       LYS 811  42.097 -27.843 -20.486
    3    HB2  LYS 811           HB2      LYS 811  40.717 -25.533 -21.829
    4    HB3  LYS 811           HB3      LYS 811  42.438 -25.886 -21.886
    5    HG2  LYS 811           HG2      LYS 811  42.052 -27.884 -23.128
    6    HG3  LYS 811           HG3      LYS 811  40.303 -27.728 -22.925
    7    HD2  LYS 811           HD2      LYS 811  41.085 -26.995 -25.144
    8    HD3  LYS 811           HD3      LYS 811  40.280 -25.716 -24.234
    9    HE2  LYS 811           HE2      LYS 811  42.466 -24.800 -23.585
   10    HE3  LYS 811           HE3      LYS 811  43.268 -26.094 -24.471
   11    HZ2  LYS 811           HZ1      LYS 811  43.208 -24.018 -25.693
   12    HZ1  LYS 811           HZ2      LYS 811  41.520 -24.015 -25.656
   13    HZ3  LYS 811           HZ3      LYS 811  42.338 -25.211 -26.503

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLU 812           H        GLU 812  43.553 -26.493 -19.434
    2    HA   GLU 812           HA       GLU 812  42.338 -24.680 -17.492
    3    HB2  GLU 812           HB2      GLU 812  45.174 -25.688 -17.760
    4    HB3  GLU 812           HB3      GLU 812  44.586 -24.633 -16.488
    5    HG2  GLU 812           HG2      GLU 812  43.100 -26.395 -15.706
    6    HG3  GLU 812           HG3      GLU 812  43.682 -27.451 -16.994

  No H/Q in entry =           6
  In of MODEL   25
    1    H    GLN 813           H        GLN 813  42.090 -22.751 -18.075
    2    HA   GLN 813           HA       GLN 813  44.020 -21.608 -19.942
    3    HB2  GLN 813           HB2      GLN 813  41.939 -21.808 -21.005
    4    HB3  GLN 813           HB3      GLN 813  41.059 -21.129 -19.639
    5    HG2  GLN 813           HG2      GLN 813  42.032 -19.010 -20.044
    6    HG3  GLN 813           HG3      GLN 813  43.032 -19.644 -21.362
    7   HE21  GLN 813          HE21      GLN 813  39.877 -18.636 -20.440
    8   HE22  GLN 813          HE22      GLN 813  39.115 -18.753 -21.982

  No H/Q in entry =           8
  In of MODEL   25
    1    H    THR 814           H        THR 814  45.030 -19.826 -19.347
    2    HA   THR 814           HA       THR 814  44.724 -18.861 -16.649
    3    HB   THR 814           HB       THR 814  46.238 -17.575 -18.841
    4    HG1  THR 814           HG1      THR 814  47.920 -18.923 -18.610
    5   HG23  THR 814          HG21      THR 814  47.774 -16.884 -17.043
    6   HG22  THR 814          HG22      THR 814  46.742 -17.725 -15.881
    7   HG21  THR 814          HG23      THR 814  46.116 -16.344 -16.781

  No H/Q in entry =           7
  In of MODEL   25
    1    H    MET 815           H        MET 815  43.354 -17.354 -16.185
    2    HA   MET 815           HA       MET 815  42.802 -15.274 -18.143
    3    HB2  MET 815           HB2      MET 815  40.408 -15.240 -17.327
    4    HB3  MET 815           HB3      MET 815  40.845 -16.594 -18.349
    5    HG2  MET 815           HG2      MET 815  41.150 -17.943 -16.492
    6    HG3  MET 815           HG3      MET 815  40.697 -16.704 -15.349
    7    HE2  MET 815           HE1      MET 815  37.944 -18.988 -18.284
    8    HE1  MET 815           HE2      MET 815  39.612 -19.339 -17.828
    9    HE3  MET 815           HE3      MET 815  39.262 -17.946 -18.855

  No H/Q in entry =           9
  In of MODEL   25
    1    H    SER 816           H        SER 816  41.523 -13.476 -16.938
    2    HA   SER 816           HA       SER 816  43.353 -12.714 -14.856
    3    HB2  SER 816           HB2      SER 816  41.050 -11.186 -16.086
    4    HB3  SER 816           HB3      SER 816  42.324 -10.536 -15.047
    5    HG   SER 816           HG       SER 816  42.580 -10.298 -17.403

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLU 817           H        GLU 817  42.694 -11.938 -12.846
    2    HA   GLU 817           HA       GLU 817  41.137 -13.679 -11.395
    3    HB2  GLU 817           HB2      GLU 817  43.018 -12.151 -10.674
    4    HB3  GLU 817           HB3      GLU 817  41.807 -10.881 -10.651
    5    HG2  GLU 817           HG2      GLU 817  40.690 -11.773  -8.827
    6    HG3  GLU 817           HG3      GLU 817  41.449 -13.356  -9.042

  No H/Q in entry =           6
  In of MODEL   25
    1    H    CYS 818           H        CYS 818  40.281 -10.381 -12.537
    2    HA   CYS 818           HA       CYS 818  37.754 -10.513 -11.256
    3    HB2  CYS 818           HB2      CYS 818  37.165  -8.487 -12.388
    4    HB3  CYS 818           HB3      CYS 818  38.872  -8.372 -11.980

  No H/Q in entry =           4
  In of MODEL   25
    1    H    GLU 819           H        GLU 819  38.969 -11.568 -14.256
    2    HA   GLU 819           HA       GLU 819  36.531 -11.867 -15.650
    3    HB2  GLU 819           HB2      GLU 819  38.792 -11.754 -16.695
    4    HB3  GLU 819           HB3      GLU 819  39.158 -13.293 -15.964
    5    HG2  GLU 819           HG2      GLU 819  37.520 -14.394 -17.311
    6    HG3  GLU 819           HG3      GLU 819  36.984 -12.845 -17.971

  No H/Q in entry =           6
  In of MODEL   25
    1    H    ALA 820           H        ALA 820  38.704 -14.266 -14.169
    2    HA   ALA 820           HA       ALA 820  37.037 -16.454 -14.342
    3    HB3  ALA 820           HB1      ALA 820  39.050 -15.874 -12.184
    4    HB1  ALA 820           HB2      ALA 820  39.385 -16.620 -13.752
    5    HB2  ALA 820           HB3      ALA 820  38.387 -17.463 -12.568

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLY 821           H        GLY 821  37.341 -14.010 -11.819
    2    HA3  GLY 821           HA2      GLY 821  35.607 -15.125  -9.904
    3    HA2  GLY 821           HA3      GLY 821  36.045 -13.428 -10.041

  No H/Q in entry =           3
  In of MODEL   25
    1    H    ALA 822           H        ALA 822  35.016 -12.810 -12.521
    2    HA   ALA 822           HA       ALA 822  32.331 -12.352 -11.823
    3    HB2  ALA 822           HB1      ALA 822  33.665 -11.924 -14.501
    4    HB1  ALA 822           HB2      ALA 822  33.619 -10.763 -13.174
    5    HB3  ALA 822           HB3      ALA 822  32.117 -11.277 -13.950

  No H/Q in entry =           5
  In of MODEL   25
    1    H    LEU 823           H        LEU 823  33.827 -14.565 -14.158
    2    HA   LEU 823           HA       LEU 823  31.347 -15.555 -15.109
    3    HB2  LEU 823           HB2      LEU 823  34.123 -16.779 -15.151
    4    HB3  LEU 823           HB3      LEU 823  32.753 -17.673 -15.695
    5    HG   LEU 823           HG       LEU 823  33.866 -16.807 -17.616
    6   HD12  LEU 823          HD11      LEU 823  31.329 -15.273 -17.188
    7   HD11  LEU 823          HD12      LEU 823  31.481 -16.924 -17.783
    8   HD13  LEU 823          HD13      LEU 823  32.112 -15.583 -18.735
    9   HD21  LEU 823          HD21      LEU 823  33.500 -14.039 -16.476
   10   HD23  LEU 823          HD22      LEU 823  34.113 -14.419 -18.088
   11   HD22  LEU 823          HD23      LEU 823  35.030 -14.896 -16.664

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ARG 824           H        ARG 824  33.366 -16.417 -12.367
    2    HA   ARG 824           HA       ARG 824  31.830 -18.737 -11.649
    3    HB2  ARG 824           HB2      ARG 824  34.274 -18.406 -11.064
    4    HB3  ARG 824           HB3      ARG 824  33.777 -17.177  -9.917
    5    HG2  ARG 824           HG2      ARG 824  32.609 -18.791  -8.582
    6    HG3  ARG 824           HG3      ARG 824  32.864 -20.048  -9.785
    7    HD2  ARG 824           HD2      ARG 824  34.439 -20.426  -8.043
    8    HD3  ARG 824           HD3      ARG 824  35.321 -19.787  -9.411
    9    HE   ARG 824           HE       ARG 824  34.875 -17.559  -8.050
   10   HH11  ARG 824          HH11      ARG 824  36.027 -20.712  -6.902
   11   HH12  ARG 824          HH12      ARG 824  37.014 -20.115  -5.662
   12   HH21  ARG 824          HH21      ARG 824  36.264 -16.680  -6.260
   13   HH22  ARG 824          HH22      ARG 824  37.135 -17.759  -5.270

  No H/Q in entry =          13
  In of MODEL   25
    1    H    CYS 825           H        CYS 825  31.297 -15.454 -11.375
    2    HA   CYS 825           HA       CYS 825  29.687 -15.660  -8.962
    3    HB2  CYS 825           HB2      CYS 825  31.179 -13.632  -9.499
    4    HB3  CYS 825           HB3      CYS 825  30.059 -13.297 -10.802

  No H/Q in entry =           4
  In of MODEL   25
    1    H    ARG 826           H        ARG 826  29.562 -15.194 -12.384
    2    HA   ARG 826           HA       ARG 826  26.869 -14.525 -12.690
    3    HB2  ARG 826           HB2      ARG 826  29.057 -14.374 -14.189
    4    HB3  ARG 826           HB3      ARG 826  28.389 -15.859 -14.847
    5    HG2  ARG 826           HG2      ARG 826  26.344 -14.738 -15.395
    6    HG3  ARG 826           HG3      ARG 826  26.955 -13.280 -14.602
    7    HD2  ARG 826           HD2      ARG 826  27.308 -12.947 -16.943
    8    HD3  ARG 826           HD3      ARG 826  28.847 -13.273 -16.194
    9    HE   ARG 826           HE       ARG 826  27.897 -15.697 -17.132
   10   HH11  ARG 826          HH11      ARG 826  28.839 -12.513 -18.488
   11   HH12  ARG 826          HH12      ARG 826  29.341 -13.135 -19.976
   12   HH21  ARG 826          HH21      ARG 826  28.624 -16.547 -19.224
   13   HH22  ARG 826          HH22      ARG 826  29.248 -15.505 -20.415

  No H/Q in entry =          13
  In of MODEL   25
    1    H    GLY 827           H        GLY 827  28.648 -17.560 -13.074
    2    HA3  GLY 827           HA2      GLY 827  27.283 -19.548 -12.248
    3    HA2  GLY 827           HA3      GLY 827  26.044 -18.904 -13.327

  No H/Q in entry =           3
  In of MODEL   25
    1    H    GLN 828           H        GLN 828  29.399 -18.837 -14.174
    2    HA   GLN 828           HA       GLN 828  28.833 -20.537 -16.461
    3    HB2  GLN 828           HB2      GLN 828  29.951 -18.377 -16.819
    4    HB3  GLN 828           HB3      GLN 828  31.205 -18.850 -15.687
    5    HG2  GLN 828           HG2      GLN 828  31.977 -19.024 -18.010
    6    HG3  GLN 828           HG3      GLN 828  31.947 -20.581 -17.183
    7   HE21  GLN 828          HE21      GLN 828  29.005 -19.132 -18.353
    8   HE22  GLN 828          HE22      GLN 828  28.752 -20.247 -19.630

  No H/Q in entry =           8
  In of MODEL   25
    1    H    SER 829           H        SER 829  30.215 -22.336 -16.934
    2    HA   SER 829           HA       SER 829  31.082 -23.687 -14.546
    3    HB2  SER 829           HB2      SER 829  31.017 -24.624 -17.410
    4    HB3  SER 829           HB3      SER 829  31.121 -25.620 -15.950
    5    HG   SER 829           HG       SER 829  29.067 -24.250 -15.485

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ILE 830           H        ILE 830  33.002 -23.177 -13.876
    2    HA   ILE 830           HA       ILE 830  35.378 -23.367 -15.581
    3    HB   ILE 830           HB       ILE 830  36.363 -21.363 -14.672
    4   HG12  ILE 830          HG12      ILE 830  35.343 -21.412 -12.366
    5   HG13  ILE 830          HG13      ILE 830  35.369 -19.811 -13.046
    6   HG21  ILE 830          HG21      ILE 830  33.631 -20.670 -15.675
    7   HG23  ILE 830          HG22      ILE 830  35.120 -20.872 -16.615
    8   HG22  ILE 830          HG23      ILE 830  34.954 -19.511 -15.505
    9   HD13  ILE 830          HD11      ILE 830  33.009 -19.990 -13.587
   10   HD12  ILE 830          HD12      ILE 830  33.316 -20.251 -11.869
   11   HD11  ILE 830          HD13      ILE 830  32.975 -21.624 -12.921

  No H/Q in entry =          11
  In of MODEL   25
    1    H    SER 831           H        SER 831  37.130 -24.100 -14.212
    2    HA   SER 831           HA       SER 831  36.362 -24.702 -11.463
    3    HB2  SER 831           HB2      SER 831  37.711 -26.443 -13.493
    4    HB3  SER 831           HB3      SER 831  37.475 -26.851 -11.793
    5    HG   SER 831           HG       SER 831  35.252 -25.989 -13.148

  No H/Q in entry =           5
  In of MODEL   25
    1    H    VAL 832           H        VAL 832  37.748 -23.371 -10.342
    2    HA   VAL 832           HA       VAL 832  40.269 -22.555 -11.442
    3    HB   VAL 832           HB       VAL 832  39.288 -22.239  -8.593
    4   HG11  VAL 832          HG11      VAL 832  41.692 -21.921  -8.802
    5   HG13  VAL 832          HG12      VAL 832  40.905 -20.376  -8.468
    6   HG12  VAL 832          HG13      VAL 832  41.450 -20.756 -10.102
    7   HG21  VAL 832          HG21      VAL 832  39.032 -20.330 -10.924
    8   HG23  VAL 832          HG22      VAL 832  38.598 -19.961  -9.256
    9   HG22  VAL 832          HG23      VAL 832  37.715 -21.205 -10.143

  No H/Q in entry =           9
  In of MODEL   25
    1    H    THR 833           H        THR 833  41.803 -24.040 -11.689
    2    HA   THR 833           HA       THR 833  42.043 -26.185  -9.816
    3    HB   THR 833           HB       THR 833  43.880 -26.860 -11.451
    4    HG1  THR 833           HG1      THR 833  43.993 -25.766 -13.351
    5   HG21  THR 833          HG21      THR 833  41.612 -27.819 -11.525
    6   HG23  THR 833          HG22      THR 833  42.264 -27.620 -13.150
    7   HG22  THR 833          HG23      THR 833  41.078 -26.473 -12.530

  No H/Q in entry =           7
  In of MODEL   25
    1    H    SER 834           H        SER 834  43.789 -23.292 -10.809
    2    HA   SER 834           HA       SER 834  45.334 -23.497  -8.388
    3    HB2  SER 834           HB2      SER 834  46.659 -23.264 -11.100
    4    HB3  SER 834           HB3      SER 834  47.482 -23.073  -9.554
    5    HG   SER 834           HG       SER 834  46.617 -25.331 -10.862

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ILE 835           H        ILE 835  46.058 -21.538  -7.635
    2    HA   ILE 835           HA       ILE 835  44.764 -19.178  -8.686
    3    HB   ILE 835           HB       ILE 835  45.783 -18.039  -6.756
    4   HG12  ILE 835          HG12      ILE 835  47.125 -20.721  -6.285
    5   HG13  ILE 835          HG13      ILE 835  47.898 -19.194  -6.686
    6   HG21  ILE 835          HG21      ILE 835  43.650 -19.182  -6.495
    7   HG23  ILE 835          HG22      ILE 835  44.602 -19.300  -5.011
    8   HG22  ILE 835          HG23      ILE 835  44.491 -20.683  -6.101
    9   HD12  ILE 835          HD11      ILE 835  48.158 -19.778  -4.406
   10   HD11  ILE 835          HD12      ILE 835  46.400 -19.783  -4.192
   11   HD13  ILE 835          HD13      ILE 835  47.249 -18.279  -4.599

  No H/Q in entry =          11
  In of MODEL   25
    1    H    ARG 836           H        ARG 836  47.362 -20.809  -9.438
    2    HA   ARG 836           HA       ARG 836  49.286 -18.678 -10.054
    3    HB2  ARG 836           HB2      ARG 836  49.466 -21.664 -10.454
    4    HB3  ARG 836           HB3      ARG 836  50.788 -20.509 -10.528
    5    HG2  ARG 836           HG2      ARG 836  50.620 -20.072  -8.184
    6    HG3  ARG 836           HG3      ARG 836  49.169 -21.072  -8.058
    7    HD2  ARG 836           HD2      ARG 836  50.517 -22.956  -8.870
    8    HD3  ARG 836           HD3      ARG 836  51.957 -21.937  -8.722
    9    HE   ARG 836           HE       ARG 836  50.832 -21.725  -6.297
   10   HH11  ARG 836          HH11      ARG 836  51.808 -24.509  -8.228
   11   HH12  ARG 836          HH12      ARG 836  52.040 -25.550  -6.905
   12   HH21  ARG 836          HH21      ARG 836  51.085 -23.181  -4.437
   13   HH22  ARG 836          HH22      ARG 836  51.595 -24.772  -4.696

  No H/Q in entry =          13
  In of MODEL   25
    1    HA   PRO 837           HA       PRO 837  47.679 -18.766 -14.303
    2    HB2  PRO 837           HB2      PRO 837  50.400 -18.352 -15.341
    3    HB3  PRO 837           HB3      PRO 837  48.994 -17.313 -15.465
    4    HG2  PRO 837           HG2      PRO 837  51.087 -16.692 -13.872
    5    HG3  PRO 837           HG3      PRO 837  49.425 -16.216 -13.506
    6    HD2  PRO 837           HD2      PRO 837  51.083 -18.383 -12.309
    7    HD3  PRO 837           HD3      PRO 837  49.864 -17.340 -11.559

  No H/Q in entry =           7
  In of MODEL   25
    1    H    CYS 838           H        CYS 838  47.808 -20.046 -16.351
    2    HA   CYS 838           HA       CYS 838  48.840 -22.750 -15.839
    3    HB2  CYS 838           HB2      CYS 838  47.287 -21.821 -18.255
    4    HB3  CYS 838           HB3      CYS 838  47.450 -23.449 -17.639

  No H/Q in entry =           4
  In of MODEL   25
    1    H    ALA 839           H        ALA 839  49.509 -23.776 -18.087
    2    HA   ALA 839           HA       ALA 839  51.290 -21.968 -19.522
    3    HB2  ALA 839           HB1      ALA 839  51.067 -25.000 -19.552
    4    HB1  ALA 839           HB2      ALA 839  52.330 -24.069 -18.741
    5    HB3  ALA 839           HB3      ALA 839  52.224 -24.065 -20.503

  No H/Q in entry =           5
  In of MODEL   25
    1    H    ALA 840           H        ALA 840  49.160 -21.071 -20.131
    2    HA   ALA 840           HA       ALA 840  48.008 -22.431 -22.477
    3    HB2  ALA 840           HB1      ALA 840  46.544 -22.815 -20.560
    4    HB3  ALA 840           HB2      ALA 840  45.784 -21.751 -21.744
    5    HB1  ALA 840           HB3      ALA 840  46.472 -21.077 -20.267

  No H/Q in entry =           5
  In of MODEL   25
    1    H    GLU 841           H        GLU 841  49.952 -20.376 -22.338
    2    HA   GLU 841           HA       GLU 841  48.602 -17.861 -22.769
    3    HB2  GLU 841           HB2      GLU 841  51.517 -18.506 -23.206
    4    HB3  GLU 841           HB3      GLU 841  50.794 -16.921 -22.977
    5    HG2  GLU 841           HG2      GLU 841  51.053 -19.099 -20.921
    6    HG3  GLU 841           HG3      GLU 841  51.948 -17.587 -20.981

  No H/Q in entry =           6
  In of MODEL   25
    1    H    THR 842           H        THR 842  48.915 -20.502 -24.525
    2    HA   THR 842           HA       THR 842  49.197 -19.201 -27.116
    3    HB   THR 842           HB       THR 842  50.514 -21.256 -26.857
    4    HG1  THR 842           HG1      THR 842  48.363 -21.358 -28.678
    5   HG23  THR 842          HG21      THR 842  49.474 -23.466 -26.458
    6   HG22  THR 842          HG22      THR 842  47.918 -22.675 -26.208
    7   HG21  THR 842          HG23      THR 842  49.248 -22.375 -25.091

  No H/Q in entry =           7
  In of MODEL   25
    1    H    GLN 843           H        GLN 843  47.393 -18.918 -28.390
    2    HA   GLN 843           HA       GLN 843  44.859 -19.336 -27.058
    3    HB2  GLN 843           HB2      GLN 843  45.445 -17.134 -28.079
    4    HB3  GLN 843           HB3      GLN 843  45.443 -17.903 -29.658
    5    HG2  GLN 843           HG2      GLN 843  43.359 -16.741 -29.329
    6    HG3  GLN 843           HG3      GLN 843  43.075 -18.478 -29.353
    7   HE21  GLN 843          HE21      GLN 843  41.162 -18.293 -28.225
    8   HE22  GLN 843          HE22      GLN 843  41.103 -17.919 -26.539

  No H/Q in entry =           8
  In of MODEL   26
    1    H1   GLY 689           H1       GLY 689  66.627 -15.306 -32.256
    2    H2   GLY 689           H3       GLY 689  67.807 -14.111 -32.079
    3    H3   GLY 689           H2       GLY 689  68.242 -15.671 -32.572
    4    HA2  GLY 689           HA2      GLY 689  67.134 -14.935 -29.942
    5    HA3  GLY 689           HA3      GLY 689  68.801 -15.384 -30.280

  No H/Q in entry =           5
  In of MODEL   26
    1    H    SER 690           H        SER 690  68.782 -17.157 -28.944
    2    HA   SER 690           HA       SER 690  67.142 -19.441 -29.816
    3    HB2  SER 690           HB2      SER 690  69.618 -19.593 -30.284
    4    HB3  SER 690           HB3      SER 690  69.918 -19.438 -28.561
    5    HG   SER 690           HG       SER 690  68.294 -21.492 -29.637

  No H/Q in entry =           5
  In of MODEL   26
    1    H    HIS 691           H        HIS 691  66.530 -17.318 -27.864
    2    HA   HIS 691           HA       HIS 691  65.645 -16.980 -25.832
    3    HB2  HIS 691           HB2      HIS 691  65.311 -19.980 -25.944
    4    HB3  HIS 691           HB3      HIS 691  64.685 -19.003 -24.618
    5    HD1  HIS 691           HD1      HIS 691  62.463 -17.846 -25.003
    6    HD2  HIS 691           HD2      HIS 691  64.065 -19.467 -28.478
    7    HE1  HIS 691           HE1      HIS 691  60.677 -17.620 -26.734
    8    HE2  HIS 691           HE2      HIS 691  61.564 -18.924 -28.688

  No H/Q in entry =           8
  In of MODEL   26
    1    H    MET 692           H        MET 692  68.483 -17.310 -26.041
    2    HA   MET 692           HA       MET 692  69.378 -18.488 -23.573
    3    HB2  MET 692           HB2      MET 692  70.759 -16.563 -25.456
    4    HB3  MET 692           HB3      MET 692  71.538 -17.329 -24.082
    5    HG2  MET 692           HG2      MET 692  71.136 -19.528 -25.096
    6    HG3  MET 692           HG3      MET 692  70.384 -18.741 -26.477
    7    HE1  MET 692           HE1      MET 692  72.750 -20.853 -26.704
    8    HE3  MET 692           HE2      MET 692  73.771 -20.091 -27.924
    9    HE2  MET 692           HE3      MET 692  72.018 -20.074 -28.108

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ASN 693           H        ASN 693  68.133 -15.517 -24.630
    2    HA   ASN 693           HA       ASN 693  67.978 -14.603 -21.916
    3    HB2  ASN 693           HB2      ASN 693  68.671 -12.294 -22.447
    4    HB3  ASN 693           HB3      ASN 693  69.985 -13.401 -22.784
    5   HD21  ASN 693          HD21      ASN 693  69.435 -10.711 -23.749
    6   HD22  ASN 693          HD22      ASN 693  69.423 -10.774 -25.464

  No H/Q in entry =           6
  In of MODEL   26
    1    HA   PRO 694           HA       PRO 694  63.905 -13.786 -23.644
    2    HB2  PRO 694           HB2      PRO 694  63.438 -12.366 -21.100
    3    HB3  PRO 694           HB3      PRO 694  62.583 -13.763 -21.749
    4    HG2  PRO 694           HG2      PRO 694  64.217 -13.965 -19.621
    5    HG3  PRO 694           HG3      PRO 694  64.045 -15.273 -20.802
    6    HD2  PRO 694           HD2      PRO 694  66.241 -13.262 -20.506
    7    HD3  PRO 694           HD3      PRO 694  66.321 -14.995 -20.906

  No H/Q in entry =           7
  In of MODEL   26
    1    H    LEU 695           H        LEU 695  63.875 -12.170 -25.062
    2    HA   LEU 695           HA       LEU 695  65.470  -9.886 -25.002
    3    HB2  LEU 695           HB2      LEU 695  64.156 -11.079 -26.941
    4    HB3  LEU 695           HB3      LEU 695  62.878  -9.966 -26.524
    5    HG   LEU 695           HG       LEU 695  65.622  -9.289 -27.594
    6   HD13  LEU 695          HD11      LEU 695  64.396  -8.435 -29.512
    7   HD12  LEU 695          HD12      LEU 695  62.886  -8.983 -28.789
    8   HD11  LEU 695          HD13      LEU 695  64.116 -10.156 -29.256
    9   HD23  LEU 695          HD21      LEU 695  64.880  -6.943 -27.672
   10   HD22  LEU 695          HD22      LEU 695  64.957  -7.541 -26.016
   11   HD21  LEU 695          HD23      LEU 695  63.399  -7.388 -26.827

  No H/Q in entry =          11
  In of MODEL   26
    1    H    THR 696           H        THR 696  65.317  -8.570 -23.325
    2    HA   THR 696           HA       THR 696  62.751  -7.282 -22.750
    3    HB   THR 696           HB       THR 696  64.935  -8.015 -20.796
    4    HG1  THR 696           HG1      THR 696  63.771  -9.822 -21.536
    5   HG23  THR 696          HG21      THR 696  63.360  -7.339 -19.077
    6   HG22  THR 696          HG22      THR 696  62.153  -6.961 -20.302
    7   HG21  THR 696          HG23      THR 696  63.631  -6.001 -20.193

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLN 697           H        GLN 697  62.934  -5.108 -22.983
    2    HA   GLN 697           HA       GLN 697  65.478  -3.846 -23.318
    3    HB2  GLN 697           HB2      GLN 697  62.683  -2.698 -23.084
    4    HB3  GLN 697           HB3      GLN 697  64.104  -1.714 -23.366
    5    HG2  GLN 697           HG2      GLN 697  62.935  -2.028 -25.429
    6    HG3  GLN 697           HG3      GLN 697  64.449  -2.919 -25.499
    7   HE21  GLN 697          HE21      GLN 697  63.714  -4.271 -27.093
    8   HE22  GLN 697          HE22      GLN 697  62.520  -5.489 -26.811

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ALA 698           H        ALA 698  63.017  -2.624 -21.220
    2    HA   ALA 698           HA       ALA 698  64.225  -3.410 -18.778
    3    HB2  ALA 698           HB1      ALA 698  64.391  -0.451 -19.371
    4    HB1  ALA 698           HB2      ALA 698  65.794  -1.523 -19.378
    5    HB3  ALA 698           HB3      ALA 698  64.877  -1.267 -17.889

  No H/Q in entry =           5
  In of MODEL   26
    1    H    VAL 699           H        VAL 699  62.316  -4.314 -18.647
    2    HA   VAL 699           HA       VAL 699  60.371  -2.482 -17.648
    3    HB   VAL 699           HB       VAL 699  58.820  -4.275 -18.236
    4   HG13  VAL 699          HG11      VAL 699  58.844  -2.194 -19.544
    5   HG12  VAL 699          HG12      VAL 699  58.585  -3.525 -20.672
    6   HG11  VAL 699          HG13      VAL 699  60.184  -2.795 -20.518
    7   HG21  VAL 699          HG21      VAL 699  60.285  -6.105 -18.726
    8   HG23  VAL 699          HG22      VAL 699  61.016  -5.205 -20.055
    9   HG22  VAL 699          HG23      VAL 699  59.343  -5.754 -20.178

  No H/Q in entry =           9
  In of MODEL   26
    1    HA   PRO 700           HA       PRO 700  61.108  -4.837 -13.997
    2    HB2  PRO 700           HB2      PRO 700  58.816  -4.389 -12.644
    3    HB3  PRO 700           HB3      PRO 700  60.073  -3.166 -12.851
    4    HG2  PRO 700           HG2      PRO 700  57.497  -3.512 -14.344
    5    HG3  PRO 700           HG3      PRO 700  58.245  -2.012 -13.775
    6    HD2  PRO 700           HD2      PRO 700  58.399  -2.873 -16.350
    7    HD3  PRO 700           HD3      PRO 700  59.657  -1.891 -15.588

  No H/Q in entry =           7
  In of MODEL   26
    1    H    LYS 701           H        LYS 701  60.795  -6.876 -13.299
    2    HA   LYS 701           HA       LYS 701  58.493  -8.263 -14.468
    3    HB2  LYS 701           HB2      LYS 701  61.007  -9.659 -13.537
    4    HB3  LYS 701           HB3      LYS 701  59.660 -10.356 -14.409
    5    HG2  LYS 701           HG2      LYS 701  61.221 -10.197 -16.072
    6    HG3  LYS 701           HG3      LYS 701  60.375  -8.654 -16.255
    7    HD2  LYS 701           HD2      LYS 701  62.085  -7.515 -14.988
    8    HD3  LYS 701           HD3      LYS 701  62.905  -9.039 -14.657
    9    HE2  LYS 701           HE2      LYS 701  63.221  -9.309 -17.125
   10    HE3  LYS 701           HE3      LYS 701  62.554  -7.681 -17.304
   11    HZ3  LYS 701           HZ1      LYS 701  64.979  -7.620 -17.268
   12    HZ2  LYS 701           HZ2      LYS 701  64.993  -8.382 -15.766
   13    HZ1  LYS 701           HZ3      LYS 701  64.333  -6.841 -15.923

  No H/Q in entry =          13
  In of MODEL   26
    1    H    CYS 702           H        CYS 702  57.328  -7.431 -12.655
    2    HA   CYS 702           HA       CYS 702  57.905  -9.011 -10.257
    3    HB2  CYS 702           HB2      CYS 702  56.013  -6.630 -10.204
    4    HB3  CYS 702           HB3      CYS 702  56.842  -7.432  -8.926

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLN 703           H        GLN 703  56.521 -10.500  -9.772
    2    HA   GLN 703           HA       GLN 703  54.401 -11.189 -11.534
    3    HB2  GLN 703           HB2      GLN 703  55.041 -12.168  -8.752
    4    HB3  GLN 703           HB3      GLN 703  53.970 -12.963  -9.894
    5    HG2  GLN 703           HG2      GLN 703  56.908 -12.501 -10.358
    6    HG3  GLN 703           HG3      GLN 703  56.220 -13.994  -9.730
    7   HE21  GLN 703          HE21      GLN 703  57.719 -13.419 -12.169
    8   HE22  GLN 703          HE22      GLN 703  56.741 -13.986 -13.479

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ARG 704           H        ARG 704  52.169 -11.670 -10.467
    2    HA   ARG 704           HA       ARG 704  50.867  -9.270  -9.937
    3    HB2  ARG 704           HB2      ARG 704  50.038 -12.073  -9.254
    4    HB3  ARG 704           HB3      ARG 704  48.975 -10.685  -9.141
    5    HG2  ARG 704           HG2      ARG 704  50.321 -11.602 -11.662
    6    HG3  ARG 704           HG3      ARG 704  48.678 -12.023 -11.176
    7    HD2  ARG 704           HD2      ARG 704  48.088  -9.646 -11.186
    8    HD3  ARG 704           HD3      ARG 704  49.727  -9.250 -11.698
    9    HE   ARG 704           HE       ARG 704  48.924 -11.021 -13.575
   10   HH11  ARG 704          HH11      ARG 704  47.494  -7.961 -12.445
   11   HH12  ARG 704          HH12      ARG 704  46.722  -7.631 -13.929
   12   HH21  ARG 704          HH21      ARG 704  47.917 -10.535 -15.563
   13   HH22  ARG 704          HH22      ARG 704  46.992  -9.115 -15.760

  No H/Q in entry =          13
  In of MODEL   26
    1    H    TRP 705           H        TRP 705  52.329 -11.498  -7.720
    2    HA   TRP 705           HA       TRP 705  51.249 -10.173  -5.347
    3    HB2  TRP 705           HB2      TRP 705  52.318 -12.101  -4.177
    4    HB3  TRP 705           HB3      TRP 705  51.076 -12.547  -5.338
    5    HD1  TRP 705           HD1      TRP 705  54.797 -12.853  -4.670
    6    HE1  TRP 705           HE1      TRP 705  55.817 -14.519  -6.309
    7    HE3  TRP 705           HE3      TRP 705  50.776 -13.535  -7.746
    8    HZ2  TRP 705           HZ2      TRP 705  55.029 -15.982  -8.601
    9    HZ3  TRP 705           HZ3      TRP 705  50.996 -15.084  -9.643
   10    HH2  TRP 705           HH2      TRP 705  53.076 -16.284 -10.057

  No H/Q in entry =          10
  In of MODEL   26
    1    H    GLU 706           H        GLU 706  53.554  -9.321  -7.303
    2    HA   GLU 706           HA       GLU 706  55.461  -8.662  -5.185
    3    HB2  GLU 706           HB2      GLU 706  56.035  -9.275  -8.088
    4    HB3  GLU 706           HB3      GLU 706  57.226  -8.726  -6.891
    5    HG2  GLU 706           HG2      GLU 706  56.927 -10.770  -5.661
    6    HG3  GLU 706           HG3      GLU 706  55.658 -11.286  -6.771

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LYS 707           H        LYS 707  56.666  -6.684  -5.656
    2    HA   LYS 707           HA       LYS 707  55.136  -4.803  -7.240
    3    HB2  LYS 707           HB2      LYS 707  55.060  -3.164  -5.394
    4    HB3  LYS 707           HB3      LYS 707  54.127  -4.614  -5.066
    5    HG2  LYS 707           HG2      LYS 707  55.852  -5.434  -3.572
    6    HG3  LYS 707           HG3      LYS 707  56.871  -4.045  -3.962
    7    HD2  LYS 707           HD2      LYS 707  55.229  -2.535  -3.004
    8    HD3  LYS 707           HD3      LYS 707  54.137  -3.884  -2.701
    9    HE2  LYS 707           HE2      LYS 707  55.724  -4.835  -1.114
   10    HE3  LYS 707           HE3      LYS 707  56.865  -3.535  -1.462
   11    HZ1  LYS 707           HZ1      LYS 707  55.262  -1.959  -0.603
   12    HZ3  LYS 707           HZ2      LYS 707  55.636  -3.089   0.575
   13    HZ2  LYS 707           HZ3      LYS 707  54.162  -3.177  -0.241

  No H/Q in entry =          13
  In of MODEL   26
    1    H    LEU 708           H        LEU 708  56.261  -3.061  -7.910
    2    HA   LEU 708           HA       LEU 708  59.152  -3.271  -7.715
    3    HB2  LEU 708           HB2      LEU 708  58.053  -3.041  -9.936
    4    HB3  LEU 708           HB3      LEU 708  57.380  -1.510  -9.415
    5    HG   LEU 708           HG       LEU 708  59.742  -0.674  -9.167
    6   HD12  LEU 708          HD11      LEU 708  61.484  -1.845 -10.418
    7   HD11  LEU 708          HD12      LEU 708  60.384  -3.206 -10.658
    8   HD13  LEU 708          HD13      LEU 708  60.913  -2.771  -9.034
    9   HD22  LEU 708          HD21      LEU 708  58.371  -0.053 -11.062
   10   HD21  LEU 708          HD22      LEU 708  58.824  -1.541 -11.891
   11   HD23  LEU 708          HD23      LEU 708  60.043  -0.306 -11.569

  No H/Q in entry =          11
  In of MODEL   26
    1    H    GLN 709           H        GLN 709  60.070  -2.091  -6.172
    2    HA   GLN 709           HA       GLN 709  59.164   0.636  -5.732
    3    HB2  GLN 709           HB2      GLN 709  59.088   0.477  -3.331
    4    HB3  GLN 709           HB3      GLN 709  58.049  -0.795  -3.948
    5    HG2  GLN 709           HG2      GLN 709  59.938  -2.417  -3.572
    6    HG3  GLN 709           HG3      GLN 709  60.841  -1.094  -2.907
    7   HE21  GLN 709          HE21      GLN 709  61.021  -2.224  -0.946
    8   HE22  GLN 709          HE22      GLN 709  59.719  -2.255   0.185

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ASN 710           H        ASN 710  60.870   1.950  -5.244
    2    HA   ASN 710           HA       ASN 710  63.038   2.652  -4.870
    3    HB2  ASN 710           HB2      ASN 710  62.725   0.964  -2.858
    4    HB3  ASN 710           HB3      ASN 710  63.567  -0.141  -3.884
    5   HD21  ASN 710          HD21      ASN 710  64.977  -0.280  -2.180
    6   HD22  ASN 710          HD22      ASN 710  66.247   0.863  -1.980

  No H/Q in entry =           6
  In of MODEL   26
    1    H    SER 711           H        SER 711  62.084   1.172  -7.251
    2    HA   SER 711           HA       SER 711  62.775   0.609  -9.286
    3    HB2  SER 711           HB2      SER 711  65.491   1.403  -8.249
    4    HB3  SER 711           HB3      SER 711  65.137   1.046  -9.952
    5    HG   SER 711           HG       SER 711  63.379   2.746  -9.480

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ARG 712           H        ARG 712  62.924  -1.304  -6.862
    2    HA   ARG 712           HA       ARG 712  64.262  -3.401  -8.386
    3    HB2  ARG 712           HB2      ARG 712  65.021  -4.488  -6.372
    4    HB3  ARG 712           HB3      ARG 712  65.619  -2.840  -6.400
    5    HG2  ARG 712           HG2      ARG 712  64.050  -2.166  -4.761
    6    HG3  ARG 712           HG3      ARG 712  63.195  -3.705  -4.866
    7    HD2  ARG 712           HD2      ARG 712  66.053  -3.383  -4.003
    8    HD3  ARG 712           HD3      ARG 712  64.682  -3.628  -2.901
    9    HE   ARG 712           HE       ARG 712  64.553  -5.735  -4.620
   10   HH11  ARG 712          HH11      ARG 712  67.225  -4.515  -2.632
   11   HH12  ARG 712          HH12      ARG 712  67.911  -6.060  -2.414
   12   HH21  ARG 712          HH21      ARG 712  65.463  -7.805  -4.259
   13   HH22  ARG 712          HH22      ARG 712  66.874  -7.976  -3.310

  No H/Q in entry =          13
  In of MODEL   26
    1    H    CYS 713           H        CYS 713  63.501  -5.614  -7.433
    2    HA   CYS 713           HA       CYS 713  60.563  -5.462  -7.575
    3    HB2  CYS 713           HB2      CYS 713  62.388  -7.738  -8.393
    4    HB3  CYS 713           HB3      CYS 713  60.644  -7.643  -8.632

  No H/Q in entry =           4
  In of MODEL   26
    1    H    VAL 714           H        VAL 714  59.604  -5.945  -5.696
    2    HA   VAL 714           HA       VAL 714  60.798  -8.013  -4.009
    3    HB   VAL 714           HB       VAL 714  60.170  -6.769  -1.974
    4   HG12  VAL 714          HG11      VAL 714  61.889  -5.020  -2.021
    5   HG11  VAL 714          HG12      VAL 714  61.976  -5.174  -3.776
    6   HG13  VAL 714          HG13      VAL 714  62.452  -6.527  -2.748
    7   HG23  VAL 714          HG21      VAL 714  59.552  -4.382  -2.099
    8   HG22  VAL 714          HG22      VAL 714  58.350  -5.440  -2.839
    9   HG21  VAL 714          HG23      VAL 714  59.463  -4.526  -3.857

  No H/Q in entry =           9
  In of MODEL   26
    1    H    CYS 715           H        CYS 715  59.016  -8.500  -2.186
    2    HA   CYS 715           HA       CYS 715  56.725  -9.305  -3.755
    3    HB2  CYS 715           HB2      CYS 715  56.162 -10.669  -1.764
    4    HB3  CYS 715           HB3      CYS 715  57.806 -10.971  -2.310

  No H/Q in entry =           4
  In of MODEL   26
    1    H    LYS 716           H        LYS 716  54.546  -8.984  -2.905
    2    HA   LYS 716           HA       LYS 716  54.090  -6.294  -1.964
    3    HB2  LYS 716           HB2      LYS 716  52.754  -7.730  -3.689
    4    HB3  LYS 716           HB3      LYS 716  52.056  -8.509  -2.286
    5    HG2  LYS 716           HG2      LYS 716  51.261  -6.161  -1.581
    6    HG3  LYS 716           HG3      LYS 716  51.733  -5.667  -3.201
    7    HD2  LYS 716           HD2      LYS 716  49.743  -7.819  -2.522
    8    HD3  LYS 716           HD3      LYS 716  49.348  -6.193  -3.073
    9    HE2  LYS 716           HE2      LYS 716  50.962  -8.191  -4.602
   10    HE3  LYS 716           HE3      LYS 716  49.225  -7.972  -4.833
   11    HZ1  LYS 716           HZ1      LYS 716  49.709  -5.662  -5.502
   12    HZ3  LYS 716           HZ2      LYS 716  50.474  -6.753  -6.526
   13    HZ2  LYS 716           HZ3      LYS 716  51.352  -5.933  -5.353

  No H/Q in entry =          13
  In of MODEL   26
    1    H    MET 717           H        MET 717  52.026  -6.501  -0.199
    2    HA   MET 717           HA       MET 717  52.993  -8.219   1.990
    3    HB2  MET 717           HB2      MET 717  51.834  -5.428   2.206
    4    HB3  MET 717           HB3      MET 717  52.247  -6.440   3.577
    5    HG2  MET 717           HG2      MET 717  54.181  -5.399   1.521
    6    HG3  MET 717           HG3      MET 717  53.909  -4.699   3.112
    7    HE2  MET 717           HE1      MET 717  53.643  -7.313   4.974
    8    HE1  MET 717           HE2      MET 717  54.632  -5.919   5.408
    9    HE3  MET 717           HE3      MET 717  55.319  -7.539   5.469

  No H/Q in entry =           9
  In of MODEL   26
    1    HA   PRO 718           HA       PRO 718  48.946  -9.983   1.903
    2    HB2  PRO 718           HB2      PRO 718  48.576 -10.715   4.513
    3    HB3  PRO 718           HB3      PRO 718  49.638 -11.579   3.397
    4    HG2  PRO 718           HG2      PRO 718  50.323  -9.520   5.454
    5    HG3  PRO 718           HG3      PRO 718  51.154 -11.044   5.087
    6    HD2  PRO 718           HD2      PRO 718  52.072  -8.676   4.208
    7    HD3  PRO 718           HD3      PRO 718  52.215 -10.149   3.229

  No H/Q in entry =           7
  In of MODEL   26
    1    H    TYR 719           H        TYR 719  49.475  -7.249   3.871
    2    HA   TYR 719           HA       TYR 719  46.578  -6.883   4.244
    3    HB2  TYR 719           HB2      TYR 719  47.103  -5.213   5.925
    4    HB3  TYR 719           HB3      TYR 719  48.022  -6.663   6.276
    5    HD1  TYR 719           HD1      TYR 719  48.145  -3.138   5.757
    6    HD2  TYR 719           HD2      TYR 719  50.523  -6.659   5.553
    7    HE1  TYR 719           HE1      TYR 719  50.170  -1.765   5.891
    8    HE2  TYR 719           HE2      TYR 719  52.561  -5.286   5.689
    9    HH   TYR 719           HH       TYR 719  53.192  -2.822   5.127

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLU 720           H        GLU 720  48.810  -6.289   2.047
    2    HA   GLU 720           HA       GLU 720  48.123  -3.507   1.454
    3    HB2  GLU 720           HB2      GLU 720  50.456  -4.170   1.716
    4    HB3  GLU 720           HB3      GLU 720  50.286  -5.353   0.428
    5    HG2  GLU 720           HG2      GLU 720  49.899  -3.486  -1.126
    6    HG3  GLU 720           HG3      GLU 720  50.171  -2.359   0.211

  No H/Q in entry =           6
  In of MODEL   26
    1    H    CYS 721           H        CYS 721  47.167  -6.571   0.811
    2    HA   CYS 721           HA       CYS 721  46.152  -5.907  -1.831
    3    HB2  CYS 721           HB2      CYS 721  46.049  -8.448  -2.076
    4    HB3  CYS 721           HB3      CYS 721  47.650  -7.749  -2.204

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLY 722           H        GLY 722  43.978  -6.615  -2.210
    2    HA3  GLY 722           HA2      GLY 722  42.504  -7.552   0.113
    3    HA2  GLY 722           HA3      GLY 722  42.052  -5.988  -0.560

  No H/Q in entry =           3
  In of MODEL   26
    1    HA   PRO 723           HA       PRO 723  39.335  -7.751  -3.610
    2    HB2  PRO 723           HB2      PRO 723  41.028  -6.313  -5.614
    3    HB3  PRO 723           HB3      PRO 723  39.271  -6.304  -5.438
    4    HG2  PRO 723           HG2      PRO 723  40.687  -4.231  -4.619
    5    HG3  PRO 723           HG3      PRO 723  39.321  -4.817  -3.658
    6    HD2  PRO 723           HD2      PRO 723  42.242  -5.120  -3.177
    7    HD3  PRO 723           HD3      PRO 723  40.914  -4.940  -2.016

  No H/Q in entry =           7
  In of MODEL   26
    1    H    SER 724           H        SER 724  39.628  -9.979  -3.972
    2    HA   SER 724           HA       SER 724  41.249 -10.996  -6.016
    3    HB2  SER 724           HB2      SER 724  42.967 -10.521  -4.267
    4    HB3  SER 724           HB3      SER 724  42.065 -11.468  -3.107
    5    HG   SER 724           HG       SER 724  42.786 -12.574  -5.564

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU 725           H        LEU 725  40.876 -13.289  -6.046
    2    HA   LEU 725           HA       LEU 725  38.231 -14.050  -5.280
    3    HB2  LEU 725           HB2      LEU 725  40.571 -15.426  -6.499
    4    HB3  LEU 725           HB3      LEU 725  39.161 -16.370  -6.049
    5    HG   LEU 725           HG       LEU 725  39.086 -14.050  -7.975
    6   HD11  LEU 725          HD11      LEU 725  39.354 -17.013  -8.544
    7   HD13  LEU 725          HD12      LEU 725  40.610 -15.801  -8.821
    8   HD12  LEU 725          HD13      LEU 725  39.112 -15.748  -9.746
    9   HD21  LEU 725          HD21      LEU 725  37.225 -16.354  -7.466
   10   HD23  LEU 725          HD22      LEU 725  37.049 -15.087  -8.689
   11   HD22  LEU 725          HD23      LEU 725  36.977 -14.671  -6.979

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ASP 726           H        ASP 726  37.615 -14.894  -3.440
    2    HA   ASP 726           HA       ASP 726  39.536 -15.525  -1.409
    3    HB2  ASP 726           HB2      ASP 726  36.515 -15.896  -1.413
    4    HB3  ASP 726           HB3      ASP 726  37.548 -16.198  -0.030

  No H/Q in entry =           4
  In of MODEL   26
    1    H    VAL 727           H        VAL 727  40.295 -17.438  -0.913
    2    HA   VAL 727           HA       VAL 727  39.182 -19.828  -2.180
    3    HB   VAL 727           HB       VAL 727  41.522 -20.638  -2.665
    4   HG11  VAL 727          HG11      VAL 727  40.752 -18.106  -4.122
    5   HG13  VAL 727          HG12      VAL 727  40.190 -19.733  -4.499
    6   HG12  VAL 727          HG13      VAL 727  41.886 -19.319  -4.716
    7   HG23  VAL 727          HG21      VAL 727  43.359 -19.000  -2.793
    8   HG22  VAL 727          HG22      VAL 727  42.766 -19.184  -1.139
    9   HG21  VAL 727          HG23      VAL 727  42.302 -17.775  -2.091

  No H/Q in entry =           9
  In of MODEL   26
    1    H    CYS 728           H        CYS 728  39.721 -21.815  -0.992
    2    HA   CYS 728           HA       CYS 728  40.284 -21.148   1.785
    3    HB2  CYS 728           HB2      CYS 728  39.160 -23.722   0.661
    4    HB3  CYS 728           HB3      CYS 728  39.306 -23.266   2.343

  No H/Q in entry =           4
  In of MODEL   26
    1    H    ALA 729           H        ALA 729  42.081 -21.728   2.721
    2    HA   ALA 729           HA       ALA 729  43.853 -23.451   1.171
    3    HB3  ALA 729           HB1      ALA 729  44.495 -21.130   1.010
    4    HB2  ALA 729           HB2      ALA 729  45.680 -22.076   1.920
    5    HB1  ALA 729           HB3      ALA 729  44.547 -21.020   2.771

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLN 730           H        GLN 730  45.580 -24.281   2.497
    2    HA   GLN 730           HA       GLN 730  44.697 -24.879   5.210
    3    HB2  GLN 730           HB2      GLN 730  44.590 -26.807   3.630
    4    HB3  GLN 730           HB3      GLN 730  46.307 -26.600   3.365
    5    HG2  GLN 730           HG2      GLN 730  46.847 -27.123   5.567
    6    HG3  GLN 730           HG3      GLN 730  45.172 -27.095   6.093
    7   HE21  GLN 730          HE21      GLN 730  45.088 -29.225   6.771
    8   HE22  GLN 730          HE22      GLN 730  45.263 -30.553   5.684

  No H/Q in entry =           8
  In of MODEL   26
    1    H    ASP 731           H        ASP 731  45.996 -24.314   6.647
    2    HA   ASP 731           HA       ASP 731  48.467 -22.959   6.125
    3    HB2  ASP 731           HB2      ASP 731  46.916 -22.242   7.885
    4    HB3  ASP 731           HB3      ASP 731  47.082 -23.804   8.658

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLU 732           H        GLU 732  50.437 -24.009   5.950
    2    HA   GLU 732           HA       GLU 732  50.488 -26.810   6.544
    3    HB2  GLU 732           HB2      GLU 732  52.515 -24.973   5.335
    4    HB3  GLU 732           HB3      GLU 732  52.861 -26.664   5.679
    5    HG2  GLU 732           HG2      GLU 732  50.737 -25.592   3.843
    6    HG3  GLU 732           HG3      GLU 732  52.222 -26.426   3.382

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ARG 733           H        ARG 733  50.695 -24.496   8.694
    2    HA   ARG 733           HA       ARG 733  52.963 -25.693  10.086
    3    HB2  ARG 733           HB2      ARG 733  52.883 -23.228   9.898
    4    HB3  ARG 733           HB3      ARG 733  51.336 -23.223  10.714
    5    HG2  ARG 733           HG2      ARG 733  52.999 -22.569  12.279
    6    HG3  ARG 733           HG3      ARG 733  52.466 -24.190  12.710
    7    HD2  ARG 733           HD2      ARG 733  54.436 -25.160  11.682
    8    HD3  ARG 733           HD3      ARG 733  54.959 -23.576  11.113
    9    HE   ARG 733           HE       ARG 733  54.631 -23.383  13.836
   10   HH11  ARG 733          HH11      ARG 733  56.753 -25.145  11.622
   11   HH12  ARG 733          HH12      ARG 733  58.035 -25.292  12.717
   12   HH21  ARG 733          HH21      ARG 733  56.410 -23.557  15.349
   13   HH22  ARG 733          HH22      ARG 733  57.833 -24.377  14.908

  No H/Q in entry =          13
  In of MODEL   26
    1    H    SER 734           H        SER 734  49.539 -24.894  10.463
    2    HA   SER 734           HA       SER 734  49.388 -26.877  12.650
    3    HB2  SER 734           HB2      SER 734  47.531 -24.574  12.059
    4    HB3  SER 734           HB3      SER 734  47.396 -25.665  13.437
    5    HG   SER 734           HG       SER 734  49.386 -23.751  12.861

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LYS 735           H        LYS 735  48.645 -26.641   9.403
    2    HA   LYS 735           HA       LYS 735  47.386 -27.732   7.928
    3    HB2  LYS 735           HB2      LYS 735  47.098 -29.780  10.140
    4    HB3  LYS 735           HB3      LYS 735  46.697 -30.059   8.453
    5    HG2  LYS 735           HG2      LYS 735  49.444 -29.421   9.540
    6    HG3  LYS 735           HG3      LYS 735  48.890 -31.007   9.020
    7    HD2  LYS 735           HD2      LYS 735  49.095 -28.580   7.208
    8    HD3  LYS 735           HD3      LYS 735  50.323 -29.822   7.333
    9    HE2  LYS 735           HE2      LYS 735  48.683 -31.493   6.575
   10    HE3  LYS 735           HE3      LYS 735  47.468 -30.227   6.424
   11    HZ2  LYS 735           HZ1      LYS 735  49.981 -30.475   4.865
   12    HZ1  LYS 735           HZ2      LYS 735  49.006 -29.157   4.734
   13    HZ3  LYS 735           HZ3      LYS 735  48.430 -30.685   4.270

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ARG 736           H        ARG 736  46.157 -25.864   9.681
    2    HA   ARG 736           HA       ARG 736  43.383 -26.619   9.924
    3    HB2  ARG 736           HB2      ARG 736  43.098 -24.241  10.673
    4    HB3  ARG 736           HB3      ARG 736  44.306 -25.115  11.607
    5    HG2  ARG 736           HG2      ARG 736  46.081 -24.092  10.351
    6    HG3  ARG 736           HG3      ARG 736  44.927 -23.271   9.306
    7    HD2  ARG 736           HD2      ARG 736  44.180 -21.940  11.212
    8    HD3  ARG 736           HD3      ARG 736  45.298 -22.815  12.268
    9    HE   ARG 736           HE       ARG 736  46.701 -21.746  10.076
   10   HH11  ARG 736          HH11      ARG 736  45.129 -20.570  13.011
   11   HH12  ARG 736          HH12      ARG 736  46.219 -19.298  13.264
   12   HH21  ARG 736          HH21      ARG 736  48.179 -20.031  10.365
   13   HH22  ARG 736          HH22      ARG 736  48.030 -18.960  11.690

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ILE 737           H        ILE 737  41.749 -25.934   8.528
    2    HA   ILE 737           HA       ILE 737  42.571 -24.817   5.974
    3    HB   ILE 737           HB       ILE 737  39.747 -25.476   6.859
    4   HG12  ILE 737          HG12      ILE 737  41.173 -27.499   7.089
    5   HG13  ILE 737          HG13      ILE 737  39.967 -27.677   5.827
    6   HG21  ILE 737          HG21      ILE 737  40.017 -24.051   4.877
    7   HG23  ILE 737          HG22      ILE 737  39.298 -25.601   4.486
    8   HG22  ILE 737          HG23      ILE 737  41.000 -25.303   4.114
    9   HD12  ILE 737          HD11      ILE 737  42.094 -28.610   5.148
   10   HD11  ILE 737          HD12      ILE 737  42.880 -27.049   5.427
   11   HD13  ILE 737          HD13      ILE 737  41.663 -27.214   4.158

  No H/Q in entry =          11
  In of MODEL   26
    1    H    LEU 738           H        LEU 738  42.434 -22.683   5.617
    2    HA   LEU 738           HA       LEU 738  40.553 -21.136   7.209
    3    HB2  LEU 738           HB2      LEU 738  42.049 -19.399   7.747
    4    HB3  LEU 738           HB3      LEU 738  42.836 -20.879   8.271
    5    HG   LEU 738           HG       LEU 738  43.505 -19.164   5.873
    6   HD11  LEU 738          HD11      LEU 738  45.013 -19.701   8.417
    7   HD13  LEU 738          HD12      LEU 738  44.213 -18.195   7.958
    8   HD12  LEU 738          HD13      LEU 738  45.610 -18.766   7.046
    9   HD23  LEU 738          HD21      LEU 738  44.900 -21.666   6.812
   10   HD22  LEU 738          HD22      LEU 738  45.338 -20.639   5.414
   11   HD21  LEU 738          HD23      LEU 738  43.820 -21.526   5.427

  No H/Q in entry =          11
  In of MODEL   26
    1    HA   PRO 739           HA       PRO 739  39.670 -19.234   3.358
    2    HB2  PRO 739           HB2      PRO 739  38.535 -16.940   4.233
    3    HB3  PRO 739           HB3      PRO 739  37.734 -18.518   4.427
    4    HG2  PRO 739           HG2      PRO 739  39.290 -16.913   6.411
    5    HG3  PRO 739           HG3      PRO 739  37.764 -17.791   6.628
    6    HD2  PRO 739           HD2      PRO 739  40.205 -18.812   7.365
    7    HD3  PRO 739           HD3      PRO 739  38.815 -19.814   6.872

  No H/Q in entry =           7
  In of MODEL   26
    1    H    LEU 740           H        LEU 740  41.155 -18.372   2.054
    2    HA   LEU 740           HA       LEU 740  42.550 -15.948   2.915
    3    HB2  LEU 740           HB2      LEU 740  43.694 -18.307   1.421
    4    HB3  LEU 740           HB3      LEU 740  44.456 -16.739   1.436
    5    HG   LEU 740           HG       LEU 740  44.050 -18.550   3.819
    6   HD12  LEU 740          HD11      LEU 740  46.502 -18.684   3.758
    7   HD11  LEU 740          HD12      LEU 740  46.502 -17.715   2.275
    8   HD13  LEU 740          HD13      LEU 740  45.757 -19.308   2.287
    9   HD21  LEU 740          HD21      LEU 740  45.389 -15.845   3.623
   10   HD23  LEU 740          HD22      LEU 740  45.413 -16.900   5.033
   11   HD22  LEU 740          HD23      LEU 740  43.892 -16.200   4.490

  No H/Q in entry =          11
  In of MODEL   26
    1    H    THR 741           H        THR 741  43.692 -15.169   0.716
    2    HA   THR 741           HA       THR 741  41.699 -15.262  -1.404
    3    HB   THR 741           HB       THR 741  43.066 -12.821  -1.527
    4    HG1  THR 741           HG1      THR 741  41.990 -13.058   1.068
    5   HG23  THR 741          HG21      THR 741  40.726 -13.165  -2.133
    6   HG22  THR 741          HG22      THR 741  40.876 -11.829  -0.990
    7   HG21  THR 741          HG23      THR 741  40.300 -13.406  -0.439

  No H/Q in entry =           7
  In of MODEL   26
    1    H    VAL 742           H        VAL 742  42.642 -14.961  -3.463
    2    HA   VAL 742           HA       VAL 742  44.918 -16.391  -4.093
    3    HB   VAL 742           HB       VAL 742  43.722 -14.059  -5.588
    4   HG11  VAL 742          HG11      VAL 742  45.883 -14.563  -6.446
    5   HG13  VAL 742          HG12      VAL 742  44.599 -14.958  -7.576
    6   HG12  VAL 742          HG13      VAL 742  45.430 -16.263  -6.696
    7   HG22  VAL 742          HG21      VAL 742  42.086 -15.633  -5.149
    8   HG21  VAL 742          HG22      VAL 742  43.114 -16.975  -5.710
    9   HG23  VAL 742          HG23      VAL 742  42.535 -15.740  -6.856

  No H/Q in entry =           9
  In of MODEL   26
    1    H    CYS 743           H        CYS 743  44.552 -12.903  -3.842
    2    HA   CYS 743           HA       CYS 743  47.152 -12.153  -4.359
    3    HB2  CYS 743           HB2      CYS 743  46.576 -10.026  -3.268
    4    HB3  CYS 743           HB3      CYS 743  45.309 -10.579  -4.349

  No H/Q in entry =           4
  In of MODEL   26
    1    H    LYS 744           H        LYS 744  45.685 -12.292  -1.129
    2    HA   LYS 744           HA       LYS 744  47.948 -11.952   0.361
    3    HB2  LYS 744           HB2      LYS 744  45.485 -13.510   1.036
    4    HB3  LYS 744           HB3      LYS 744  46.773 -13.150   2.181
    5    HG2  LYS 744           HG2      LYS 744  46.397 -10.727   1.773
    6    HG3  LYS 744           HG3      LYS 744  45.071 -11.140   0.692
    7    HD2  LYS 744           HD2      LYS 744  44.216 -10.497   2.881
    8    HD3  LYS 744           HD3      LYS 744  43.890 -12.201   2.569
    9    HE2  LYS 744           HE2      LYS 744  45.770 -12.845   3.966
   10    HE3  LYS 744           HE3      LYS 744  46.197 -11.151   4.207
   11    HZ1  LYS 744           HZ1      LYS 744  43.633 -12.375   5.066
   12    HZ3  LYS 744           HZ2      LYS 744  44.213 -10.822   5.444
   13    HZ2  LYS 744           HZ3      LYS 744  44.982 -12.177   6.045

  No H/Q in entry =          13
  In of MODEL   26
    1    H    MET 745           H        MET 745  46.558 -15.095  -0.559
    2    HA   MET 745           HA       MET 745  48.412 -16.775   0.695
    3    HB2  MET 745           HB2      MET 745  46.639 -17.943  -0.174
    4    HB3  MET 745           HB3      MET 745  46.583 -17.009  -1.653
    5    HG2  MET 745           HG2      MET 745  47.287 -19.101  -2.359
    6    HG3  MET 745           HG3      MET 745  48.758 -18.172  -2.268
    7    HE1  MET 745           HE1      MET 745  46.696 -21.046  -1.069
    8    HE3  MET 745           HE2      MET 745  46.584 -20.103   0.422
    9    HE2  MET 745           HE3      MET 745  47.476 -21.626   0.389

  No H/Q in entry =           9
  In of MODEL   26
    1    H    HIS 746           H        HIS 746  48.502 -15.448  -2.595
    2    HA   HIS 746           HA       HIS 746  50.949 -16.690  -3.290
    3    HB2  HIS 746           HB2      HIS 746  49.427 -14.414  -4.375
    4    HB3  HIS 746           HB3      HIS 746  51.111 -14.579  -4.886
    5    HD1  HIS 746           HD1      HIS 746  51.654 -16.823  -6.212
    6    HD2  HIS 746           HD2      HIS 746  47.629 -15.977  -5.663
    7    HE1  HIS 746           HE1      HIS 746  50.458 -18.097  -7.982
    8    HE2  HIS 746           HE2      HIS 746  48.072 -17.356  -7.792

  No H/Q in entry =           8
  In of MODEL   26
    1    H    VAL 747           H        VAL 747  50.227 -13.559  -1.918
    2    HA   VAL 747           HA       VAL 747  52.843 -12.592  -1.904
    3    HB   VAL 747           HB       VAL 747  50.404 -11.866  -0.294
    4   HG12  VAL 747          HG11      VAL 747  53.093 -10.484  -0.346
    5   HG11  VAL 747          HG12      VAL 747  52.427 -11.356   1.030
    6   HG13  VAL 747          HG13      VAL 747  51.642  -9.886   0.454
    7   HG23  VAL 747          HG21      VAL 747  51.926 -10.561  -2.496
    8   HG22  VAL 747          HG22      VAL 747  50.483  -9.884  -1.712
    9   HG21  VAL 747          HG23      VAL 747  50.376 -11.385  -2.653

  No H/Q in entry =           9
  In of MODEL   26
    1    H    LEU 748           H        LEU 748  50.960 -14.097   0.715
    2    HA   LEU 748           HA       LEU 748  53.126 -14.022   2.487
    3    HB2  LEU 748           HB2      LEU 748  51.798 -15.596   3.927
    4    HB3  LEU 748           HB3      LEU 748  50.941 -14.156   3.436
    5    HG   LEU 748           HG       LEU 748  49.768 -15.584   1.728
    6   HD12  LEU 748          HD11      LEU 748  50.920 -17.837   3.352
    7   HD11  LEU 748          HD12      LEU 748  51.289 -17.474   1.670
    8   HD13  LEU 748          HD13      LEU 748  49.666 -17.984   2.123
    9   HD21  LEU 748          HD21      LEU 748  49.386 -16.200   4.649
   10   HD23  LEU 748          HD22      LEU 748  48.203 -16.496   3.380
   11   HD22  LEU 748          HD23      LEU 748  48.694 -14.846   3.756

  No H/Q in entry =          11
  In of MODEL   26
    1    H    HIS 749           H        HIS 749  52.217 -16.328   0.100
    2    HA   HIS 749           HA       HIS 749  53.929 -18.437   0.957
    3    HB2  HIS 749           HB2      HIS 749  51.953 -18.378  -0.817
    4    HB3  HIS 749           HB3      HIS 749  53.257 -18.005  -1.933
    5    HD1  HIS 749           HD1      HIS 749  55.118 -19.932  -2.214
    6    HD2  HIS 749           HD2      HIS 749  51.681 -20.962  -0.130
    7    HE1  HIS 749           HE1      HIS 749  55.114 -22.436  -2.126
    8    HE2  HIS 749           HE2      HIS 749  52.898 -23.025  -1.124

  No H/Q in entry =           8
  In of MODEL   26
    1    H    CYS 750           H        CYS 750  54.250 -15.630  -1.105
    2    HA   CYS 750           HA       CYS 750  56.868 -16.239  -2.040
    3    HB2  CYS 750           HB2      CYS 750  55.308 -14.791  -3.303
    4    HB3  CYS 750           HB3      CYS 750  55.349 -13.613  -2.002

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLN 751           H        GLN 751  55.494 -14.558   0.729
    2    HA   GLN 751           HA       GLN 751  57.979 -13.467   1.568
    3    HB2  GLN 751           HB2      GLN 751  55.435 -13.896   3.121
    4    HB3  GLN 751           HB3      GLN 751  56.809 -12.948   3.673
    5    HG2  GLN 751           HG2      GLN 751  56.519 -11.472   1.713
    6    HG3  GLN 751           HG3      GLN 751  55.082 -12.391   1.284
    7   HE21  GLN 751          HE21      GLN 751  55.346  -9.638   1.918
    8   HE22  GLN 751          HE22      GLN 751  54.364  -9.308   3.286

  No H/Q in entry =           8
  In of MODEL   26
    1    H    GLY 752           H        GLY 752  56.777 -16.605   1.640
    2    HA3  GLY 752           HA2      GLY 752  58.552 -18.215   2.266
    3    HA2  GLY 752           HA3      GLY 752  58.745 -17.284   3.736

  No H/Q in entry =           3
  In of MODEL   26
    1    H    ARG 753           H        ARG 753  55.503 -17.348   3.280
    2    HA   ARG 753           HA       ARG 753  55.148 -19.389   5.301
    3    HB2  ARG 753           HB2      ARG 753  53.082 -17.825   3.743
    4    HB3  ARG 753           HB3      ARG 753  52.788 -18.806   5.168
    5    HG2  ARG 753           HG2      ARG 753  54.472 -16.309   5.115
    6    HG3  ARG 753           HG3      ARG 753  52.777 -16.351   5.569
    7    HD2  ARG 753           HD2      ARG 753  53.404 -18.012   7.367
    8    HD3  ARG 753           HD3      ARG 753  55.091 -17.648   6.998
    9    HE   ARG 753           HE       ARG 753  54.095 -15.222   7.372
   10   HH11  ARG 753          HH11      ARG 753  54.014 -18.114   9.433
   11   HH12  ARG 753          HH12      ARG 753  53.648 -17.274  10.864
   12   HH21  ARG 753          HH21      ARG 753  53.593 -14.056   9.380
   13   HH22  ARG 753          HH22      ARG 753  53.417 -14.927  10.832

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ASN 754           H        ASN 754  54.230 -21.438   4.972
    2    HA   ASN 754           HA       ASN 754  53.847 -22.174   2.163
    3    HB2  ASN 754           HB2      ASN 754  54.456 -23.988   4.520
    4    HB3  ASN 754           HB3      ASN 754  54.193 -24.530   2.869
    5   HD21  ASN 754          HD21      ASN 754  56.391 -23.150   5.109
    6   HD22  ASN 754          HD22      ASN 754  57.769 -23.148   4.068

  No H/Q in entry =           6
  In of MODEL   26
    1    H    TYR 755           H        TYR 755  51.931 -22.780   1.473
    2    HA   TYR 755           HA       TYR 755  49.879 -23.649   3.305
    3    HB2  TYR 755           HB2      TYR 755  49.675 -21.158   1.613
    4    HB3  TYR 755           HB3      TYR 755  48.274 -22.119   2.067
    5    HD1  TYR 755           HD1      TYR 755  47.267 -21.863   4.125
    6    HD2  TYR 755           HD2      TYR 755  51.062 -20.116   3.476
    7    HE1  TYR 755           HE1      TYR 755  47.080 -20.664   6.250
    8    HE2  TYR 755           HE2      TYR 755  50.871 -18.908   5.594
    9    HH   TYR 755           HH       TYR 755  48.633 -19.795   7.889

  No H/Q in entry =           9
  In of MODEL   26
    1    H    THR 756           H        THR 756  48.228 -24.714   2.274
    2    HA   THR 756           HA       THR 756  48.773 -25.569  -0.497
    3    HB   THR 756           HB       THR 756  47.511 -27.086   1.810
    4    HG1  THR 756           HG1      THR 756  49.462 -27.523   2.304
    5   HG22  THR 756          HG21      THR 756  47.655 -29.047   0.340
    6   HG21  THR 756          HG22      THR 756  48.255 -28.008  -0.968
    7   HG23  THR 756          HG23      THR 756  46.619 -27.788  -0.333

  No H/Q in entry =           7
  In of MODEL   26
    1    H    LEU 757           H        LEU 757  46.888 -25.677  -1.890
    2    HA   LEU 757           HA       LEU 757  44.524 -24.299  -0.882
    3    HB2  LEU 757           HB2      LEU 757  45.270 -25.245  -3.660
    4    HB3  LEU 757           HB3      LEU 757  43.700 -24.586  -3.280
    5    HG   LEU 757           HG       LEU 757  44.974 -22.905  -4.361
    6   HD11  LEU 757          HD11      LEU 757  43.538 -22.114  -2.619
    7   HD13  LEU 757          HD12      LEU 757  44.977 -21.108  -2.721
    8   HD12  LEU 757          HD13      LEU 757  44.824 -22.292  -1.425
    9   HD22  LEU 757          HD21      LEU 757  47.227 -23.723  -3.987
   10   HD21  LEU 757          HD22      LEU 757  47.115 -23.334  -2.273
   11   HD23  LEU 757          HD23      LEU 757  47.116 -22.040  -3.473

  No H/Q in entry =          11
  In of MODEL   26
    1    H    THR 758           H        THR 758  42.669 -25.315  -0.276
    2    HA   THR 758           HA       THR 758  42.621 -28.188  -0.767
    3    HB   THR 758           HB       THR 758  41.018 -28.162   1.254
    4    HG1  THR 758           HG1      THR 758  42.082 -26.200   2.554
    5   HG22  THR 758          HG21      THR 758  42.940 -28.287   2.801
    6   HG21  THR 758          HG22      THR 758  43.959 -27.520   1.583
    7   HG23  THR 758          HG23      THR 758  43.282 -29.119   1.284

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLY 759           H        GLY 759  39.987 -26.185   0.258
    2    HA3  GLY 759           HA2      GLY 759  38.601 -26.131  -2.221
    3    HA2  GLY 759           HA3      GLY 759  38.052 -27.501  -1.263

  No H/Q in entry =           3
  In of MODEL   26
    1    H    ARG 760           H        ARG 760  36.489 -25.264  -2.049
    2    HA   ARG 760           HA       ARG 760  36.327 -23.346   0.049
    3    HB2  ARG 760           HB2      ARG 760  34.374 -22.432  -1.100
    4    HB3  ARG 760           HB3      ARG 760  35.689 -22.746  -2.215
    5    HG2  ARG 760           HG2      ARG 760  33.837 -23.466  -3.412
    6    HG3  ARG 760           HG3      ARG 760  34.445 -24.954  -2.684
    7    HD2  ARG 760           HD2      ARG 760  32.758 -24.750  -0.892
    8    HD3  ARG 760           HD3      ARG 760  32.130 -23.296  -1.668
    9    HE   ARG 760           HE       ARG 760  32.254 -25.760  -3.186
   10   HH11  ARG 760          HH11      ARG 760  30.177 -23.466  -1.407
   11   HH12  ARG 760          HH12      ARG 760  28.763 -23.890  -2.243
   12   HH21  ARG 760          HH21      ARG 760  30.260 -26.344  -4.317
   13   HH22  ARG 760          HH22      ARG 760  28.799 -25.563  -3.908

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ASP 761           H        ASP 761  35.140 -26.435  -0.194
    2    HA   ASP 761           HA       ASP 761  32.891 -26.058   1.553
    3    HB2  ASP 761           HB2      ASP 761  32.732 -27.859  -0.017
    4    HB3  ASP 761           HB3      ASP 761  34.262 -28.543   0.516

  No H/Q in entry =           4
  In of MODEL   26
    1    H    SER 762           H        SER 762  36.250 -26.605   1.837
    2    HA   SER 762           HA       SER 762  36.289 -28.047   4.257
    3    HB2  SER 762           HB2      SER 762  38.465 -26.499   2.884
    4    HB3  SER 762           HB3      SER 762  38.702 -27.718   4.144
    5    HG   SER 762           HG       SER 762  37.335 -29.032   2.594

  No H/Q in entry =           5
  In of MODEL   26
    1    H    CYS 763           H        CYS 763  36.272 -24.576   3.595
    2    HA   CYS 763           HA       CYS 763  35.836 -24.242   6.422
    3    HB2  CYS 763           HB2      CYS 763  37.379 -22.369   6.675
    4    HB3  CYS 763           HB3      CYS 763  38.257 -23.803   6.134

  No H/Q in entry =           4
  In of MODEL   26
    1    H    THR 764           H        THR 764  35.149 -21.869   6.818
    2    HA   THR 764           HA       THR 764  33.073 -21.366   4.906
    3    HB   THR 764           HB       THR 764  33.780 -19.853   7.433
    4    HG1  THR 764           HG1      THR 764  32.324 -22.210   6.925
    5   HG21  THR 764          HG21      THR 764  32.253 -18.680   5.886
    6   HG23  THR 764          HG22      THR 764  31.423 -19.172   7.364
    7   HG22  THR 764          HG23      THR 764  31.196 -20.093   5.875

  No H/Q in entry =           7
  In of MODEL   26
    1    H    LEU 765           H        LEU 765  33.483 -20.331   3.179
    2    HA   LEU 765           HA       LEU 765  35.605 -18.373   3.129
    3    HB2  LEU 765           HB2      LEU 765  35.316 -20.403   1.575
    4    HB3  LEU 765           HB3      LEU 765  34.022 -19.469   0.858
    5    HG   LEU 765           HG       LEU 765  35.638 -17.696   0.315
    6   HD11  LEU 765          HD11      LEU 765  37.538 -19.738   1.396
    7   HD13  LEU 765          HD12      LEU 765  37.216 -18.170   2.099
    8   HD12  LEU 765          HD13      LEU 765  38.050 -18.284   0.528
    9   HD22  LEU 765          HD21      LEU 765  36.724 -18.929  -1.486
   10   HD21  LEU 765          HD22      LEU 765  35.042 -19.429  -1.308
   11   HD23  LEU 765          HD23      LEU 765  36.337 -20.455  -0.690

  No H/Q in entry =          11
  In of MODEL   26
    1    HA   PRO 766           HA       PRO 766  32.500 -15.125   2.949
    2    HB2  PRO 766           HB2      PRO 766  34.228 -13.490   1.340
    3    HB3  PRO 766           HB3      PRO 766  33.810 -13.273   3.031
    4    HG2  PRO 766           HG2      PRO 766  36.260 -14.159   1.915
    5    HG3  PRO 766           HG3      PRO 766  35.849 -14.026   3.633
    6    HD2  PRO 766           HD2      PRO 766  36.198 -16.365   2.013
    7    HD3  PRO 766           HD3      PRO 766  35.846 -16.287   3.744

  No H/Q in entry =           7
  In of MODEL   26
    1    H    ALA 767           H        ALA 767  34.398 -16.009   0.110
    2    HA   ALA 767           HA       ALA 767  32.163 -15.228  -1.574
    3    HB2  ALA 767           HB1      ALA 767  34.472 -14.587  -2.193
    4    HB3  ALA 767           HB2      ALA 767  33.536 -15.449  -3.440
    5    HB1  ALA 767           HB3      ALA 767  34.780 -16.304  -2.511

  No H/Q in entry =           5
  In of MODEL   26
    1    H    SER 768           H        SER 768  31.076 -16.644  -0.463
    2    HA   SER 768           HA       SER 768  30.621 -18.948  -2.134
    3    HB2  SER 768           HB2      SER 768  30.836 -19.099   0.885
    4    HB3  SER 768           HB3      SER 768  30.289 -20.372  -0.217
    5    HG   SER 768           HG       SER 768  32.624 -19.437  -1.062

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA 769           H        ALA 769  29.582 -16.223  -1.398
    2    HA   ALA 769           HA       ALA 769  26.816 -16.934  -1.167
    3    HB3  ALA 769           HB1      ALA 769  27.386 -16.537   1.176
    4    HB2  ALA 769           HB2      ALA 769  26.383 -15.226   0.521
    5    HB1  ALA 769           HB3      ALA 769  28.114 -14.984   0.740

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLU 770           H        GLU 770  25.617 -14.854  -1.294
    2    HA   GLU 770           HA       GLU 770  26.737 -13.217  -3.430
    3    HB2  GLU 770           HB2      GLU 770  24.390 -12.782  -3.970
    4    HB3  GLU 770           HB3      GLU 770  24.775 -14.493  -4.080
    5    HG2  GLU 770           HG2      GLU 770  23.629 -13.346  -1.595
    6    HG3  GLU 770           HG3      GLU 770  22.526 -13.795  -2.927

  No H/Q in entry =           6
  In of MODEL   26
    1    H    LYS 771           H        LYS 771  26.361 -10.939  -3.260
    2    HA   LYS 771           HA       LYS 771  25.325  -9.999  -0.709
    3    HB2  LYS 771           HB2      LYS 771  27.872  -8.967  -2.028
    4    HB3  LYS 771           HB3      LYS 771  27.144  -8.344  -0.558
    5    HG2  LYS 771           HG2      LYS 771  28.292 -11.115  -0.879
    6    HG3  LYS 771           HG3      LYS 771  29.099  -9.757  -0.086
    7    HD2  LYS 771           HD2      LYS 771  27.546  -9.749   1.690
    8    HD3  LYS 771           HD3      LYS 771  26.400 -10.756   0.807
    9    HE2  LYS 771           HE2      LYS 771  27.462 -12.095   2.486
   10    HE3  LYS 771           HE3      LYS 771  27.991 -12.600   0.886
   11    HZ1  LYS 771           HZ1      LYS 771  30.080 -11.378   1.230
   12    HZ3  LYS 771           HZ2      LYS 771  29.830 -12.503   2.457
   13    HZ2  LYS 771           HZ3      LYS 771  29.552 -10.894   2.763

  No H/Q in entry =          13
  In of MODEL   26
    1    H    ALA 772           H        ALA 772  24.184  -8.073  -0.926
    2    HA   ALA 772           HA       ALA 772  22.991  -7.456  -3.345
    3    HB1  ALA 772           HB1      ALA 772  22.086  -6.705  -1.216
    4    HB2  ALA 772           HB2      ALA 772  22.347  -5.321  -2.275
    5    HB3  ALA 772           HB3      ALA 772  23.480  -5.654  -0.957

  No H/Q in entry =           5
  In of MODEL   26
    1    H    CYS 773           H        CYS 773  23.595  -6.088  -4.998
    2    HA   CYS 773           HA       CYS 773  26.304  -5.040  -4.796
    3    HB2  CYS 773           HB2      CYS 773  26.280  -7.315  -5.720
    4    HB3  CYS 773           HB3      CYS 773  25.155  -6.799  -6.958

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLY 774           H        GLY 774  26.695  -3.893  -7.112
    2    HA3  GLY 774           HA2      GLY 774  25.380  -2.498  -8.753
    3    HA2  GLY 774           HA3      GLY 774  24.549  -1.879  -7.318

  No H/Q in entry =           3
  In of MODEL   26
    1    H    ALA 775           H        ALA 775  26.917  -2.172  -5.726
    2    HA   ALA 775           HA       ALA 775  28.973  -0.477  -6.871
    3    HB3  ALA 775           HB1      ALA 775  29.103   0.741  -4.694
    4    HB1  ALA 775           HB2      ALA 775  27.637  -0.085  -4.166
    5    HB2  ALA 775           HB3      ALA 775  27.573   1.044  -5.521

  No H/Q in entry =           5
  In of MODEL   26
    1    H    CYS 776           H        CYS 776  30.685  -1.841  -6.739
    2    HA   CYS 776           HA       CYS 776  30.926  -3.641  -4.471
    3    HB2  CYS 776           HB2      CYS 776  30.735  -5.616  -5.934
    4    HB3  CYS 776           HB3      CYS 776  29.237  -4.709  -5.800

  No H/Q in entry =           4
  In of MODEL   26
    1    HA   PRO 777           HA       PRO 777  35.236  -3.925  -5.917
    2    HB2  PRO 777           HB2      PRO 777  35.170  -6.850  -5.535
    3    HB3  PRO 777           HB3      PRO 777  36.147  -5.643  -4.692
    4    HG2  PRO 777           HG2      PRO 777  34.150  -6.893  -3.463
    5    HG3  PRO 777           HG3      PRO 777  34.440  -5.167  -3.180
    6    HD2  PRO 777           HD2      PRO 777  32.445  -6.475  -4.975
    7    HD3  PRO 777           HD3      PRO 777  32.209  -5.155  -3.805

  No H/Q in entry =           7
  In of MODEL   26
    1    H    LEU 778           H        LEU 778  36.387  -6.266  -6.957
    2    HA   LEU 778           HA       LEU 778  36.823  -5.830  -9.509
    3    HB2  LEU 778           HB2      LEU 778  36.506  -8.679  -8.677
    4    HB3  LEU 778           HB3      LEU 778  37.608  -8.026  -9.863
    5    HG   LEU 778           HG       LEU 778  38.655  -6.857  -7.715
    6   HD12  LEU 778          HD11      LEU 778  38.539  -8.327  -5.764
    7   HD11  LEU 778          HD12      LEU 778  37.273  -9.261  -6.552
    8   HD13  LEU 778          HD13      LEU 778  36.987  -7.580  -6.120
    9   HD22  LEU 778          HD21      LEU 778  39.821  -8.414  -9.191
   10   HD21  LEU 778          HD22      LEU 778  39.006  -9.761  -8.399
   11   HD23  LEU 778          HD23      LEU 778  40.159  -8.779  -7.494

  No H/Q in entry =          11
  In of MODEL   26
    1    H    TRP 779           H        TRP 779  34.514  -8.485  -8.824
    2    HA   TRP 779           HA       TRP 779  33.385  -8.061 -11.522
    3    HB2  TRP 779           HB2      TRP 779  32.829 -10.454 -11.457
    4    HB3  TRP 779           HB3      TRP 779  34.570 -10.192 -11.291
    5    HD1  TRP 779           HD1      TRP 779  31.490 -11.373  -9.307
    6    HE1  TRP 779           HE1      TRP 779  32.267 -12.546  -7.180
    7    HE3  TRP 779           HE3      TRP 779  36.488 -10.460  -9.650
    8    HZ2  TRP 779           HZ2      TRP 779  34.695 -13.044  -5.821
    9    HZ3  TRP 779           HZ3      TRP 779  37.966 -11.347  -7.893
   10    HH2  TRP 779           HH2      TRP 779  37.084 -12.595  -6.037

  No H/Q in entry =          10
  In of MODEL   26
    1    H    GLY 780           H        GLY 780  32.675  -7.299  -8.536
    2    HA3  GLY 780           HA2      GLY 780  30.573  -6.822  -7.572
    3    HA2  GLY 780           HA3      GLY 780  29.817  -7.793  -8.833

  No H/Q in entry =           3
  In of MODEL   26
    1    H    LYS 781           H        LYS 781  28.559  -9.070  -7.467
    2    HA   LYS 781           HA       LYS 781  29.937 -11.306  -6.360
    3    HB2  LYS 781           HB2      LYS 781  30.056  -9.507  -4.543
    4    HB3  LYS 781           HB3      LYS 781  28.317  -9.732  -4.384
    5    HG2  LYS 781           HG2      LYS 781  29.462 -11.010  -2.684
    6    HG3  LYS 781           HG3      LYS 781  28.672 -12.096  -3.824
    7    HD2  LYS 781           HD2      LYS 781  30.796 -13.042  -3.400
    8    HD3  LYS 781           HD3      LYS 781  30.949 -12.306  -4.985
    9    HE2  LYS 781           HE2      LYS 781  31.960 -11.179  -2.355
   10    HE3  LYS 781           HE3      LYS 781  32.943 -11.935  -3.602
   11    HZ2  LYS 781           HZ1      LYS 781  31.550  -9.322  -3.696
   12    HZ1  LYS 781           HZ2      LYS 781  32.207 -10.011  -5.077
   13    HZ3  LYS 781           HZ3      LYS 781  33.200  -9.614  -3.774

  No H/Q in entry =          13
  In of MODEL   26
    1    H    CYS 782           H        CYS 782  28.687 -12.997  -6.868
    2    HA   CYS 782           HA       CYS 782  25.850 -12.878  -6.370
    3    HB2  CYS 782           HB2      CYS 782  26.068 -12.082  -8.724
    4    HB3  CYS 782           HB3      CYS 782  26.905 -13.576  -9.122

  No H/Q in entry =           4
  In of MODEL   26
    1    H    ASP 783           H        ASP 783  24.871 -14.918  -6.093
    2    HA   ASP 783           HA       ASP 783  26.440 -17.282  -6.573
    3    HB2  ASP 783           HB2      ASP 783  27.073 -16.552  -4.221
    4    HB3  ASP 783           HB3      ASP 783  25.386 -16.781  -3.771

  No H/Q in entry =           4
  In of MODEL   26
    1    H    ALA 784           H        ALA 784  23.571 -16.433  -4.569
    2    HA   ALA 784           HA       ALA 784  21.954 -17.795  -6.563
    3    HB1  ALA 784           HB1      ALA 784  22.233 -19.306  -4.630
    4    HB2  ALA 784           HB2      ALA 784  20.573 -18.728  -4.750
    5    HB3  ALA 784           HB3      ALA 784  21.666 -18.028  -3.556

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLU 785           H        GLU 785  19.524 -17.203  -5.896
    2    HA   GLU 785           HA       GLU 785  19.411 -14.315  -6.214
    3    HB2  GLU 785           HB2      GLU 785  17.153 -16.324  -6.215
    4    HB3  GLU 785           HB3      GLU 785  17.144 -14.708  -6.897
    5    HG2  GLU 785           HG2      GLU 785  18.752 -17.048  -7.909
    6    HG3  GLU 785           HG3      GLU 785  17.280 -16.410  -8.631

  No H/Q in entry =           6
  In of MODEL   26
    1    H    SER 786           H        SER 786  20.043 -15.541  -3.607
    2    HA   SER 786           HA       SER 786  17.997 -15.795  -1.794
    3    HB2  SER 786           HB2      SER 786  20.756 -14.753  -1.215
    4    HB3  SER 786           HB3      SER 786  19.700 -15.670  -0.132
    5    HG   SER 786           HG       SER 786  21.423 -16.558  -2.026

  No H/Q in entry =           5
  In of MODEL   26
    1    H    SER 787           H        SER 787  19.657 -12.819  -2.778
    2    HA   SER 787           HA       SER 787  17.539 -11.335  -1.525
    3    HB2  SER 787           HB2      SER 787  19.134 -11.511   0.311
    4    HB3  SER 787           HB3      SER 787  20.428 -10.921  -0.725
    5    HG   SER 787           HG       SER 787  18.101  -9.444  -0.043

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LYS 788           H        LYS 788  20.722 -10.103  -2.493
    2    HA   LYS 788           HA       LYS 788  19.745  -9.342  -5.095
    3    HB2  LYS 788           HB2      LYS 788  19.232  -7.374  -3.637
    4    HB3  LYS 788           HB3      LYS 788  20.916  -7.330  -3.142
    5    HG2  LYS 788           HG2      LYS 788  20.532  -5.636  -4.832
    6    HG3  LYS 788           HG3      LYS 788  21.559  -6.897  -5.503
    7    HD2  LYS 788           HD2      LYS 788  19.585  -7.906  -6.605
    8    HD3  LYS 788           HD3      LYS 788  18.578  -6.613  -5.961
    9    HE2  LYS 788           HE2      LYS 788  19.938  -4.969  -7.219
   10    HE3  LYS 788           HE3      LYS 788  20.890  -6.297  -7.881
   11    HZ3  LYS 788           HZ1      LYS 788  19.198  -5.617  -9.445
   12    HZ2  LYS 788           HZ2      LYS 788  17.996  -5.794  -8.322
   13    HZ1  LYS 788           HZ3      LYS 788  18.807  -7.160  -8.896

  No H/Q in entry =          13
  In of MODEL   26
    1    H    CYS 789           H        CYS 789  21.348  -9.361  -6.563
    2    HA   CYS 789           HA       CYS 789  24.063  -9.416  -5.715
    3    HB2  CYS 789           HB2      CYS 789  24.433 -11.683  -6.610
    4    HB3  CYS 789           HB3      CYS 789  23.466 -11.613  -5.120

  No H/Q in entry =           4
  In of MODEL   26
    1    H    VAL 790           H        VAL 790  25.476  -9.286  -7.521
    2    HA   VAL 790           HA       VAL 790  24.254  -9.121 -10.136
    3    HB   VAL 790           HB       VAL 790  25.754  -6.773  -8.890
    4   HG13  VAL 790          HG11      VAL 790  26.498  -7.053 -11.161
    5   HG12  VAL 790          HG12      VAL 790  25.484  -5.611 -11.030
    6   HG11  VAL 790          HG13      VAL 790  24.832  -7.092 -11.736
    7   HG21  VAL 790          HG21      VAL 790  23.389  -6.852  -8.301
    8   HG23  VAL 790          HG22      VAL 790  22.977  -6.938 -10.014
    9   HG22  VAL 790          HG23      VAL 790  23.741  -5.481  -9.360

  No H/Q in entry =           9
  In of MODEL   26
    1    H    CYS 791           H        CYS 791  25.686  -9.633 -11.695
    2    HA   CYS 791           HA       CYS 791  28.476  -9.964 -10.893
    3    HB2  CYS 791           HB2      CYS 791  28.580 -11.876 -12.539
    4    HB3  CYS 791           HB3      CYS 791  27.614 -12.184 -11.105

  No H/Q in entry =           4
  In of MODEL   26
    1    H    ARG 792           H        ARG 792  29.752  -8.656 -11.905
    2    HA   ARG 792           HA       ARG 792  28.953  -7.139 -14.205
    3    HB2  ARG 792           HB2      ARG 792  31.519  -7.421 -12.662
    4    HB3  ARG 792           HB3      ARG 792  31.398  -6.422 -14.090
    5    HG2  ARG 792           HG2      ARG 792  29.777  -6.047 -11.578
    6    HG3  ARG 792           HG3      ARG 792  31.271  -5.189 -11.948
    7    HD2  ARG 792           HD2      ARG 792  30.123  -4.416 -14.086
    8    HD3  ARG 792           HD3      ARG 792  28.628  -5.023 -13.377
    9    HE   ARG 792           HE       ARG 792  29.708  -3.440 -11.454
   10   HH11  ARG 792          HH11      ARG 792  28.826  -2.811 -14.879
   11   HH12  ARG 792          HH12      ARG 792  28.448  -1.190 -14.591
   12   HH21  ARG 792          HH21      ARG 792  29.263  -1.216 -11.131
   13   HH22  ARG 792          HH22      ARG 792  28.688  -0.248 -12.409

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLU 793           H        GLU 793  30.163  -7.166 -16.230
    2    HA   GLU 793           HA       GLU 793  31.100  -9.792 -16.940
    3    HB2  GLU 793           HB2      GLU 793  31.053  -7.207 -18.519
    4    HB3  GLU 793           HB3      GLU 793  31.531  -8.769 -19.164
    5    HG2  GLU 793           HG2      GLU 793  28.808  -8.105 -18.083
    6    HG3  GLU 793           HG3      GLU 793  29.244  -8.135 -19.793

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ALA 794           H        ALA 794  33.299  -9.863 -18.090
    2    HA   ALA 794           HA       ALA 794  35.224  -9.375 -16.112
    3    HB3  ALA 794           HB1      ALA 794  36.823 -10.235 -17.717
    4    HB1  ALA 794           HB2      ALA 794  35.636 -10.059 -19.011
    5    HB2  ALA 794           HB3      ALA 794  35.356 -11.215 -17.706

  No H/Q in entry =           5
  In of MODEL   26
    1    H    SER 795           H        SER 795  34.318  -7.630 -18.957
    2    HA   SER 795           HA       SER 795  36.609  -5.994 -18.947
    3    HB2  SER 795           HB2      SER 795  34.002  -5.637 -20.417
    4    HB3  SER 795           HB3      SER 795  35.471  -4.707 -20.719
    5    HG   SER 795           HG       SER 795  35.285  -7.537 -20.883

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLU 796           H        GLU 796  33.861  -5.998 -17.022
    2    HA   GLU 796           HA       GLU 796  33.781  -3.089 -16.593
    3    HB2  GLU 796           HB2      GLU 796  32.053  -5.293 -15.503
    4    HB3  GLU 796           HB3      GLU 796  31.803  -3.574 -15.246
    5    HG2  GLU 796           HG2      GLU 796  31.423  -3.350 -17.684
    6    HG3  GLU 796           HG3      GLU 796  31.556  -5.105 -17.815

  No H/Q in entry =           6
  In of MODEL   26
    1    H    CYS 797           H        CYS 797  35.866  -5.093 -15.725
    2    HA   CYS 797           HA       CYS 797  35.613  -5.636 -13.005
    3    HB2  CYS 797           HB2      CYS 797  38.035  -6.083 -13.082
    4    HB3  CYS 797           HB3      CYS 797  37.132  -6.887 -14.359

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLU 798           H        GLU 798  35.860  -4.480 -11.271
    2    HA   GLU 798           HA       GLU 798  36.728  -1.750 -11.299
    3    HB2  GLU 798           HB2      GLU 798  35.116  -2.648  -9.629
    4    HB3  GLU 798           HB3      GLU 798  36.371  -3.691  -8.990
    5    HG2  GLU 798           HG2      GLU 798  35.994  -1.750  -7.578
    6    HG3  GLU 798           HG3      GLU 798  37.626  -1.761  -8.238

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU 799           H        GLU 799  38.087  -4.834 -10.710
    2    HA   GLU 799           HA       GLU 799  40.789  -3.854 -10.856
    3    HB2  GLU 799           HB2      GLU 799  40.482  -3.900  -8.480
    4    HB3  GLU 799           HB3      GLU 799  39.588  -5.403  -8.551
    5    HG2  GLU 799           HG2      GLU 799  41.803  -5.722  -7.587
    6    HG3  GLU 799           HG3      GLU 799  41.644  -6.598  -9.102

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLU 800           H        GLU 800  41.894  -5.238 -12.136
    2    HA   GLU 800           HA       GLU 800  40.542  -7.471 -13.300
    3    HB2  GLU 800           HB2      GLU 800  42.731  -7.841 -14.490
    4    HB3  GLU 800           HB3      GLU 800  41.996  -6.268 -14.769
    5    HG2  GLU 800           HG2      GLU 800  43.570  -5.284 -13.150
    6    HG3  GLU 800           HG3      GLU 800  44.295  -6.874 -12.914

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLY 801           H        GLY 801  42.859  -6.962 -10.829
    2    HA3  GLY 801           HA2      GLY 801  43.488  -8.269  -9.122
    3    HA2  GLY 801           HA3      GLY 801  42.438  -9.537  -9.744

  No H/Q in entry =           3
  In of MODEL   26
    1    H    PHE 802           H        PHE 802  43.858 -11.084  -9.418
    2    HA   PHE 802           HA       PHE 802  46.472 -11.082 -10.666
    3    HB2  PHE 802           HB2      PHE 802  44.954 -12.998  -8.944
    4    HB3  PHE 802           HB3      PHE 802  46.369 -13.538  -9.828
    5    HD1  PHE 802           HD1      PHE 802  47.507 -14.108  -7.807
    6    HD2  PHE 802           HD2      PHE 802  46.194 -10.133  -8.495
    7    HE1  PHE 802           HE1      PHE 802  48.950 -13.351  -6.036
    8    HE2  PHE 802           HE2      PHE 802  47.651  -9.340  -6.723
    9    HZ   PHE 802           HZ       PHE 802  49.042 -10.939  -5.450

  No H/Q in entry =           9
  In of MODEL   26
    1    H    SER 803           H        SER 803  46.983 -13.303 -11.741
    2    HA   SER 803           HA       SER 803  44.899 -13.955 -13.639
    3    HB2  SER 803           HB2      SER 803  46.933 -14.665 -15.038
    4    HB3  SER 803           HB3      SER 803  46.698 -12.929 -14.825
    5    HG   SER 803           HG       SER 803  48.827 -14.140 -14.429

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ILE 804           H        ILE 804  44.282 -16.068 -13.618
    2    HA   ILE 804           HA       ILE 804  45.901 -17.930 -12.034
    3    HB   ILE 804           HB       ILE 804  43.987 -18.887 -10.891
    4   HG12  ILE 804          HG12      ILE 804  42.248 -18.392 -12.658
    5   HG13  ILE 804          HG13      ILE 804  41.714 -18.093 -11.015
    6   HG23  ILE 804          HG21      ILE 804  43.352 -17.052  -9.384
    7   HG22  ILE 804          HG22      ILE 804  44.034 -15.908 -10.540
    8   HG21  ILE 804          HG23      ILE 804  45.084 -17.081  -9.738
    9   HD13  ILE 804          HD11      ILE 804  40.925 -16.367 -12.515
   10   HD12  ILE 804          HD12      ILE 804  42.576 -16.015 -13.017
   11   HD11  ILE 804          HD13      ILE 804  42.070 -15.693 -11.357

  No H/Q in entry =          11
  In of MODEL   26
    1    H    CYS 805           H        CYS 805  45.426 -20.179 -12.436
    2    HA   CYS 805           HA       CYS 805  44.774 -20.625 -15.225
    3    HB2  CYS 805           HB2      CYS 805  46.856 -21.582 -14.334
    4    HB3  CYS 805           HB3      CYS 805  45.938 -22.456 -13.113

  No H/Q in entry =           4
  In of MODEL   26
    1    H    VAL 806           H        VAL 806  42.650 -21.025 -15.593
    2    HA   VAL 806           HA       VAL 806  41.388 -22.861 -13.717
    3    HB   VAL 806           HB       VAL 806  40.448 -20.569 -13.420
    4   HG13  VAL 806          HG11      VAL 806  40.937 -19.719 -15.555
    5   HG12  VAL 806          HG12      VAL 806  39.224 -19.525 -15.172
    6   HG11  VAL 806          HG13      VAL 806  39.748 -20.792 -16.285
    7   HG21  VAL 806          HG21      VAL 806  38.944 -22.518 -13.118
    8   HG23  VAL 806          HG22      VAL 806  38.471 -22.373 -14.806
    9   HG22  VAL 806          HG23      VAL 806  38.125 -21.061 -13.668

  No H/Q in entry =           9
  In of MODEL   26
    1    H    GLU 807           H        GLU 807  40.261 -24.506 -14.584
    2    HA   GLU 807           HA       GLU 807  40.682 -25.013 -17.385
    3    HB2  GLU 807           HB2      GLU 807  41.228 -26.711 -15.693
    4    HB3  GLU 807           HB3      GLU 807  39.563 -26.711 -15.149
    5    HG2  GLU 807           HG2      GLU 807  38.896 -27.499 -17.396
    6    HG3  GLU 807           HG3      GLU 807  40.600 -27.592 -17.819

  No H/Q in entry =           6
  In of MODEL   26
    1    H    VAL 808           H        VAL 808  39.197 -24.260 -18.740
    2    HA   VAL 808           HA       VAL 808  36.425 -24.486 -18.108
    3    HB   VAL 808           HB       VAL 808  36.024 -22.527 -19.216
    4   HG11  VAL 808          HG11      VAL 808  36.447 -22.247 -16.860
    5   HG13  VAL 808          HG12      VAL 808  36.943 -20.784 -17.715
    6   HG12  VAL 808          HG13      VAL 808  38.158 -21.948 -17.170
    7   HG23  VAL 808          HG21      VAL 808  38.965 -22.124 -19.712
    8   HG22  VAL 808          HG22      VAL 808  37.709 -20.914 -20.070
    9   HG21  VAL 808          HG23      VAL 808  37.676 -22.504 -20.859

  No H/Q in entry =           9
  In of MODEL   26
    1    H    ASN 809           H        ASN 809  35.308 -25.106 -19.996
    2    HA   ASN 809           HA       ASN 809  34.933 -25.850 -22.030
    3    HB2  ASN 809           HB2      ASN 809  37.281 -24.125 -22.643
    4    HB3  ASN 809           HB3      ASN 809  36.628 -25.143 -23.913
    5   HD21  ASN 809          HD21      ASN 809  36.121 -22.363 -21.882
    6   HD22  ASN 809          HD22      ASN 809  34.716 -21.774 -22.671

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLY 810           H        GLY 810  37.041 -27.163 -20.166
    2    HA3  GLY 810           HA2      GLY 810  37.962 -29.290 -20.202
    3    HA2  GLY 810           HA3      GLY 810  37.794 -29.318 -21.953

  No H/Q in entry =           3
  In of MODEL   26
    1    H    LYS 811           H        LYS 811  39.157 -26.409 -21.168
    2    HA   LYS 811           HA       LYS 811  41.904 -27.425 -21.491
    3    HB2  LYS 811           HB2      LYS 811  40.615 -24.943 -22.591
    4    HB3  LYS 811           HB3      LYS 811  42.335 -25.302 -22.627
    5    HG2  LYS 811           HG2      LYS 811  42.042 -27.070 -24.166
    6    HG3  LYS 811           HG3      LYS 811  40.293 -27.103 -23.907
    7    HD2  LYS 811           HD2      LYS 811  40.931 -26.037 -26.049
    8    HD3  LYS 811           HD3      LYS 811  40.051 -24.953 -24.976
    9    HE2  LYS 811           HE2      LYS 811  42.299 -24.039 -24.251
   10    HE3  LYS 811           HE3      LYS 811  43.011 -24.996 -25.548
   11    HZ3  LYS 811           HZ1      LYS 811  42.648 -22.759 -26.236
   12    HZ2  LYS 811           HZ2      LYS 811  41.011 -22.830 -25.862
   13    HZ1  LYS 811           HZ3      LYS 811  41.644 -23.773 -27.123

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLU 812           H        GLU 812  43.519 -25.941 -20.630
    2    HA   GLU 812           HA       GLU 812  42.563 -24.526 -18.227
    3    HB2  GLU 812           HB2      GLU 812  45.435 -25.102 -18.956
    4    HB3  GLU 812           HB3      GLU 812  44.795 -24.652 -17.386
    5    HG2  GLU 812           HG2      GLU 812  45.307 -26.912 -17.135
    6    HG3  GLU 812           HG3      GLU 812  43.577 -26.898 -17.498

  No H/Q in entry =           6
  In of MODEL   26
    1    H    GLN 813           H        GLN 813  42.439 -22.435 -18.300
    2    HA   GLN 813           HA       GLN 813  44.226 -21.053 -20.116
    3    HB2  GLN 813           HB2      GLN 813  42.137 -21.213 -21.305
    4    HB3  GLN 813           HB3      GLN 813  41.242 -20.650 -19.901
    5    HG2  GLN 813           HG2      GLN 813  42.213 -18.516 -20.056
    6    HG3  GLN 813           HG3      GLN 813  43.285 -19.006 -21.370
    7   HE21  GLN 813          HE21      GLN 813  40.021 -18.193 -20.509
    8   HE22  GLN 813          HE22      GLN 813  39.420 -18.047 -22.119

  No H/Q in entry =           8
  In of MODEL   26
    1    H    THR 814           H        THR 814  44.941 -19.110 -19.408
    2    HA   THR 814           HA       THR 814  44.473 -18.526 -16.609
    3    HB   THR 814           HB       THR 814  46.166 -17.063 -18.564
    4    HG1  THR 814           HG1      THR 814  46.428 -19.533 -17.702
    5   HG22  THR 814          HG21      THR 814  46.300 -17.296 -15.558
    6   HG21  THR 814          HG22      THR 814  45.760 -15.894 -16.480
    7   HG23  THR 814          HG23      THR 814  47.449 -16.399 -16.549

  No H/Q in entry =           7
  In of MODEL   26
    1    H    MET 815           H        MET 815  43.100 -17.078 -16.112
    2    HA   MET 815           HA       MET 815  42.510 -14.940 -17.983
    3    HB2  MET 815           HB2      MET 815  40.125 -15.057 -17.139
    4    HB3  MET 815           HB3      MET 815  40.602 -16.323 -18.255
    5    HG2  MET 815           HG2      MET 815  41.029 -17.753 -16.422
    6    HG3  MET 815           HG3      MET 815  40.412 -16.593 -15.268
    7    HE2  MET 815           HE1      MET 815  37.980 -18.942 -18.415
    8    HE1  MET 815           HE2      MET 815  39.642 -19.234 -17.904
    9    HE3  MET 815           HE3      MET 815  39.264 -17.812 -18.875

  No H/Q in entry =           9
  In of MODEL   26
    1    H    SER 816           H        SER 816  41.197 -13.235 -16.657
    2    HA   SER 816           HA       SER 816  42.975 -12.647 -14.499
    3    HB2  SER 816           HB2      SER 816  40.623 -11.106 -15.595
    4    HB3  SER 816           HB3      SER 816  41.849 -10.497 -14.484
    5    HG   SER 816           HG       SER 816  42.379  -9.868 -16.497

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLU 817           H        GLU 817  42.320 -12.177 -12.493
    2    HA   GLU 817           HA       GLU 817  40.737 -13.920 -11.119
    3    HB2  GLU 817           HB2      GLU 817  42.568 -12.449 -10.289
    4    HB3  GLU 817           HB3      GLU 817  41.455 -11.119 -10.533
    5    HG2  GLU 817           HG2      GLU 817  40.271 -11.518  -8.750
    6    HG3  GLU 817           HG3      GLU 817  40.602 -13.277  -8.770

  No H/Q in entry =           6
  In of MODEL   26
    1    H    CYS 818           H        CYS 818  40.008 -10.691 -12.305
    2    HA   CYS 818           HA       CYS 818  37.449 -10.481 -11.259
    3    HB2  CYS 818           HB2      CYS 818  37.078  -8.758 -13.007
    4    HB3  CYS 818           HB3      CYS 818  38.567  -8.544 -12.096

  No H/Q in entry =           4
  In of MODEL   26
    1    H    GLU 819           H        GLU 819  38.573 -11.811 -14.335
    2    HA   GLU 819           HA       GLU 819  36.005 -12.210 -15.440
    3    HB2  GLU 819           HB2      GLU 819  38.010 -11.989 -16.832
    4    HB3  GLU 819           HB3      GLU 819  38.656 -13.470 -16.153
    5    HG2  GLU 819           HG2      GLU 819  37.077 -14.784 -17.244
    6    HG3  GLU 819           HG3      GLU 819  36.061 -13.396 -17.665

  No H/Q in entry =           6
  In of MODEL   26
    1    H    ALA 820           H        ALA 820  38.373 -14.439 -14.034
    2    HA   ALA 820           HA       ALA 820  36.860 -16.734 -14.191
    3    HB3  ALA 820           HB1      ALA 820  38.858 -15.998 -12.061
    4    HB1  ALA 820           HB2      ALA 820  39.197 -16.786 -13.609
    5    HB2  ALA 820           HB3      ALA 820  38.270 -17.630 -12.376

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLY 821           H        GLY 821  37.021 -14.258 -11.655
    2    HA3  GLY 821           HA2      GLY 821  35.345 -15.459  -9.747
    3    HA2  GLY 821           HA3      GLY 821  35.704 -13.737  -9.877

  No H/Q in entry =           3
  In of MODEL   26
    1    H    ALA 822           H        ALA 822  34.636 -13.168 -12.344
    2    HA   ALA 822           HA       ALA 822  31.904 -12.885 -11.738
    3    HB2  ALA 822           HB1      ALA 822  33.175 -11.332 -13.214
    4    HB3  ALA 822           HB2      ALA 822  31.655 -11.902 -13.888
    5    HB1  ALA 822           HB3      ALA 822  33.178 -12.593 -14.455

  No H/Q in entry =           5
  In of MODEL   26
    1    H    LEU 823           H        LEU 823  33.705 -15.073 -13.798
    2    HA   LEU 823           HA       LEU 823  31.578 -16.310 -15.051
    3    HB2  LEU 823           HB2      LEU 823  34.247 -17.467 -14.290
    4    HB3  LEU 823           HB3      LEU 823  33.111 -18.272 -15.349
    5    HG   LEU 823           HG       LEU 823  34.563 -15.683 -15.874
    6   HD11  LEU 823          HD11      LEU 823  35.915 -17.666 -16.167
    7   HD13  LEU 823          HD12      LEU 823  35.574 -16.886 -17.709
    8   HD12  LEU 823          HD13      LEU 823  34.698 -18.351 -17.248
    9   HD23  LEU 823          HD21      LEU 823  33.483 -15.756 -18.110
   10   HD22  LEU 823          HD22      LEU 823  32.374 -15.431 -16.790
   11   HD21  LEU 823          HD23      LEU 823  32.417 -17.039 -17.515

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ARG 824           H        ARG 824  33.098 -17.140 -11.979
    2    HA   ARG 824           HA       ARG 824  31.571 -19.431 -11.293
    3    HB2  ARG 824           HB2      ARG 824  32.178 -17.288  -9.277
    4    HB3  ARG 824           HB3      ARG 824  32.091 -19.014  -9.023
    5    HG2  ARG 824           HG2      ARG 824  34.255 -19.306 -10.080
    6    HG3  ARG 824           HG3      ARG 824  34.292 -17.587 -10.508
    7    HD2  ARG 824           HD2      ARG 824  34.341 -18.820  -7.768
    8    HD3  ARG 824           HD3      ARG 824  35.589 -17.830  -8.529
    9    HE   ARG 824           HE       ARG 824  33.650 -16.105  -8.584
   10   HH11  ARG 824          HH11      ARG 824  34.692 -18.100  -5.848
   11   HH12  ARG 824          HH12      ARG 824  33.832 -17.245  -4.672
   12   HH21  ARG 824          HH21      ARG 824  32.442 -14.904  -6.972
   13   HH22  ARG 824          HH22      ARG 824  32.469 -15.384  -5.333

  No H/Q in entry =          13
  In of MODEL   26
    1    H    CYS 825           H        CYS 825  31.079 -16.041 -10.685
    2    HA   CYS 825           HA       CYS 825  28.719 -16.144  -9.212
    3    HB2  CYS 825           HB2      CYS 825  30.185 -14.044 -10.685
    4    HB3  CYS 825           HB3      CYS 825  28.682 -13.650  -9.892

  No H/Q in entry =           4
  In of MODEL   26
    1    H    ARG 826           H        ARG 826  29.184 -16.103 -12.675
    2    HA   ARG 826           HA       ARG 826  26.406 -15.338 -13.069
    3    HB2  ARG 826           HB2      ARG 826  26.923 -15.392 -15.467
    4    HB3  ARG 826           HB3      ARG 826  27.961 -14.279 -14.565
    5    HG2  ARG 826           HG2      ARG 826  29.727 -15.925 -14.636
    6    HG3  ARG 826           HG3      ARG 826  28.681 -17.042 -15.509
    7    HD2  ARG 826           HD2      ARG 826  29.506 -14.315 -16.467
    8    HD3  ARG 826           HD3      ARG 826  30.216 -15.837 -17.006
    9    HE   ARG 826           HE       ARG 826  27.715 -16.308 -17.568
   10   HH11  ARG 826          HH11      ARG 826  29.423 -13.241 -18.037
   11   HH12  ARG 826          HH12      ARG 826  28.610 -12.816 -19.457
   12   HH21  ARG 826          HH21      ARG 826  26.607 -15.787 -19.528
   13   HH22  ARG 826          HH22      ARG 826  26.932 -14.328 -20.337

  No H/Q in entry =          13
  In of MODEL   26
    1    H    GLY 827           H        GLY 827  28.056 -18.180 -12.585
    2    HA3  GLY 827           HA2      GLY 827  26.768 -20.238 -12.530
    3    HA2  GLY 827           HA3      GLY 827  25.852 -19.596 -13.897

  No H/Q in entry =           3
  In of MODEL   26
    1    H    GLN 828           H        GLN 828  28.926 -18.872 -14.577
    2    HA   GLN 828           HA       GLN 828  29.137 -20.819 -16.635
    3    HB2  GLN 828           HB2      GLN 828  30.119 -18.575 -16.844
    4    HB3  GLN 828           HB3      GLN 828  31.212 -18.927 -15.519
    5    HG2  GLN 828           HG2      GLN 828  32.376 -19.112 -17.643
    6    HG3  GLN 828           HG3      GLN 828  32.256 -20.682 -16.856
    7   HE21  GLN 828          HE21      GLN 828  31.085 -18.730 -19.495
    8   HE22  GLN 828          HE22      GLN 828  30.387 -20.037 -20.367

  No H/Q in entry =           8
  In of MODEL   26
    1    H    SER 829           H        SER 829  30.166 -22.747 -16.631
    2    HA   SER 829           HA       SER 829  30.967 -23.818 -14.101
    3    HB2  SER 829           HB2      SER 829  31.040 -25.141 -16.819
    4    HB3  SER 829           HB3      SER 829  31.023 -25.931 -15.246
    5    HG   SER 829           HG       SER 829  28.949 -24.905 -14.906

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ILE 830           H        ILE 830  32.934 -23.436 -13.384
    2    HA   ILE 830           HA       ILE 830  35.219 -23.619 -15.195
    3    HB   ILE 830           HB       ILE 830  36.344 -21.713 -14.269
    4   HG12  ILE 830          HG12      ILE 830  35.467 -21.814 -11.922
    5   HG13  ILE 830          HG13      ILE 830  35.460 -20.186 -12.561
    6   HG22  ILE 830          HG21      ILE 830  33.571 -20.872 -15.015
    7   HG21  ILE 830          HG22      ILE 830  34.891 -21.218 -16.121
    8   HG23  ILE 830          HG23      ILE 830  34.996 -19.833 -15.029
    9   HD12  ILE 830          HD11      ILE 830  33.088 -22.013 -12.280
   10   HD11  ILE 830          HD12      ILE 830  33.047 -20.396 -12.969
   11   HD13  ILE 830          HD13      ILE 830  33.462 -20.617 -11.272

  No H/Q in entry =          11
  In of MODEL   26
    1    H    SER 831           H        SER 831  37.017 -24.549 -14.347
    2    HA   SER 831           HA       SER 831  36.821 -25.427 -11.575
    3    HB2  SER 831           HB2      SER 831  37.977 -26.773 -13.988
    4    HB3  SER 831           HB3      SER 831  38.074 -27.378 -12.333
    5    HG   SER 831           HG       SER 831  35.742 -27.323 -12.345

  No H/Q in entry =           5
  In of MODEL   26
    1    H    VAL 832           H        VAL 832  38.135 -23.870 -10.616
    2    HA   VAL 832           HA       VAL 832  40.551 -22.932 -11.784
    3    HB   VAL 832           HB       VAL 832  39.725 -22.873  -8.858
    4   HG13  VAL 832          HG11      VAL 832  41.262 -20.965  -8.671
    5   HG12  VAL 832          HG12      VAL 832  41.739 -21.191 -10.353
    6   HG11  VAL 832          HG13      VAL 832  42.102 -22.437  -9.162
    7   HG23  VAL 832          HG21      VAL 832  39.282 -20.802 -11.014
    8   HG22  VAL 832          HG22      VAL 832  38.913 -20.591  -9.302
    9   HG21  VAL 832          HG23      VAL 832  38.037 -21.791 -10.253

  No H/Q in entry =           9
  In of MODEL   26
    1    H    THR 833           H        THR 833  42.271 -24.204 -12.113
    2    HA   THR 833           HA       THR 833  42.542 -26.624 -10.632
    3    HB   THR 833           HB       THR 833  44.579 -26.889 -12.110
    4    HG1  THR 833           HG1      THR 833  44.853 -25.360 -13.726
    5   HG21  THR 833          HG21      THR 833  41.938 -26.280 -13.450
    6   HG23  THR 833          HG22      THR 833  42.406 -27.829 -12.751
    7   HG22  THR 833          HG23      THR 833  43.249 -27.210 -14.171

  No H/Q in entry =           7
  In of MODEL   26
    1    H    SER 834           H        SER 834  44.147 -23.517 -10.872
    2    HA   SER 834           HA       SER 834  45.063 -23.766  -8.197
    3    HB2  SER 834           HB2      SER 834  46.899 -24.934  -9.476
    4    HB3  SER 834           HB3      SER 834  47.138 -23.431 -10.384
    5    HG   SER 834           HG       SER 834  47.672 -24.035  -7.705

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ILE 835           H        ILE 835  45.794 -21.794  -7.438
    2    HA   ILE 835           HA       ILE 835  44.560 -19.480  -8.584
    3    HB   ILE 835           HB       ILE 835  45.557 -18.318  -6.653
    4   HG12  ILE 835          HG12      ILE 835  46.922 -20.992  -6.187
    5   HG13  ILE 835          HG13      ILE 835  47.674 -19.442  -6.550
    6   HG22  ILE 835          HG21      ILE 835  44.274 -20.970  -5.976
    7   HG21  ILE 835          HG22      ILE 835  43.423 -19.481  -6.393
    8   HG23  ILE 835          HG23      ILE 835  44.364 -19.571  -4.904
    9   HD12  ILE 835          HD11      ILE 835  47.909 -20.070  -4.284
   10   HD11  ILE 835          HD12      ILE 835  46.147 -20.105  -4.111
   11   HD13  ILE 835          HD13      ILE 835  46.980 -18.576  -4.463

  No H/Q in entry =          11
  In of MODEL   26
    1    H    ARG 836           H        ARG 836  47.308 -21.094  -9.248
    2    HA   ARG 836           HA       ARG 836  49.090 -18.871  -9.728
    3    HB2  ARG 836           HB2      ARG 836  49.384 -21.841 -10.173
    4    HB3  ARG 836           HB3      ARG 836  50.643 -20.653 -10.494
    5    HG2  ARG 836           HG2      ARG 836  50.633 -20.013  -8.132
    6    HG3  ARG 836           HG3      ARG 836  49.374 -21.202  -7.828
    7    HD2  ARG 836           HD2      ARG 836  52.095 -21.835  -8.924
    8    HD3  ARG 836           HD3      ARG 836  51.622 -21.878  -7.221
    9    HE   ARG 836           HE       ARG 836  49.807 -23.425  -8.629
   10   HH11  ARG 836          HH11      ARG 836  53.274 -23.539  -7.823
   11   HH12  ARG 836          HH12      ARG 836  53.376 -25.231  -7.900
   12   HH21  ARG 836          HH21      ARG 836  49.981 -25.820  -8.676
   13   HH22  ARG 836          HH22      ARG 836  51.477 -26.535  -8.376

  No H/Q in entry =          13
  In of MODEL   26
    1    HA   PRO 837           HA       PRO 837  47.565 -18.632 -13.938
    2    HB2  PRO 837           HB2      PRO 837  49.604 -17.225 -15.052
    3    HB3  PRO 837           HB3      PRO 837  48.402 -16.476 -13.995
    4    HG2  PRO 837           HG2      PRO 837  51.172 -17.409 -13.341
    5    HG3  PRO 837           HG3      PRO 837  50.354 -15.911 -12.862
    6    HD2  PRO 837           HD2      PRO 837  50.566 -18.033 -11.204
    7    HD3  PRO 837           HD3      PRO 837  49.160 -16.948 -11.180

  No H/Q in entry =           7
  In of MODEL   26
    1    H    CYS 838           H        CYS 838  47.979 -19.618 -15.969
    2    HA   CYS 838           HA       CYS 838  50.235 -21.434 -15.892
    3    HB2  CYS 838           HB2      CYS 838  48.996 -22.678 -17.762
    4    HB3  CYS 838           HB3      CYS 838  48.231 -22.762 -16.194

  No H/Q in entry =           4
  In of MODEL   26
    1    H    ALA 839           H        ALA 839  50.708 -21.962 -18.574
    2    HA   ALA 839           HA       ALA 839  51.857 -19.453 -19.426
    3    HB2  ALA 839           HB1      ALA 839  51.934 -22.191 -20.708
    4    HB1  ALA 839           HB2      ALA 839  53.133 -21.548 -19.589
    5    HB3  ALA 839           HB3      ALA 839  52.923 -20.808 -21.177

  No H/Q in entry =           5
  In of MODEL   26
    1    H    ALA 840           H        ALA 840  48.924 -20.280 -19.487
    2    HA   ALA 840           HA       ALA 840  48.214 -20.065 -22.264
    3    HB3  ALA 840           HB1      ALA 840  46.990 -21.582 -20.848
    4    HB1  ALA 840           HB2      ALA 840  45.890 -20.308 -21.405
    5    HB2  ALA 840           HB3      ALA 840  46.572 -20.284 -19.764

  No H/Q in entry =           5
  In of MODEL   26
    1    H    GLU 841           H        GLU 841  48.924 -17.872 -19.789
    2    HA   GLU 841           HA       GLU 841  47.264 -15.852 -20.963
    3    HB2  GLU 841           HB2      GLU 841  48.474 -14.240 -19.436
    4    HB3  GLU 841           HB3      GLU 841  47.586 -15.540 -18.648
    5    HG2  GLU 841           HG2      GLU 841  49.523 -16.602 -17.929
    6    HG3  GLU 841           HG3      GLU 841  50.528 -15.787 -19.127

  No H/Q in entry =           6
  In of MODEL   26
    1    H    THR 842           H        THR 842  47.962 -16.254 -23.042
    2    HA   THR 842           HA       THR 842  50.345 -14.747 -23.792
    3    HB   THR 842           HB       THR 842  49.584 -17.479 -24.878
    4    HG1  THR 842           HG1      THR 842  50.627 -18.056 -23.113
    5   HG22  THR 842          HG21      THR 842  51.989 -15.731 -25.428
    6   HG21  THR 842          HG22      THR 842  50.661 -16.023 -26.549
    7   HG23  THR 842          HG23      THR 842  51.728 -17.348 -26.080

  No H/Q in entry =           7
  In of MODEL   26
    1    H    GLN 843           H        GLN 843  49.811 -13.318 -25.337
    2    HA   GLN 843           HA       GLN 843  47.429 -13.872 -26.891
    3    HB2  GLN 843           HB2      GLN 843  47.329 -11.396 -27.355
    4    HB3  GLN 843           HB3      GLN 843  47.027 -11.848 -25.691
    5    HG2  GLN 843           HG2      GLN 843  49.212 -11.106 -25.041
    6    HG3  GLN 843           HG3      GLN 843  49.658 -10.820 -26.722
    7   HE21  GLN 843          HE21      GLN 843  48.832  -9.055 -27.778
    8   HE22  GLN 843          HE22      GLN 843  48.066  -7.742 -26.970

  No H/Q in entry =           8
  In of MODEL   27
    1    H1   GLY 689           H2       GLY 689  58.916  11.316 -24.750
    2    H2   GLY 689           H1       GLY 689  58.881  10.300 -23.408
    3    H3   GLY 689           H3       GLY 689  59.408   9.699 -24.907
    4    HA2  GLY 689           HA2      GLY 689  57.159   9.000 -24.374
    5    HA3  GLY 689           HA3      GLY 689  57.224   9.989 -25.829

  No H/Q in entry =           5
  In of MODEL   27
    1    H    SER 690           H        SER 690  55.065   9.519 -23.917
    2    HA   SER 690           HA       SER 690  53.394  10.554 -22.983
    3    HB2  SER 690           HB2      SER 690  55.111  11.079 -21.211
    4    HB3  SER 690           HB3      SER 690  55.381  12.629 -22.000
    5    HG   SER 690           HG       SER 690  53.432  11.851 -20.305

  No H/Q in entry =           5
  In of MODEL   27
    1    H    HIS 691           H        HIS 691  52.852  10.857 -25.215
    2    HA   HIS 691           HA       HIS 691  51.967  13.594 -25.545
    3    HB2  HIS 691           HB2      HIS 691  54.113  13.390 -26.899
    4    HB3  HIS 691           HB3      HIS 691  53.271  12.214 -27.899
    5    HD1  HIS 691           HD1      HIS 691  52.348  13.239 -29.968
    6    HD2  HIS 691           HD2      HIS 691  52.422  15.920 -26.805
    7    HE1  HIS 691           HE1      HIS 691  51.449  15.389 -30.890
    8    HE2  HIS 691           HE2      HIS 691  51.821  17.048 -29.025

  No H/Q in entry =           8
  In of MODEL   27
    1    H    MET 692           H        MET 692  51.994  10.365 -27.099
    2    HA   MET 692           HA       MET 692  49.320  10.715 -28.052
    3    HB2  MET 692           HB2      MET 692  49.374   8.403 -28.764
    4    HB3  MET 692           HB3      MET 692  50.931   9.111 -29.133
    5    HG2  MET 692           HG2      MET 692  51.843   8.038 -27.085
    6    HG3  MET 692           HG3      MET 692  50.285   7.260 -26.849
    7    HE2  MET 692           HE1      MET 692  50.083   4.974 -30.074
    8    HE1  MET 692           HE2      MET 692  49.450   6.608 -29.898
    9    HE3  MET 692           HE3      MET 692  49.259   5.442 -28.589

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ASN 693           H        ASN 693  50.767   9.683 -25.154
    2    HA   ASN 693           HA       ASN 693  48.221   9.833 -23.852
    3    HB2  ASN 693           HB2      ASN 693  48.480   7.392 -24.274
    4    HB3  ASN 693           HB3      ASN 693  50.061   7.437 -23.497
    5   HD21  ASN 693          HD21      ASN 693  49.439   5.953 -21.925
    6   HD22  ASN 693          HD22      ASN 693  48.359   6.355 -20.652

  No H/Q in entry =           6
  In of MODEL   27
    1    HA   PRO 694           HA       PRO 694  51.304  12.116 -21.466
    2    HB2  PRO 694           HB2      PRO 694  49.088  12.702 -19.643
    3    HB3  PRO 694           HB3      PRO 694  50.045  13.821 -20.618
    4    HG2  PRO 694           HG2      PRO 694  47.487  13.294 -21.180
    5    HG3  PRO 694           HG3      PRO 694  48.680  13.572 -22.465
    6    HD2  PRO 694           HD2      PRO 694  47.564  10.990 -21.432
    7    HD3  PRO 694           HD3      PRO 694  47.836  11.532 -23.108

  No H/Q in entry =           7
  In of MODEL   27
    1    H    LEU 695           H        LEU 695  49.179   9.680 -20.208
    2    HA   LEU 695           HA       LEU 695  50.347   9.627 -17.588
    3    HB2  LEU 695           HB2      LEU 695  48.435   7.727 -18.956
    4    HB3  LEU 695           HB3      LEU 695  49.026   7.484 -17.330
    5    HG   LEU 695           HG       LEU 695  47.939   9.675 -16.709
    6   HD13  LEU 695          HD11      LEU 695  47.730  10.679 -18.901
    7   HD12  LEU 695          HD12      LEU 695  46.148  10.528 -18.134
    8   HD11  LEU 695          HD13      LEU 695  46.623   9.402 -19.406
    9   HD21  LEU 695          HD21      LEU 695  46.166   7.464 -17.725
   10   HD23  LEU 695          HD22      LEU 695  45.692   8.713 -16.569
   11   HD22  LEU 695          HD23      LEU 695  46.943   7.546 -16.144

  No H/Q in entry =          11
  In of MODEL   27
    1    H    THR 696           H        THR 696  52.282   8.889 -17.267
    2    HA   THR 696           HA       THR 696  53.132   6.568 -18.804
    3    HB   THR 696           HB       THR 696  55.477   7.573 -18.691
    4    HG1  THR 696           HG1      THR 696  54.260   9.405 -17.294
    5   HG22  THR 696          HG21      THR 696  53.401   8.992 -20.378
    6   HG21  THR 696          HG22      THR 696  54.179   7.461 -20.778
    7   HG23  THR 696          HG23      THR 696  55.136   8.939 -20.702

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLN 697           H        GLN 697  52.407   5.405 -16.878
    2    HA   GLN 697           HA       GLN 697  54.495   5.534 -14.815
    3    HB2  GLN 697           HB2      GLN 697  51.908   5.627 -14.226
    4    HB3  GLN 697           HB3      GLN 697  51.966   3.896 -14.506
    5    HG2  GLN 697           HG2      GLN 697  53.741   5.308 -12.501
    6    HG3  GLN 697           HG3      GLN 697  52.173   4.644 -12.098
    7   HE21  GLN 697          HE21      GLN 697  52.410   2.235 -13.623
    8   HE22  GLN 697          HE22      GLN 697  53.607   1.269 -12.858

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ALA 698           H        ALA 698  53.024   3.771 -17.297
    2    HA   ALA 698           HA       ALA 698  53.523   1.956 -18.496
    3    HB1  ALA 698           HB1      ALA 698  55.821   2.836 -18.548
    4    HB3  ALA 698           HB2      ALA 698  55.830   1.071 -18.458
    5    HB2  ALA 698           HB3      ALA 698  56.164   2.027 -17.020

  No H/Q in entry =           5
  In of MODEL   27
    1    H    VAL 699           H        VAL 699  54.535  -0.465 -18.032
    2    HA   VAL 699           HA       VAL 699  52.934  -1.334 -15.789
    3    HB   VAL 699           HB       VAL 699  52.647  -2.520 -17.948
    4   HG12  VAL 699          HG11      VAL 699  55.484  -3.460 -17.619
    5   HG11  VAL 699          HG12      VAL 699  54.885  -2.349 -18.849
    6   HG13  VAL 699          HG13      VAL 699  54.340  -4.027 -18.838
    7   HG23  VAL 699          HG21      VAL 699  52.803  -4.836 -17.118
    8   HG22  VAL 699          HG22      VAL 699  52.125  -3.732 -15.918
    9   HG21  VAL 699          HG23      VAL 699  53.797  -4.268 -15.774

  No H/Q in entry =           9
  In of MODEL   27
    1    HA   PRO 700           HA       PRO 700  56.598  -1.660 -13.195
    2    HB2  PRO 700           HB2      PRO 700  54.877  -3.506 -11.641
    3    HB3  PRO 700           HB3      PRO 700  55.726  -2.056 -11.099
    4    HG2  PRO 700           HG2      PRO 700  53.068  -2.072 -11.399
    5    HG3  PRO 700           HG3      PRO 700  54.038  -0.643 -11.786
    6    HD2  PRO 700           HD2      PRO 700  52.796  -2.640 -13.626
    7    HD3  PRO 700           HD3      PRO 700  53.006  -0.877 -13.799

  No H/Q in entry =           7
  In of MODEL   27
    1    H    LYS 701           H        LYS 701  58.175  -3.142 -13.013
    2    HA   LYS 701           HA       LYS 701  57.882  -5.493 -14.694
    3    HB2  LYS 701           HB2      LYS 701  60.323  -4.126 -13.526
    4    HB3  LYS 701           HB3      LYS 701  60.401  -5.594 -14.487
    5    HG2  LYS 701           HG2      LYS 701  60.912  -3.784 -15.963
    6    HG3  LYS 701           HG3      LYS 701  59.266  -4.345 -16.314
    7    HD2  LYS 701           HD2      LYS 701  58.366  -2.479 -14.984
    8    HD3  LYS 701           HD3      LYS 701  60.011  -1.908 -14.712
    9    HE2  LYS 701           HE2      LYS 701  60.297  -1.446 -17.056
   10    HE3  LYS 701           HE3      LYS 701  58.766  -2.244 -17.423
   11    HZ2  LYS 701           HZ1      LYS 701  59.034   0.252 -15.822
   12    HZ1  LYS 701           HZ2      LYS 701  57.606  -0.547 -16.199
   13    HZ3  LYS 701           HZ3      LYS 701  58.512   0.158 -17.429

  No H/Q in entry =          13
  In of MODEL   27
    1    H    CYS 702           H        CYS 702  56.726  -5.376 -12.202
    2    HA   CYS 702           HA       CYS 702  58.098  -7.479 -10.640
    3    HB2  CYS 702           HB2      CYS 702  55.999  -5.587  -9.582
    4    HB3  CYS 702           HB3      CYS 702  57.157  -6.554  -8.687

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLN 703           H        GLN 703  56.627  -9.047  -9.769
    2    HA   GLN 703           HA       GLN 703  54.330  -9.547 -11.454
    3    HB2  GLN 703           HB2      GLN 703  55.502 -10.972  -9.088
    4    HB3  GLN 703           HB3      GLN 703  54.033 -11.495  -9.897
    5    HG2  GLN 703           HG2      GLN 703  56.764 -11.265 -11.135
    6    HG3  GLN 703           HG3      GLN 703  55.941 -12.761 -10.684
    7   HE21  GLN 703          HE21      GLN 703  56.193 -10.239 -13.025
    8   HE22  GLN 703          HE22      GLN 703  55.098 -10.923 -14.174

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ARG 704           H        ARG 704  52.335 -10.351 -10.132
    2    HA   ARG 704           HA       ARG 704  51.337  -7.829  -9.206
    3    HB2  ARG 704           HB2      ARG 704  49.930 -10.480  -9.412
    4    HB3  ARG 704           HB3      ARG 704  49.152  -8.926  -9.142
    5    HG2  ARG 704           HG2      ARG 704  49.920  -8.129 -11.294
    6    HG3  ARG 704           HG3      ARG 704  50.781  -9.649 -11.550
    7    HD2  ARG 704           HD2      ARG 704  48.713 -10.849 -11.456
    8    HD3  ARG 704           HD3      ARG 704  47.809  -9.343 -11.229
    9    HE   ARG 704           HE       ARG 704  49.049 -10.362 -13.639
   10   HH11  ARG 704          HH11      ARG 704  47.365  -7.603 -12.094
   11   HH12  ARG 704          HH12      ARG 704  47.007  -6.845 -13.580
   12   HH21  ARG 704          HH21      ARG 704  48.431  -9.296 -15.657
   13   HH22  ARG 704          HH22      ARG 704  47.586  -7.815 -15.618

  No H/Q in entry =          13
  In of MODEL   27
    1    H    TRP 705           H        TRP 705  52.643 -10.516  -7.640
    2    HA   TRP 705           HA       TRP 705  51.456  -9.756  -5.090
    3    HB2  TRP 705           HB2      TRP 705  52.732 -11.756  -4.211
    4    HB3  TRP 705           HB3      TRP 705  51.514 -12.111  -5.429
    5    HD1  TRP 705           HD1      TRP 705  55.294 -12.163  -4.874
    6    HE1  TRP 705           HE1      TRP 705  56.380 -13.534  -6.762
    7    HE3  TRP 705           HE3      TRP 705  51.215 -12.814  -7.875
    8    HZ2  TRP 705           HZ2      TRP 705  55.606 -14.733  -9.192
    9    HZ3  TRP 705           HZ3      TRP 705  51.475 -14.058  -9.952
   10    HH2  TRP 705           HH2      TRP 705  53.623 -15.018 -10.598

  No H/Q in entry =          10
  In of MODEL   27
    1    H    GLU 706           H        GLU 706  53.696  -8.582  -6.936
    2    HA   GLU 706           HA       GLU 706  55.538  -7.910  -4.776
    3    HB2  GLU 706           HB2      GLU 706  56.001  -8.091  -7.753
    4    HB3  GLU 706           HB3      GLU 706  57.163  -7.418  -6.602
    5    HG2  GLU 706           HG2      GLU 706  57.287  -9.642  -5.568
    6    HG3  GLU 706           HG3      GLU 706  56.177 -10.251  -6.802

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LYS 707           H        LYS 707  56.431  -5.731  -5.071
    2    HA   LYS 707           HA       LYS 707  54.733  -3.955  -6.594
    3    HB2  LYS 707           HB2      LYS 707  54.613  -2.297  -4.770
    4    HB3  LYS 707           HB3      LYS 707  53.820  -3.797  -4.341
    5    HG2  LYS 707           HG2      LYS 707  55.583  -4.400  -2.859
    6    HG3  LYS 707           HG3      LYS 707  56.605  -3.089  -3.454
    7    HD2  LYS 707           HD2      LYS 707  54.968  -1.453  -2.602
    8    HD3  LYS 707           HD3      LYS 707  53.995  -2.772  -1.963
    9    HE2  LYS 707           HE2      LYS 707  56.861  -2.309  -1.167
   10    HE3  LYS 707           HE3      LYS 707  55.513  -1.574  -0.313
   11    HZ1  LYS 707           HZ1      LYS 707  55.962  -4.523  -0.609
   12    HZ3  LYS 707           HZ2      LYS 707  54.703  -3.740   0.237
   13    HZ2  LYS 707           HZ3      LYS 707  56.276  -3.576   0.754

  No H/Q in entry =          13
  In of MODEL   27
    1    H    LEU 708           H        LEU 708  55.726  -2.017  -7.191
    2    HA   LEU 708           HA       LEU 708  58.605  -2.319  -7.459
    3    HB2  LEU 708           HB2      LEU 708  57.276  -2.024  -9.456
    4    HB3  LEU 708           HB3      LEU 708  56.608  -0.526  -8.841
    5    HG   LEU 708           HG       LEU 708  58.912   0.464  -8.974
    6   HD11  LEU 708          HD11      LEU 708  59.568  -2.108 -10.392
    7   HD13  LEU 708          HD12      LEU 708  60.218  -1.579  -8.842
    8   HD12  LEU 708          HD13      LEU 708  60.599  -0.681 -10.309
    9   HD22  LEU 708          HD21      LEU 708  57.273   0.843 -10.746
   10   HD21  LEU 708          HD22      LEU 708  57.760  -0.651 -11.534
   11   HD23  LEU 708          HD23      LEU 708  58.894   0.696 -11.424

  No H/Q in entry =          11
  In of MODEL   27
    1    H    GLN 709           H        GLN 709  59.765  -1.362  -5.900
    2    HA   GLN 709           HA       GLN 709  59.391   1.481  -5.406
    3    HB2  GLN 709           HB2      GLN 709  59.413   1.317  -3.024
    4    HB3  GLN 709           HB3      GLN 709  58.122   0.253  -3.561
    5    HG2  GLN 709           HG2      GLN 709  59.645  -1.676  -3.291
    6    HG3  GLN 709           HG3      GLN 709  60.886  -0.578  -2.733
    7   HE21  GLN 709          HE21      GLN 709  61.003  -1.644  -0.768
    8   HE22  GLN 709          HE22      GLN 709  59.789  -1.449   0.450

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ASN 710           H        ASN 710  61.315   2.412  -4.698
    2    HA   ASN 710           HA       ASN 710  63.595   2.638  -4.471
    3    HB2  ASN 710           HB2      ASN 710  63.057   0.989  -2.567
    4    HB3  ASN 710           HB3      ASN 710  63.462  -0.281  -3.673
    5   HD21  ASN 710          HD21      ASN 710  64.888  -0.911  -2.087
    6   HD22  ASN 710          HD22      ASN 710  66.440  -0.196  -1.935

  No H/Q in entry =           6
  In of MODEL   27
    1    H    SER 711           H        SER 711  62.282   1.608  -6.930
    2    HA   SER 711           HA       SER 711  62.724   1.011  -9.031
    3    HB2  SER 711           HB2      SER 711  65.579   1.488  -8.180
    4    HB3  SER 711           HB3      SER 711  65.029   1.372  -9.862
    5    HG   SER 711           HG       SER 711  63.513   3.075  -8.429

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ARG 712           H        ARG 712  62.616  -1.075  -6.928
    2    HA   ARG 712           HA       ARG 712  63.817  -3.233  -8.497
    3    HB2  ARG 712           HB2      ARG 712  64.478  -4.397  -6.441
    4    HB3  ARG 712           HB3      ARG 712  65.319  -2.861  -6.595
    5    HG2  ARG 712           HG2      ARG 712  63.885  -1.845  -4.980
    6    HG3  ARG 712           HG3      ARG 712  62.862  -3.278  -4.909
    7    HD2  ARG 712           HD2      ARG 712  64.353  -3.198  -2.988
    8    HD3  ARG 712           HD3      ARG 712  64.765  -4.555  -4.028
    9    HE   ARG 712           HE       ARG 712  66.239  -2.155  -4.551
   10   HH11  ARG 712          HH11      ARG 712  66.165  -5.192  -2.735
   11   HH12  ARG 712          HH12      ARG 712  67.835  -5.208  -2.426
   12   HH21  ARG 712          HH21      ARG 712  68.498  -2.154  -4.142
   13   HH22  ARG 712          HH22      ARG 712  69.213  -3.424  -3.264

  No H/Q in entry =          13
  In of MODEL   27
    1    H    CYS 713           H        CYS 713  62.831  -5.394  -7.685
    2    HA   CYS 713           HA       CYS 713  59.970  -4.959  -7.339
    3    HB2  CYS 713           HB2      CYS 713  61.462  -7.496  -8.040
    4    HB3  CYS 713           HB3      CYS 713  59.733  -7.202  -8.191

  No H/Q in entry =           4
  In of MODEL   27
    1    H    VAL 714           H        VAL 714  59.283  -5.119  -5.289
    2    HA   VAL 714           HA       VAL 714  60.601  -7.079  -3.534
    3    HB   VAL 714           HB       VAL 714  60.017  -5.697  -1.589
    4   HG13  VAL 714          HG11      VAL 714  61.546  -3.828  -1.900
    5   HG12  VAL 714          HG12      VAL 714  61.512  -4.104  -3.642
    6   HG11  VAL 714          HG13      VAL 714  62.194  -5.328  -2.568
    7   HG21  VAL 714          HG21      VAL 714  58.976  -3.703  -3.584
    8   HG23  VAL 714          HG22      VAL 714  59.163  -3.409  -1.854
    9   HG22  VAL 714          HG23      VAL 714  58.020  -4.624  -2.424

  No H/Q in entry =           9
  In of MODEL   27
    1    H    CYS 715           H        CYS 715  58.896  -7.537  -1.656
    2    HA   CYS 715           HA       CYS 715  56.647  -8.553  -3.158
    3    HB2  CYS 715           HB2      CYS 715  57.445  -9.008  -0.280
    4    HB3  CYS 715           HB3      CYS 715  56.205  -9.891  -1.161

  No H/Q in entry =           4
  In of MODEL   27
    1    H    LYS 716           H        LYS 716  54.485  -8.328  -2.422
    2    HA   LYS 716           HA       LYS 716  53.806  -5.696  -1.442
    3    HB2  LYS 716           HB2      LYS 716  52.697  -7.061  -3.329
    4    HB3  LYS 716           HB3      LYS 716  52.030  -8.073  -2.070
    5    HG2  LYS 716           HG2      LYS 716  50.750  -6.169  -1.221
    6    HG3  LYS 716           HG3      LYS 716  51.445  -5.140  -2.484
    7    HD2  LYS 716           HD2      LYS 716  50.492  -6.677  -4.186
    8    HD3  LYS 716           HD3      LYS 716  49.735  -7.595  -2.890
    9    HE2  LYS 716           HE2      LYS 716  48.108  -6.115  -3.871
   10    HE3  LYS 716           HE3      LYS 716  48.480  -5.558  -2.244
   11    HZ1  LYS 716           HZ1      LYS 716  49.651  -4.414  -4.724
   12    HZ3  LYS 716           HZ2      LYS 716  49.843  -3.797  -3.158
   13    HZ2  LYS 716           HZ3      LYS 716  48.342  -3.787  -3.895

  No H/Q in entry =          13
  In of MODEL   27
    1    H    MET 717           H        MET 717  51.759  -5.961   0.318
    2    HA   MET 717           HA       MET 717  52.821  -7.678   2.442
    3    HB2  MET 717           HB2      MET 717  50.969  -5.300   2.550
    4    HB3  MET 717           HB3      MET 717  51.352  -6.280   3.945
    5    HG2  MET 717           HG2      MET 717  53.469  -4.843   2.382
    6    HG3  MET 717           HG3      MET 717  52.541  -4.038   3.634
    7    HE2  MET 717           HE1      MET 717  55.787  -7.281   4.320
    8    HE1  MET 717           HE2      MET 717  55.272  -6.686   2.734
    9    HE3  MET 717           HE3      MET 717  54.256  -7.806   3.650

  No H/Q in entry =           9
  In of MODEL   27
    1    HA   PRO 718           HA       PRO 718  49.470 -10.422   1.623
    2    HB2  PRO 718           HB2      PRO 718  49.394 -11.776   4.000
    3    HB3  PRO 718           HB3      PRO 718  50.612 -12.061   2.756
    4    HG2  PRO 718           HG2      PRO 718  50.800 -10.412   5.246
    5    HG3  PRO 718           HG3      PRO 718  51.997 -11.518   4.549
    6    HD2  PRO 718           HD2      PRO 718  52.171  -8.841   4.280
    7    HD3  PRO 718           HD3      PRO 718  52.714  -9.954   3.007

  No H/Q in entry =           7
  In of MODEL   27
    1    H    TYR 719           H        TYR 719  49.392  -8.255   4.256
    2    HA   TYR 719           HA       TYR 719  46.584  -8.765   4.804
    3    HB2  TYR 719           HB2      TYR 719  46.898  -7.084   6.639
    4    HB3  TYR 719           HB3      TYR 719  47.922  -8.506   6.764
    5    HD1  TYR 719           HD1      TYR 719  47.848  -4.927   6.051
    6    HD2  TYR 719           HD2      TYR 719  50.343  -8.321   6.564
    7    HE1  TYR 719           HE1      TYR 719  49.780  -3.457   6.229
    8    HE2  TYR 719           HE2      TYR 719  52.312  -6.844   6.752
    9    HH   TYR 719           HH       TYR 719  53.022  -4.610   6.193

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLU 720           H        GLU 720  48.442  -6.793   2.856
    2    HA   GLU 720           HA       GLU 720  46.231  -4.927   2.405
    3    HB2  GLU 720           HB2      GLU 720  49.189  -4.544   2.407
    4    HB3  GLU 720           HB3      GLU 720  48.209  -3.540   1.342
    5    HG2  GLU 720           HG2      GLU 720  47.832  -3.799   4.309
    6    HG3  GLU 720           HG3      GLU 720  48.693  -2.482   3.511

  No H/Q in entry =           6
  In of MODEL   27
    1    H    CYS 721           H        CYS 721  46.386  -7.386   1.497
    2    HA   CYS 721           HA       CYS 721  47.707  -7.931  -0.878
    3    HB2  CYS 721           HB2      CYS 721  46.005  -9.819  -0.904
    4    HB3  CYS 721           HB3      CYS 721  47.073  -9.686   0.489

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLY 722           H        GLY 722  44.448  -6.610  -0.306
    2    HA3  GLY 722           HA2      GLY 722  43.444  -5.123  -1.835
    3    HA2  GLY 722           HA3      GLY 722  44.434  -5.812  -3.112

  No H/Q in entry =           3
  In of MODEL   27
    1    HA   PRO 723           HA       PRO 723  40.228  -7.734  -3.600
    2    HB2  PRO 723           HB2      PRO 723  40.182  -6.756  -6.265
    3    HB3  PRO 723           HB3      PRO 723  39.221  -6.173  -4.905
    4    HG2  PRO 723           HG2      PRO 723  41.166  -4.701  -6.216
    5    HG3  PRO 723           HG3      PRO 723  40.610  -4.384  -4.565
    6    HD2  PRO 723           HD2      PRO 723  43.041  -5.854  -5.503
    7    HD3  PRO 723           HD3      PRO 723  42.858  -4.719  -4.144

  No H/Q in entry =           7
  In of MODEL   27
    1    H    SER 724           H        SER 724  40.063  -9.843  -4.252
    2    HA   SER 724           HA       SER 724  41.297 -10.974  -6.559
    3    HB2  SER 724           HB2      SER 724  43.229 -10.460  -5.061
    4    HB3  SER 724           HB3      SER 724  42.493 -11.452  -3.815
    5    HG   SER 724           HG       SER 724  43.221 -12.352  -6.408

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU 725           H        LEU 725  40.998 -13.421  -6.386
    2    HA   LEU 725           HA       LEU 725  38.344 -13.934  -5.576
    3    HB2  LEU 725           HB2      LEU 725  40.556 -15.444  -6.798
    4    HB3  LEU 725           HB3      LEU 725  39.148 -16.363  -6.266
    5    HG   LEU 725           HG       LEU 725  39.079 -14.091  -8.268
    6   HD11  LEU 725          HD11      LEU 725  40.438 -15.956  -9.113
    7   HD13  LEU 725          HD12      LEU 725  38.906 -15.826  -9.974
    8   HD12  LEU 725          HD13      LEU 725  39.124 -17.075  -8.747
    9   HD23  LEU 725          HD21      LEU 725  36.920 -15.019  -8.842
   10   HD22  LEU 725          HD22      LEU 725  36.965 -14.534  -7.151
   11   HD21  LEU 725          HD23      LEU 725  37.081 -16.244  -7.583

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ASP 726           H        ASP 726  37.638 -14.784  -3.673
    2    HA   ASP 726           HA       ASP 726  39.526 -15.635  -1.632
    3    HB2  ASP 726           HB2      ASP 726  36.500 -15.452  -1.573
    4    HB3  ASP 726           HB3      ASP 726  37.483 -16.014  -0.227

  No H/Q in entry =           4
  In of MODEL   27
    1    H    VAL 727           H        VAL 727  40.175 -17.510  -1.192
    2    HA   VAL 727           HA       VAL 727  38.819 -19.824  -2.390
    3    HB   VAL 727           HB       VAL 727  41.047 -20.806  -2.947
    4   HG11  VAL 727          HG11      VAL 727  40.481 -18.168  -4.307
    5   HG13  VAL 727          HG12      VAL 727  39.779 -19.731  -4.727
    6   HG12  VAL 727          HG13      VAL 727  41.502 -19.450  -4.956
    7   HG21  VAL 727          HG21      VAL 727  42.422 -19.526  -1.388
    8   HG23  VAL 727          HG22      VAL 727  42.114 -18.049  -2.305
    9   HG22  VAL 727          HG23      VAL 727  43.035 -19.365  -3.032

  No H/Q in entry =           9
  In of MODEL   27
    1    H    CYS 728           H        CYS 728  39.589 -21.888  -1.392
    2    HA   CYS 728           HA       CYS 728  39.967 -21.475   1.486
    3    HB2  CYS 728           HB2      CYS 728  39.265 -24.038   0.055
    4    HB3  CYS 728           HB3      CYS 728  39.112 -23.685   1.757

  No H/Q in entry =           4
  In of MODEL   27
    1    H    ALA 729           H        ALA 729  41.858 -22.135   2.456
    2    HA   ALA 729           HA       ALA 729  43.660 -23.702   0.803
    3    HB1  ALA 729           HB1      ALA 729  44.405 -21.201   2.287
    4    HB3  ALA 729           HB2      ALA 729  44.277 -21.364   0.530
    5    HB2  ALA 729           HB3      ALA 729  45.519 -22.249   1.411

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLN 730           H        GLN 730  45.488 -24.454   2.090
    2    HA   GLN 730           HA       GLN 730  44.642 -25.054   4.832
    3    HB2  GLN 730           HB2      GLN 730  44.460 -27.028   3.313
    4    HB3  GLN 730           HB3      GLN 730  46.169 -26.850   2.983
    5    HG2  GLN 730           HG2      GLN 730  46.765 -27.295   5.221
    6    HG3  GLN 730           HG3      GLN 730  45.086 -27.308   5.741
    7   HE21  GLN 730          HE21      GLN 730  45.163 -29.393   6.505
    8   HE22  GLN 730          HE22      GLN 730  45.289 -30.756   5.467

  No H/Q in entry =           8
  In of MODEL   27
    1    H    ASP 731           H        ASP 731  46.005 -24.615   6.313
    2    HA   ASP 731           HA       ASP 731  48.514 -23.317   5.783
    3    HB2  ASP 731           HB2      ASP 731  47.039 -22.609   7.649
    4    HB3  ASP 731           HB3      ASP 731  47.190 -24.203   8.358

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLU 732           H        GLU 732  50.451 -24.407   5.581
    2    HA   GLU 732           HA       GLU 732  50.404 -27.240   6.052
    3    HB2  GLU 732           HB2      GLU 732  52.486 -25.440   4.894
    4    HB3  GLU 732           HB3      GLU 732  52.777 -27.153   5.185
    5    HG2  GLU 732           HG2      GLU 732  50.662 -25.969   3.406
    6    HG3  GLU 732           HG3      GLU 732  52.147 -26.771   2.885

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ARG 733           H        ARG 733  50.878 -24.867   8.255
    2    HA   ARG 733           HA       ARG 733  53.152 -26.103   9.516
    3    HB2  ARG 733           HB2      ARG 733  51.437 -23.769  10.354
    4    HB3  ARG 733           HB3      ARG 733  52.996 -24.234  11.013
    5    HG2  ARG 733           HG2      ARG 733  52.536 -23.338   8.184
    6    HG3  ARG 733           HG3      ARG 733  53.056 -22.274   9.484
    7    HD2  ARG 733           HD2      ARG 733  54.588 -24.739   8.668
    8    HD3  ARG 733           HD3      ARG 733  54.866 -23.160   7.942
    9    HE   ARG 733           HE       ARG 733  54.991 -23.064  10.775
   10   HH11  ARG 733          HH11      ARG 733  56.830 -23.964   7.922
   11   HH12  ARG 733          HH12      ARG 733  58.368 -23.710   8.596
   12   HH21  ARG 733          HH21      ARG 733  57.118 -22.632  11.746
   13   HH22  ARG 733          HH22      ARG 733  58.519 -22.936  10.831

  No H/Q in entry =          13
  In of MODEL   27
    1    H    SER 734           H        SER 734  49.779 -25.268  10.110
    2    HA   SER 734           HA       SER 734  49.669 -27.198  12.329
    3    HB2  SER 734           HB2      SER 734  47.745 -25.005  11.559
    4    HB3  SER 734           HB3      SER 734  47.676 -25.972  13.030
    5    HG   SER 734           HG       SER 734  49.466 -23.946  12.294

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LYS 735           H        LYS 735  48.967 -27.084   9.061
    2    HA   LYS 735           HA       LYS 735  47.734 -28.154   7.612
    3    HB2  LYS 735           HB2      LYS 735  47.624 -30.213   9.801
    4    HB3  LYS 735           HB3      LYS 735  47.044 -30.505   8.170
    5    HG2  LYS 735           HG2      LYS 735  49.864 -29.773   8.945
    6    HG3  LYS 735           HG3      LYS 735  49.295 -31.380   8.496
    7    HD2  LYS 735           HD2      LYS 735  49.235 -28.951   6.689
    8    HD3  LYS 735           HD3      LYS 735  50.476 -30.181   6.658
    9    HE2  LYS 735           HE2      LYS 735  48.742 -31.872   6.111
   10    HE3  LYS 735           HE3      LYS 735  47.523 -30.605   6.121
   11    HZ3  LYS 735           HZ1      LYS 735  48.166 -31.050   3.882
   12    HZ2  LYS 735           HZ2      LYS 735  49.794 -30.892   4.254
   13    HZ1  LYS 735           HZ3      LYS 735  48.829 -29.530   4.260

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ARG 736           H        ARG 736  46.308 -26.304   9.355
    2    HA   ARG 736           HA       ARG 736  43.642 -27.499   9.310
    3    HB2  ARG 736           HB2      ARG 736  42.853 -25.590  10.509
    4    HB3  ARG 736           HB3      ARG 736  44.285 -26.204  11.316
    5    HG2  ARG 736           HG2      ARG 736  45.529 -24.366  10.796
    6    HG3  ARG 736           HG3      ARG 736  44.608 -24.028   9.326
    7    HD2  ARG 736           HD2      ARG 736  43.630 -23.659  12.148
    8    HD3  ARG 736           HD3      ARG 736  44.173 -22.400  11.023
    9    HE   ARG 736           HE       ARG 736  42.261 -23.444   9.562
   10   HH11  ARG 736          HH11      ARG 736  42.096 -22.742  13.026
   11   HH12  ARG 736          HH12      ARG 736  40.417 -22.524  13.018
   12   HH21  ARG 736          HH21      ARG 736  40.020 -23.159   9.563
   13   HH22  ARG 736          HH22      ARG 736  39.174 -22.791  10.995

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ILE 737           H        ILE 737  41.913 -26.455   8.240
    2    HA   ILE 737           HA       ILE 737  42.716 -25.241   5.739
    3    HB   ILE 737           HB       ILE 737  39.905 -25.708   6.743
    4   HG12  ILE 737          HG12      ILE 737  41.159 -27.856   6.870
    5   HG13  ILE 737          HG13      ILE 737  39.899 -27.900   5.649
    6   HG23  ILE 737          HG21      ILE 737  39.341 -25.706   4.375
    7   HG22  ILE 737          HG22      ILE 737  41.037 -25.603   3.948
    8   HG21  ILE 737          HG23      ILE 737  40.259 -24.250   4.768
    9   HD13  ILE 737          HD11      ILE 737  41.902 -28.997   4.865
   10   HD12  ILE 737          HD12      ILE 737  42.847 -27.537   5.177
   11   HD11  ILE 737          HD13      ILE 737  41.585 -27.530   3.935

  No H/Q in entry =          11
  In of MODEL   27
    1    H    LEU 738           H        LEU 738  42.592 -23.072   5.421
    2    HA   LEU 738           HA       LEU 738  40.880 -21.553   7.196
    3    HB2  LEU 738           HB2      LEU 738  42.414 -19.821   7.623
    4    HB3  LEU 738           HB3      LEU 738  43.251 -21.304   8.050
    5    HG   LEU 738           HG       LEU 738  43.688 -19.585   5.600
    6   HD12  LEU 738          HD11      LEU 738  45.422 -20.077   8.002
    7   HD11  LEU 738          HD12      LEU 738  44.554 -18.590   7.628
    8   HD13  LEU 738          HD13      LEU 738  45.871 -19.124   6.587
    9   HD23  LEU 738          HD21      LEU 738  45.178 -22.048   6.464
   10   HD22  LEU 738          HD22      LEU 738  45.505 -21.043   5.024
   11   HD21  LEU 738          HD23      LEU 738  43.996 -21.945   5.163

  No H/Q in entry =          11
  In of MODEL   27
    1    HA   PRO 739           HA       PRO 739  39.670 -19.656   3.432
    2    HB2  PRO 739           HB2      PRO 739  38.681 -17.325   4.406
    3    HB3  PRO 739           HB3      PRO 739  37.854 -18.880   4.634
    4    HG2  PRO 739           HG2      PRO 739  39.602 -17.379   6.544
    5    HG3  PRO 739           HG3      PRO 739  38.058 -18.197   6.847
    6    HD2  PRO 739           HD2      PRO 739  40.480 -19.339   7.407
    7    HD3  PRO 739           HD3      PRO 739  39.035 -20.275   6.939

  No H/Q in entry =           7
  In of MODEL   27
    1    H    LEU 740           H        LEU 740  40.938 -18.640   1.971
    2    HA   LEU 740           HA       LEU 740  42.499 -16.337   2.845
    3    HB2  LEU 740           HB2      LEU 740  43.503 -18.659   1.209
    4    HB3  LEU 740           HB3      LEU 740  44.281 -17.098   1.179
    5    HG   LEU 740           HG       LEU 740  44.058 -18.957   3.545
    6   HD12  LEU 740          HD11      LEU 740  46.496 -19.059   3.311
    7   HD11  LEU 740          HD12      LEU 740  46.385 -18.036   1.870
    8   HD13  LEU 740          HD13      LEU 740  45.663 -19.640   1.869
    9   HD21  LEU 740          HD21      LEU 740  45.336 -16.222   3.349
   10   HD23  LEU 740          HD22      LEU 740  45.503 -17.336   4.702
   11   HD22  LEU 740          HD23      LEU 740  43.929 -16.645   4.328

  No H/Q in entry =          11
  In of MODEL   27
    1    H    THR 741           H        THR 741  43.554 -15.565   0.588
    2    HA   THR 741           HA       THR 741  41.497 -15.522  -1.448
    3    HB   THR 741           HB       THR 741  42.989 -13.018  -0.577
    4    HG1  THR 741           HG1      THR 741  40.319 -13.619   0.271
    5   HG22  THR 741          HG21      THR 741  40.332 -13.420  -1.937
    6   HG21  THR 741          HG22      THR 741  41.847 -13.076  -2.758
    7   HG23  THR 741          HG23      THR 741  41.140 -11.872  -1.670

  No H/Q in entry =           7
  In of MODEL   27
    1    H    VAL 742           H        VAL 742  42.532 -15.161  -3.516
    2    HA   VAL 742           HA       VAL 742  44.927 -16.427  -4.044
    3    HB   VAL 742           HB       VAL 742  43.703 -14.136  -5.567
    4   HG13  VAL 742          HG11      VAL 742  45.879 -14.461  -6.378
    5   HG12  VAL 742          HG12      VAL 742  44.703 -15.042  -7.551
    6   HG11  VAL 742          HG13      VAL 742  45.621 -16.200  -6.573
    7   HG21  VAL 742          HG21      VAL 742  43.188 -17.074  -5.770
    8   HG23  VAL 742          HG22      VAL 742  42.655 -15.843  -6.930
    9   HG22  VAL 742          HG23      VAL 742  42.083 -15.779  -5.263

  No H/Q in entry =           9
  In of MODEL   27
    1    H    CYS 743           H        CYS 743  44.412 -12.950  -3.853
    2    HA   CYS 743           HA       CYS 743  46.965 -12.009  -4.101
    3    HB2  CYS 743           HB2      CYS 743  46.166 -10.025  -2.835
    4    HB3  CYS 743           HB3      CYS 743  45.048 -10.561  -4.072

  No H/Q in entry =           4
  In of MODEL   27
    1    H    LYS 744           H        LYS 744  45.365 -12.913  -1.044
    2    HA   LYS 744           HA       LYS 744  47.484 -12.334   0.694
    3    HB2  LYS 744           HB2      LYS 744  45.373 -14.480   0.997
    4    HB3  LYS 744           HB3      LYS 744  46.424 -13.899   2.276
    5    HG2  LYS 744           HG2      LYS 744  45.397 -11.669   2.073
    6    HG3  LYS 744           HG3      LYS 744  44.312 -12.296   0.832
    7    HD2  LYS 744           HD2      LYS 744  43.463 -13.946   2.481
    8    HD3  LYS 744           HD3      LYS 744  44.484 -13.204   3.712
    9    HE2  LYS 744           HE2      LYS 744  42.234 -11.875   2.199
   10    HE3  LYS 744           HE3      LYS 744  42.187 -12.398   3.879
   11    HZ3  LYS 744           HZ1      LYS 744  42.564 -10.042   3.753
   12    HZ2  LYS 744           HZ2      LYS 744  43.873 -10.220   2.750
   13    HZ1  LYS 744           HZ3      LYS 744  43.960 -10.762   4.354

  No H/Q in entry =          13
  In of MODEL   27
    1    H    MET 745           H        MET 745  46.485 -15.471  -0.591
    2    HA   MET 745           HA       MET 745  48.485 -17.111   0.359
    3    HB2  MET 745           HB2      MET 745  46.806 -18.194  -0.575
    4    HB3  MET 745           HB3      MET 745  46.661 -17.166  -1.999
    5    HG2  MET 745           HG2      MET 745  47.480 -19.126  -2.909
    6    HG3  MET 745           HG3      MET 745  48.934 -18.223  -2.629
    7    HE3  MET 745           HE1      MET 745  46.697 -20.226  -0.025
    8    HE2  MET 745           HE2      MET 745  47.541 -21.780  -0.064
    9    HE1  MET 745           HE3      MET 745  46.740 -21.176  -1.507

  No H/Q in entry =           9
  In of MODEL   27
    1    H    HIS 746           H        HIS 746  48.486 -15.247  -2.674
    2    HA   HIS 746           HA       HIS 746  50.944 -16.286  -3.628
    3    HB2  HIS 746           HB2      HIS 746  49.231 -14.023  -4.328
    4    HB3  HIS 746           HB3      HIS 746  50.914 -13.897  -4.880
    5    HD1  HIS 746           HD1      HIS 746  51.605 -15.797  -6.652
    6    HD2  HIS 746           HD2      HIS 746  47.570 -15.564  -5.741
    7    HE1  HIS 746           HE1      HIS 746  50.415 -16.892  -8.571
    8    HE2  HIS 746           HE2      HIS 746  48.000 -16.878  -7.932

  No H/Q in entry =           8
  In of MODEL   27
    1    H    VAL 747           H        VAL 747  50.215 -13.245  -1.956
    2    HA   VAL 747           HA       VAL 747  52.892 -12.343  -1.912
    3    HB   VAL 747           HB       VAL 747  50.548 -11.584  -0.150
    4   HG13  VAL 747          HG11      VAL 747  51.847  -9.595   0.400
    5   HG12  VAL 747          HG12      VAL 747  53.202 -10.208  -0.543
    6   HG11  VAL 747          HG13      VAL 747  52.680 -11.056   0.914
    7   HG23  VAL 747          HG21      VAL 747  51.755 -10.269  -2.565
    8   HG22  VAL 747          HG22      VAL 747  50.413  -9.624  -1.607
    9   HG21  VAL 747          HG23      VAL 747  50.216 -11.125  -2.522

  No H/Q in entry =           9
  In of MODEL   27
    1    H    LEU 748           H        LEU 748  50.900 -14.003   0.412
    2    HA   LEU 748           HA       LEU 748  52.776 -14.154   2.449
    3    HB2  LEU 748           HB2      LEU 748  50.675 -14.530   3.211
    4    HB3  LEU 748           HB3      LEU 748  50.155 -15.274   1.735
    5    HG   LEU 748           HG       LEU 748  51.763 -16.785   3.786
    6   HD11  LEU 748          HD11      LEU 748  48.755 -16.458   3.537
    7   HD13  LEU 748          HD12      LEU 748  49.738 -15.801   4.844
    8   HD12  LEU 748          HD13      LEU 748  49.584 -17.546   4.650
    9   HD23  LEU 748          HD21      LEU 748  49.765 -17.622   1.671
   10   HD22  LEU 748          HD22      LEU 748  50.678 -18.685   2.725
   11   HD21  LEU 748          HD23      LEU 748  51.516 -17.726   1.502

  No H/Q in entry =          11
  In of MODEL   27
    1    H    HIS 749           H        HIS 749  52.338 -16.066  -0.413
    2    HA   HIS 749           HA       HIS 749  54.109 -18.174   0.358
    3    HB2  HIS 749           HB2      HIS 749  52.223 -18.160  -1.454
    4    HB3  HIS 749           HB3      HIS 749  53.466 -17.482  -2.494
    5    HD1  HIS 749           HD1      HIS 749  55.554 -19.078  -2.980
    6    HD2  HIS 749           HD2      HIS 749  52.314 -20.814  -1.078
    7    HE1  HIS 749           HE1      HIS 749  55.902 -21.556  -3.208
    8    HE2  HIS 749           HE2      HIS 749  53.750 -22.534  -2.355

  No H/Q in entry =           8
  In of MODEL   27
    1    H    CYS 750           H        CYS 750  54.439 -15.061  -1.340
    2    HA   CYS 750           HA       CYS 750  57.136 -15.701  -2.098
    3    HB2  CYS 750           HB2      CYS 750  57.289 -13.410  -3.021
    4    HB3  CYS 750           HB3      CYS 750  55.876 -14.252  -3.626

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLN 751           H        GLN 751  55.540 -14.154   0.515
    2    HA   GLN 751           HA       GLN 751  57.847 -13.099   1.787
    3    HB2  GLN 751           HB2      GLN 751  55.253 -14.167   2.926
    4    HB3  GLN 751           HB3      GLN 751  56.483 -13.376   3.896
    5    HG2  GLN 751           HG2      GLN 751  55.091 -12.106   1.559
    6    HG3  GLN 751           HG3      GLN 751  54.570 -11.907   3.224
    7   HE21  GLN 751          HE21      GLN 751  55.449  -9.857   1.374
    8   HE22  GLN 751          HE22      GLN 751  56.862  -9.138   2.066

  No H/Q in entry =           8
  In of MODEL   27
    1    H    GLY 752           H        GLY 752  56.277 -16.239   1.828
    2    HA3  GLY 752           HA2      GLY 752  58.026 -18.054   1.620
    3    HA2  GLY 752           HA3      GLY 752  58.725 -17.330   3.056

  No H/Q in entry =           3
  In of MODEL   27
    1    H    ARG 753           H        ARG 753  55.247 -17.885   2.468
    2    HA   ARG 753           HA       ARG 753  55.379 -19.809   4.685
    3    HB2  ARG 753           HB2      ARG 753  52.861 -18.466   3.724
    4    HB3  ARG 753           HB3      ARG 753  53.172 -19.234   5.273
    5    HG2  ARG 753           HG2      ARG 753  54.310 -16.605   4.340
    6    HG3  ARG 753           HG3      ARG 753  53.019 -16.824   5.516
    7    HD2  ARG 753           HD2      ARG 753  54.506 -17.766   7.099
    8    HD3  ARG 753           HD3      ARG 753  55.783 -17.949   5.889
    9    HE   ARG 753           HE       ARG 753  54.884 -15.265   6.223
   10   HH11  ARG 753          HH11      ARG 753  57.091 -17.658   7.634
   11   HH12  ARG 753          HH12      ARG 753  58.258 -16.502   8.068
   12   HH21  ARG 753          HH21      ARG 753  56.507 -13.690   6.820
   13   HH22  ARG 753          HH22      ARG 753  57.910 -14.203   7.622

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ASN 754           H        ASN 754  54.335 -21.771   4.419
    2    HA   ASN 754           HA       ASN 754  53.856 -22.496   1.612
    3    HB2  ASN 754           HB2      ASN 754  54.449 -24.371   3.921
    4    HB3  ASN 754           HB3      ASN 754  54.372 -24.789   2.216
    5   HD21  ASN 754          HD21      ASN 754  56.319 -23.625   4.767
    6   HD22  ASN 754          HD22      ASN 754  57.746 -23.366   3.857

  No H/Q in entry =           6
  In of MODEL   27
    1    H    TYR 755           H        TYR 755  51.882 -23.034   0.999
    2    HA   TYR 755           HA       TYR 755  49.931 -23.988   2.921
    3    HB2  TYR 755           HB2      TYR 755  49.628 -21.500   1.240
    4    HB3  TYR 755           HB3      TYR 755  48.241 -22.447   1.755
    5    HD1  TYR 755           HD1      TYR 755  47.292 -22.064   3.829
    6    HD2  TYR 755           HD2      TYR 755  51.181 -20.601   3.066
    7    HE1  TYR 755           HE1      TYR 755  47.262 -20.872   5.970
    8    HE2  TYR 755           HE2      TYR 755  51.148 -19.389   5.179
    9    HH   TYR 755           HH       TYR 755  48.904 -20.131   7.545

  No H/Q in entry =           9
  In of MODEL   27
    1    H    THR 756           H        THR 756  48.217 -25.048   1.930
    2    HA   THR 756           HA       THR 756  48.684 -25.894  -0.851
    3    HB   THR 756           HB       THR 756  47.310 -27.332   1.455
    4    HG1  THR 756           HG1      THR 756  49.213 -27.760   2.011
    5   HG21  THR 756          HG21      THR 756  46.457 -28.000  -0.734
    6   HG23  THR 756          HG22      THR 756  47.361 -29.309   0.027
    7   HG22  THR 756          HG23      THR 756  48.099 -28.362  -1.280

  No H/Q in entry =           7
  In of MODEL   27
    1    H    LEU 757           H        LEU 757  46.508 -26.197  -2.046
    2    HA   LEU 757           HA       LEU 757  44.525 -24.522  -0.757
    3    HB2  LEU 757           HB2      LEU 757  44.853 -25.158  -3.663
    4    HB3  LEU 757           HB3      LEU 757  43.434 -24.382  -2.995
    5    HG   LEU 757           HG       LEU 757  45.256 -22.745  -2.028
    6   HD13  LEU 757          HD11      LEU 757  47.006 -22.291  -3.660
    7   HD12  LEU 757          HD12      LEU 757  46.538 -23.735  -4.559
    8   HD11  LEU 757          HD13      LEU 757  47.171 -23.883  -2.917
    9   HD23  LEU 757          HD21      LEU 757  44.748 -21.292  -3.900
   10   HD22  LEU 757          HD22      LEU 757  43.347 -22.173  -3.282
   11   HD21  LEU 757          HD23      LEU 757  44.112 -22.685  -4.794

  No H/Q in entry =          11
  In of MODEL   27
    1    H    THR 758           H        THR 758  42.359 -25.099  -0.805
    2    HA   THR 758           HA       THR 758  41.982 -27.942  -1.188
    3    HB   THR 758           HB       THR 758  40.590 -27.897   0.955
    4    HG1  THR 758           HG1      THR 758  40.457 -26.065   1.898
    5   HG23  THR 758          HG21      THR 758  42.568 -28.280   2.385
    6   HG22  THR 758          HG22      THR 758  43.582 -27.482   1.187
    7   HG21  THR 758          HG23      THR 758  42.790 -29.005   0.793

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLY 759           H        GLY 759  39.486 -28.349  -0.684
    2    HA3  GLY 759           HA2      GLY 759  38.277 -27.000  -2.909
    3    HA2  GLY 759           HA3      GLY 759  37.619 -28.369  -2.033

  No H/Q in entry =           3
  In of MODEL   27
    1    H    ARG 760           H        ARG 760  36.184 -26.239  -2.901
    2    HA   ARG 760           HA       ARG 760  35.561 -24.134  -1.278
    3    HB2  ARG 760           HB2      ARG 760  33.234 -24.332  -2.300
    4    HB3  ARG 760           HB3      ARG 760  34.617 -24.187  -3.375
    5    HG2  ARG 760           HG2      ARG 760  33.219 -25.846  -4.374
    6    HG3  ARG 760           HG3      ARG 760  34.575 -26.667  -3.595
    7    HD2  ARG 760           HD2      ARG 760  32.517 -27.881  -3.217
    8    HD3  ARG 760           HD3      ARG 760  33.214 -27.256  -1.720
    9    HE   ARG 760           HE       ARG 760  31.348 -25.428  -2.721
   10   HH11  ARG 760          HH11      ARG 760  31.333 -28.688  -1.319
   11   HH12  ARG 760          HH12      ARG 760  29.879 -28.491  -0.482
   12   HH21  ARG 760          HH21      ARG 760  29.294 -25.184  -1.686
   13   HH22  ARG 760          HH22      ARG 760  28.634 -26.444  -0.741

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ASP 761           H        ASP 761  34.939 -27.356  -0.521
    2    HA   ASP 761           HA       ASP 761  32.819 -26.761   1.396
    3    HB2  ASP 761           HB2      ASP 761  32.622 -28.804   0.161
    4    HB3  ASP 761           HB3      ASP 761  34.222 -29.322   0.674

  No H/Q in entry =           4
  In of MODEL   27
    1    H    SER 762           H        SER 762  36.213 -27.098   1.363
    2    HA   SER 762           HA       SER 762  36.537 -28.188   3.945
    3    HB2  SER 762           HB2      SER 762  38.935 -27.561   3.774
    4    HB3  SER 762           HB3      SER 762  38.330 -28.413   2.361
    5    HG   SER 762           HG       SER 762  38.128 -26.368   1.311

  No H/Q in entry =           5
  In of MODEL   27
    1    H    CYS 763           H        CYS 763  36.384 -24.771   2.986
    2    HA   CYS 763           HA       CYS 763  35.824 -24.222   5.760
    3    HB2  CYS 763           HB2      CYS 763  37.393 -22.382   5.951
    4    HB3  CYS 763           HB3      CYS 763  38.280 -23.861   5.526

  No H/Q in entry =           4
  In of MODEL   27
    1    H    THR 764           H        THR 764  35.157 -21.879   5.956
    2    HA   THR 764           HA       THR 764  33.484 -21.214   3.657
    3    HB   THR 764           HB       THR 764  33.356 -20.277   6.537
    4    HG1  THR 764           HG1      THR 764  31.998 -21.885   6.915
    5   HG22  THR 764          HG21      THR 764  31.062 -19.607   5.946
    6   HG21  THR 764          HG22      THR 764  31.336 -20.159   4.287
    7   HG23  THR 764          HG23      THR 764  32.255 -18.795   4.926

  No H/Q in entry =           7
  In of MODEL   27
    1    H    LEU 765           H        LEU 765  33.625 -19.126   2.766
    2    HA   LEU 765           HA       LEU 765  36.018 -17.683   3.455
    3    HB2  LEU 765           HB2      LEU 765  34.202 -17.713   1.076
    4    HB3  LEU 765           HB3      LEU 765  35.304 -16.380   1.295
    5    HG   LEU 765           HG       LEU 765  36.379 -17.692  -0.212
    6   HD11  LEU 765          HD11      LEU 765  37.916 -17.262   1.581
    7   HD13  LEU 765          HD12      LEU 765  38.238 -18.828   0.829
    8   HD12  LEU 765          HD13      LEU 765  37.429 -18.759   2.382
    9   HD23  LEU 765          HD21      LEU 765  35.521 -20.089   1.304
   10   HD22  LEU 765          HD22      LEU 765  36.506 -20.042  -0.194
   11   HD21  LEU 765          HD23      LEU 765  34.826 -19.434  -0.193

  No H/Q in entry =          11
  In of MODEL   27
    1    HA   PRO 766           HA       PRO 766  33.968 -14.185   5.290
    2    HB2  PRO 766           HB2      PRO 766  34.888 -12.224   3.500
    3    HB3  PRO 766           HB3      PRO 766  35.730 -12.756   4.958
    4    HG2  PRO 766           HG2      PRO 766  36.087 -13.716   2.126
    5    HG3  PRO 766           HG3      PRO 766  37.341 -13.364   3.345
    6    HD2  PRO 766           HD2      PRO 766  36.652 -15.800   2.762
    7    HD3  PRO 766           HD3      PRO 766  36.846 -15.420   4.468

  No H/Q in entry =           7
  In of MODEL   27
    1    H    ALA 767           H        ALA 767  33.950 -14.466   1.790
    2    HA   ALA 767           HA       ALA 767  31.087 -14.086   1.778
    3    HB2  ALA 767           HB1      ALA 767  32.898 -12.546  -0.056
    4    HB1  ALA 767           HB2      ALA 767  31.954 -11.838   1.277
    5    HB3  ALA 767           HB3      ALA 767  31.138 -12.597  -0.100

  No H/Q in entry =           5
  In of MODEL   27
    1    H    SER 768           H        SER 768  30.903 -16.133   1.407
    2    HA   SER 768           HA       SER 768  32.107 -17.278  -0.913
    3    HB2  SER 768           HB2      SER 768  29.988 -18.337   0.976
    4    HB3  SER 768           HB3      SER 768  30.857 -19.273  -0.240
    5    HG   SER 768           HG       SER 768  32.211 -19.605   1.224

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA 769           H        ALA 769  28.902 -16.501   0.290
    2    HA   ALA 769           HA       ALA 769  27.629 -16.766  -2.268
    3    HB2  ALA 769           HB1      ALA 769  26.588 -15.798   0.402
    4    HB3  ALA 769           HB2      ALA 769  26.508 -17.457  -0.189
    5    HB1  ALA 769           HB3      ALA 769  25.599 -16.187  -1.006

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLU 770           H        GLU 770  25.811 -14.571  -1.873
    2    HA   GLU 770           HA       GLU 770  27.294 -12.445  -3.103
    3    HB2  GLU 770           HB2      GLU 770  25.143 -11.292  -3.150
    4    HB3  GLU 770           HB3      GLU 770  25.002 -12.933  -3.785
    5    HG2  GLU 770           HG2      GLU 770  23.667 -13.625  -2.091
    6    HG3  GLU 770           HG3      GLU 770  24.495 -12.631  -0.903

  No H/Q in entry =           6
  In of MODEL   27
    1    H    LYS 771           H        LYS 771  27.152 -10.314  -2.438
    2    HA   LYS 771           HA       LYS 771  26.693  -9.716   0.383
    3    HB2  LYS 771           HB2      LYS 771  28.749  -8.537  -1.514
    4    HB3  LYS 771           HB3      LYS 771  28.192  -7.806  -0.011
    5    HG2  LYS 771           HG2      LYS 771  29.590 -10.479  -0.153
    6    HG3  LYS 771           HG3      LYS 771  30.429  -8.955   0.129
    7    HD2  LYS 771           HD2      LYS 771  30.109  -9.615   2.303
    8    HD3  LYS 771           HD3      LYS 771  28.612  -8.728   2.058
    9    HE2  LYS 771           HE2      LYS 771  27.556 -10.975   1.434
   10    HE3  LYS 771           HE3      LYS 771  29.047 -11.694   1.955
   11    HZ3  LYS 771           HZ1      LYS 771  27.408 -11.725   3.727
   12    HZ2  LYS 771           HZ2      LYS 771  27.318 -10.045   3.724
   13    HZ1  LYS 771           HZ3      LYS 771  28.741 -10.804   4.167

  No H/Q in entry =          13
  In of MODEL   27
    1    H    ALA 772           H        ALA 772  24.916  -8.669   0.396
    2    HA   ALA 772           HA       ALA 772  23.465  -7.977  -1.918
    3    HB2  ALA 772           HB1      ALA 772  22.994  -6.940   0.864
    4    HB3  ALA 772           HB2      ALA 772  22.452  -8.506   0.234
    5    HB1  ALA 772           HB3      ALA 772  21.852  -7.008  -0.489

  No H/Q in entry =           5
  In of MODEL   27
    1    H    CYS 773           H        CYS 773  24.157  -6.756  -3.225
    2    HA   CYS 773           HA       CYS 773  23.918  -4.152  -3.611
    3    HB2  CYS 773           HB2      CYS 773  25.507  -3.681  -1.689
    4    HB3  CYS 773           HB3      CYS 773  26.759  -4.559  -2.563

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLY 774           H        GLY 774  26.182  -6.807  -3.709
    2    HA3  GLY 774           HA2      GLY 774  26.995  -8.008  -5.468
    3    HA2  GLY 774           HA3      GLY 774  26.021  -7.025  -6.547

  No H/Q in entry =           3
  In of MODEL   27
    1    H    ALA 775           H        ALA 775  28.282  -5.564  -4.335
    2    HA   ALA 775           HA       ALA 775  30.108  -5.088  -6.521
    3    HB1  ALA 775           HB1      ALA 775  29.052  -3.060  -4.543
    4    HB2  ALA 775           HB2      ALA 775  28.674  -3.117  -6.259
    5    HB3  ALA 775           HB3      ALA 775  30.317  -2.751  -5.734

  No H/Q in entry =           5
  In of MODEL   27
    1    H    CYS 776           H        CYS 776  31.778  -3.552  -4.991
    2    HA   CYS 776           HA       CYS 776  33.350  -3.459  -3.488
    3    HB2  CYS 776           HB2      CYS 776  32.316  -6.036  -2.249
    4    HB3  CYS 776           HB3      CYS 776  33.787  -5.239  -1.688

  No H/Q in entry =           4
  In of MODEL   27
    1    HA   PRO 777           HA       PRO 777  36.271  -6.587  -5.304
    2    HB2  PRO 777           HB2      PRO 777  34.715  -8.792  -6.493
    3    HB3  PRO 777           HB3      PRO 777  36.141  -8.874  -5.453
    4    HG2  PRO 777           HG2      PRO 777  33.766  -9.606  -4.518
    5    HG3  PRO 777           HG3      PRO 777  34.896  -8.695  -3.508
    6    HD2  PRO 777           HD2      PRO 777  32.553  -7.654  -5.074
    7    HD3  PRO 777           HD3      PRO 777  32.986  -7.373  -3.371

  No H/Q in entry =           7
  In of MODEL   27
    1    H    LEU 778           H        LEU 778  36.984  -6.571  -7.356
    2    HA   LEU 778           HA       LEU 778  36.125  -4.834  -9.208
    3    HB2  LEU 778           HB2      LEU 778  37.622  -6.089 -10.824
    4    HB3  LEU 778           HB3      LEU 778  38.281  -5.500  -9.304
    5    HG   LEU 778           HG       LEU 778  37.335  -8.297  -9.238
    6   HD12  LEU 778          HD11      LEU 778  39.877  -7.582 -10.710
    7   HD11  LEU 778          HD12      LEU 778  38.383  -8.239 -11.428
    8   HD13  LEU 778          HD13      LEU 778  39.277  -9.186 -10.242
    9   HD21  LEU 778          HD21      LEU 778  39.841  -6.920  -8.303
   10   HD23  LEU 778          HD22      LEU 778  39.433  -8.601  -7.991
   11   HD22  LEU 778          HD23      LEU 778  38.456  -7.329  -7.290

  No H/Q in entry =          11
  In of MODEL   27
    1    H    TRP 779           H        TRP 779  35.142  -8.248  -9.206
    2    HA   TRP 779           HA       TRP 779  33.702  -7.833 -11.723
    3    HB2  TRP 779           HB2      TRP 779  33.366 -10.314 -11.670
    4    HB3  TRP 779           HB3      TRP 779  35.067  -9.856 -11.646
    5    HD1  TRP 779           HD1      TRP 779  32.336 -11.266  -9.358
    6    HE1  TRP 779           HE1      TRP 779  33.438 -12.361  -7.332
    7    HE3  TRP 779           HE3      TRP 779  37.162 -10.037 -10.302
    8    HZ2  TRP 779           HZ2      TRP 779  36.045 -12.650  -6.274
    9    HZ3  TRP 779           HZ3      TRP 779  38.890 -10.788  -8.707
   10    HH2  TRP 779           HH2      TRP 779  38.324 -12.056  -6.770

  No H/Q in entry =          10
  In of MODEL   27
    1    H    GLY 780           H        GLY 780  33.119  -7.349  -8.554
    2    HA3  GLY 780           HA2      GLY 780  31.113  -6.891  -7.511
    3    HA2  GLY 780           HA3      GLY 780  30.259  -7.726  -8.814

  No H/Q in entry =           3
  In of MODEL   27
    1    H    LYS 781           H        LYS 781  29.087  -9.011  -7.389
    2    HA   LYS 781           HA       LYS 781  30.333 -11.457  -6.934
    3    HB2  LYS 781           HB2      LYS 781  29.943  -9.785  -4.587
    4    HB3  LYS 781           HB3      LYS 781  29.333 -11.432  -4.389
    5    HG2  LYS 781           HG2      LYS 781  32.143 -10.519  -5.012
    6    HG3  LYS 781           HG3      LYS 781  31.613 -11.311  -3.521
    7    HD2  LYS 781           HD2      LYS 781  31.737 -12.596  -6.295
    8    HD3  LYS 781           HD3      LYS 781  32.921 -12.790  -5.030
    9    HE2  LYS 781           HE2      LYS 781  30.034 -13.604  -4.691
   10    HE3  LYS 781           HE3      LYS 781  31.269 -14.685  -5.323
   11    HZ2  LYS 781           HZ1      LYS 781  31.245 -13.455  -2.609
   12    HZ1  LYS 781           HZ2      LYS 781  32.496 -14.378  -3.243
   13    HZ3  LYS 781           HZ3      LYS 781  30.993 -15.080  -3.001

  No H/Q in entry =          13
  In of MODEL   27
    1    H    CYS 782           H        CYS 782  29.078 -12.880  -7.479
    2    HA   CYS 782           HA       CYS 782  26.390 -12.919  -6.501
    3    HB2  CYS 782           HB2      CYS 782  26.204 -11.857  -8.760
    4    HB3  CYS 782           HB3      CYS 782  27.014 -13.258  -9.454

  No H/Q in entry =           4
  In of MODEL   27
    1    H    ASP 783           H        ASP 783  25.862 -14.902  -5.930
    2    HA   ASP 783           HA       ASP 783  26.819 -17.306  -6.977
    3    HB2  ASP 783           HB2      ASP 783  28.892 -16.472  -5.670
    4    HB3  ASP 783           HB3      ASP 783  27.902 -16.583  -4.224

  No H/Q in entry =           4
  In of MODEL   27
    1    H    ALA 784           H        ALA 784  24.637 -17.466  -6.978
    2    HA   ALA 784           HA       ALA 784  22.526 -17.710  -6.341
    3    HB1  ALA 784           HB1      ALA 784  23.347 -19.454  -4.756
    4    HB3  ALA 784           HB2      ALA 784  21.960 -18.581  -4.107
    5    HB2  ALA 784           HB3      ALA 784  23.584 -18.204  -3.532

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLU 785           H        GLU 785  20.804 -16.679  -4.725
    2    HA   GLU 785           HA       GLU 785  21.838 -14.046  -4.087
    3    HB2  GLU 785           HB2      GLU 785  19.718 -13.020  -4.856
    4    HB3  GLU 785           HB3      GLU 785  20.713 -13.689  -6.135
    5    HG2  GLU 785           HG2      GLU 785  19.246 -15.560  -6.370
    6    HG3  GLU 785           HG3      GLU 785  18.334 -15.073  -4.937

  No H/Q in entry =           6
  In of MODEL   27
    1    H    SER 786           H        SER 786  21.054 -13.025  -2.472
    2    HA   SER 786           HA       SER 786  19.123 -14.391  -0.762
    3    HB2  SER 786           HB2      SER 786  21.404 -14.720   0.114
    4    HB3  SER 786           HB3      SER 786  21.692 -12.988   0.072
    5    HG   SER 786           HG       SER 786  20.434 -12.709   1.753

  No H/Q in entry =           5
  In of MODEL   27
    1    H    SER 787           H        SER 787  20.546 -11.408  -2.011
    2    HA   SER 787           HA       SER 787  18.012 -10.147  -1.711
    3    HB2  SER 787           HB2      SER 787  19.028  -9.699   0.502
    4    HB3  SER 787           HB3      SER 787  20.404  -8.938  -0.297
    5    HG   SER 787           HG       SER 787  18.496  -7.651   0.533

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LYS 788           H        LYS 788  21.469  -9.289  -2.285
    2    HA   LYS 788           HA       LYS 788  20.680  -8.355  -4.888
    3    HB2  LYS 788           HB2      LYS 788  20.296  -6.398  -3.475
    4    HB3  LYS 788           HB3      LYS 788  21.941  -6.494  -2.875
    5    HG2  LYS 788           HG2      LYS 788  21.783  -4.735  -4.503
    6    HG3  LYS 788           HG3      LYS 788  22.770  -6.040  -5.155
    7    HD2  LYS 788           HD2      LYS 788  20.842  -6.835  -6.445
    8    HD3  LYS 788           HD3      LYS 788  19.868  -5.516  -5.791
    9    HE2  LYS 788           HE2      LYS 788  21.496  -3.910  -6.786
   10    HE3  LYS 788           HE3      LYS 788  22.328  -5.275  -7.517
   11    HZ1  LYS 788           HZ1      LYS 788  20.282  -5.795  -8.730
   12    HZ3  LYS 788           HZ2      LYS 788  20.828  -4.251  -9.080
   13    HZ2  LYS 788           HZ3      LYS 788  19.531  -4.461  -8.030

  No H/Q in entry =          13
  In of MODEL   27
    1    H    CYS 789           H        CYS 789  22.002  -9.138  -6.182
    2    HA   CYS 789           HA       CYS 789  24.848  -9.359  -5.594
    3    HB2  CYS 789           HB2      CYS 789  24.781 -11.645  -6.620
    4    HB3  CYS 789           HB3      CYS 789  23.918 -11.511  -5.084

  No H/Q in entry =           4
  In of MODEL   27
    1    H    VAL 790           H        VAL 790  26.163  -9.141  -7.464
    2    HA   VAL 790           HA       VAL 790  24.863  -8.567 -10.014
    3    HB   VAL 790           HB       VAL 790  26.628  -6.529  -8.564
    4   HG13  VAL 790          HG11      VAL 790  26.289  -5.046 -10.468
    5   HG12  VAL 790          HG12      VAL 790  25.399  -6.315 -11.310
    6   HG11  VAL 790          HG13      VAL 790  27.115  -6.531 -10.948
    7   HG23  VAL 790          HG21      VAL 790  23.771  -6.334  -9.427
    8   HG22  VAL 790          HG22      VAL 790  24.709  -5.050  -8.643
    9   HG21  VAL 790          HG23      VAL 790  24.331  -6.544  -7.771

  No H/Q in entry =           9
  In of MODEL   27
    1    H    CYS 791           H        CYS 791  26.363  -8.675 -11.746
    2    HA   CYS 791           HA       CYS 791  29.085  -9.498 -11.099
    3    HB2  CYS 791           HB2      CYS 791  28.912 -11.304 -12.821
    4    HB3  CYS 791           HB3      CYS 791  27.910 -11.573 -11.397

  No H/Q in entry =           4
  In of MODEL   27
    1    H    ARG 792           H        ARG 792  30.587  -8.841 -12.552
    2    HA   ARG 792           HA       ARG 792  29.741  -7.020 -14.693
    3    HB2  ARG 792           HB2      ARG 792  32.491  -7.633 -13.554
    4    HB3  ARG 792           HB3      ARG 792  32.127  -6.338 -14.671
    5    HG2  ARG 792           HG2      ARG 792  30.963  -6.524 -11.904
    6    HG3  ARG 792           HG3      ARG 792  32.443  -5.653 -12.286
    7    HD2  ARG 792           HD2      ARG 792  29.817  -5.080 -13.635
    8    HD3  ARG 792           HD3      ARG 792  30.315  -4.284 -12.142
    9    HE   ARG 792           HE       ARG 792  32.272  -4.108 -14.236
   10   HH11  ARG 792          HH11      ARG 792  29.337  -2.600 -12.952
   11   HH12  ARG 792          HH12      ARG 792  29.691  -1.055 -13.550
   12   HH21  ARG 792          HH21      ARG 792  32.783  -1.993 -15.053
   13   HH22  ARG 792          HH22      ARG 792  31.728  -0.697 -14.775

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLU 793           H        GLU 793  30.884  -7.375 -16.863
    2    HA   GLU 793           HA       GLU 793  31.344 -10.206 -17.433
    3    HB2  GLU 793           HB2      GLU 793  32.193  -8.008 -19.355
    4    HB3  GLU 793           HB3      GLU 793  31.701  -9.628 -19.691
    5    HG2  GLU 793           HG2      GLU 793  29.837  -7.439 -18.835
    6    HG3  GLU 793           HG3      GLU 793  30.077  -8.012 -20.474

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ALA 794           H        ALA 794  33.549 -10.603 -18.733
    2    HA   ALA 794           HA       ALA 794  35.699 -10.340 -16.889
    3    HB2  ALA 794           HB1      ALA 794  35.554 -12.151 -18.519
    4    HB3  ALA 794           HB2      ALA 794  37.058 -11.244 -18.684
    5    HB1  ALA 794           HB3      ALA 794  35.744 -10.987 -19.836

  No H/Q in entry =           5
  In of MODEL   27
    1    H    SER 795           H        SER 795  34.553  -8.402 -19.525
    2    HA   SER 795           HA       SER 795  36.965  -6.906 -19.747
    3    HB2  SER 795           HB2      SER 795  35.545  -5.733 -21.497
    4    HB3  SER 795           HB3      SER 795  35.896  -7.446 -21.763
    5    HG   SER 795           HG       SER 795  33.495  -6.202 -20.974

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLU 796           H        GLU 796  34.130  -6.722 -17.806
    2    HA   GLU 796           HA       GLU 796  34.016  -3.785 -17.969
    3    HB2  GLU 796           HB2      GLU 796  32.154  -5.579 -16.427
    4    HB3  GLU 796           HB3      GLU 796  31.898  -3.901 -16.866
    5    HG2  GLU 796           HG2      GLU 796  31.908  -6.298 -18.652
    6    HG3  GLU 796           HG3      GLU 796  30.529  -5.305 -18.209

  No H/Q in entry =           6
  In of MODEL   27
    1    H    CYS 797           H        CYS 797  35.900  -5.687 -16.407
    2    HA   CYS 797           HA       CYS 797  35.389  -4.742 -13.711
    3    HB2  CYS 797           HB2      CYS 797  37.515  -6.606 -14.764
    4    HB3  CYS 797           HB3      CYS 797  37.241  -6.227 -13.069

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLU 798           H        GLU 798  36.569  -3.251 -12.664
    2    HA   GLU 798           HA       GLU 798  38.346  -1.580 -14.216
    3    HB2  GLU 798           HB2      GLU 798  37.297  -1.344 -11.397
    4    HB3  GLU 798           HB3      GLU 798  38.262  -0.121 -12.202
    5    HG2  GLU 798           HG2      GLU 798  35.522  -1.062 -13.024
    6    HG3  GLU 798           HG3      GLU 798  35.909   0.469 -12.240

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU 799           H        GLU 799  39.086  -4.334 -13.111
    2    HA   GLU 799           HA       GLU 799  41.765  -3.716 -12.341
    3    HB2  GLU 799           HB2      GLU 799  40.675  -3.596 -10.124
    4    HB3  GLU 799           HB3      GLU 799  39.880  -5.127 -10.425
    5    HG2  GLU 799           HG2      GLU 799  41.754  -5.300  -8.829
    6    HG3  GLU 799           HG3      GLU 799  41.970  -6.310 -10.253

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLU 800           H        GLU 800  43.051  -5.622 -12.478
    2    HA   GLU 800           HA       GLU 800  41.965  -7.614 -14.343
    3    HB2  GLU 800           HB2      GLU 800  44.787  -7.252 -13.337
    4    HB3  GLU 800           HB3      GLU 800  44.263  -8.210 -14.707
    5    HG2  GLU 800           HG2      GLU 800  43.696  -6.240 -15.933
    6    HG3  GLU 800           HG3      GLU 800  44.061  -5.222 -14.532

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLY 801           H        GLY 801  43.643  -7.204 -11.281
    2    HA3  GLY 801           HA2      GLY 801  43.743  -8.520  -9.407
    3    HA2  GLY 801           HA3      GLY 801  42.695  -9.701 -10.193

  No H/Q in entry =           3
  In of MODEL   27
    1    H    PHE 802           H        PHE 802  44.144 -11.425  -9.531
    2    HA   PHE 802           HA       PHE 802  46.760 -11.386 -10.758
    3    HB2  PHE 802           HB2      PHE 802  45.368 -13.353  -8.964
    4    HB3  PHE 802           HB3      PHE 802  46.928 -13.685  -9.705
    5    HD1  PHE 802           HD1      PHE 802  48.903 -12.676  -8.902
    6    HD2  PHE 802           HD2      PHE 802  45.121 -11.527  -7.376
    7    HE1  PHE 802           HE1      PHE 802  49.998 -11.487  -7.086
    8    HE2  PHE 802           HE2      PHE 802  46.195 -10.335  -5.571
    9    HZ   PHE 802           HZ       PHE 802  48.660 -10.303  -5.396

  No H/Q in entry =           9
  In of MODEL   27
    1    H    SER 803           H        SER 803  47.264 -13.805 -11.603
    2    HA   SER 803           HA       SER 803  45.177 -14.471 -13.510
    3    HB2  SER 803           HB2      SER 803  48.138 -15.063 -13.789
    4    HB3  SER 803           HB3      SER 803  46.851 -15.117 -15.011
    5    HG   SER 803           HG       SER 803  46.703 -12.908 -14.977

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ILE 804           H        ILE 804  44.334 -16.401 -13.171
    2    HA   ILE 804           HA       ILE 804  45.738 -18.276 -11.413
    3    HB   ILE 804           HB       ILE 804  43.680 -18.908 -10.270
    4   HG12  ILE 804          HG12      ILE 804  42.056 -18.412 -12.137
    5   HG13  ILE 804          HG13      ILE 804  41.524 -17.870 -10.556
    6   HG23  ILE 804          HG21      ILE 804  43.202 -16.883  -8.964
    7   HG22  ILE 804          HG22      ILE 804  44.016 -15.918 -10.171
    8   HG21  ILE 804          HG23      ILE 804  44.932 -17.107  -9.239
    9   HD12  ILE 804          HD11      ILE 804  42.607 -16.156 -12.783
   10   HD11  ILE 804          HD12      ILE 804  42.216 -15.580 -11.168
   11   HD13  ILE 804          HD13      ILE 804  40.946 -16.240 -12.198

  No H/Q in entry =          11
  In of MODEL   27
    1    H    CYS 805           H        CYS 805  44.877 -20.535 -11.608
    2    HA   CYS 805           HA       CYS 805  44.424 -21.109 -14.441
    3    HB2  CYS 805           HB2      CYS 805  46.368 -22.181 -13.347
    4    HB3  CYS 805           HB3      CYS 805  45.271 -22.913 -12.181

  No H/Q in entry =           4
  In of MODEL   27
    1    H    VAL 806           H        VAL 806  42.468 -21.652 -15.034
    2    HA   VAL 806           HA       VAL 806  40.666 -22.791 -13.019
    3    HB   VAL 806           HB       VAL 806  39.940 -20.863 -15.208
    4   HG11  VAL 806          HG11      VAL 806  38.267 -22.029 -12.998
    5   HG13  VAL 806          HG12      VAL 806  38.132 -22.363 -14.718
    6   HG12  VAL 806          HG13      VAL 806  37.752 -20.747 -14.097
    7   HG23  VAL 806          HG21      VAL 806  39.468 -19.238 -13.432
    8   HG22  VAL 806          HG22      VAL 806  41.169 -19.694 -13.515
    9   HG21  VAL 806          HG23      VAL 806  40.138 -20.364 -12.247

  No H/Q in entry =           9
  In of MODEL   27
    1    H    GLU 807           H        GLU 807  39.642 -24.575 -13.628
    2    HA   GLU 807           HA       GLU 807  40.120 -25.637 -16.249
    3    HB2  GLU 807           HB2      GLU 807  40.202 -27.155 -14.303
    4    HB3  GLU 807           HB3      GLU 807  38.523 -26.770 -13.935
    5    HG2  GLU 807           HG2      GLU 807  37.816 -27.715 -16.016
    6    HG3  GLU 807           HG3      GLU 807  39.504 -28.060 -16.452

  No H/Q in entry =           6
  In of MODEL   27
    1    H    VAL 808           H        VAL 808  38.833 -25.467 -17.828
    2    HA   VAL 808           HA       VAL 808  36.052 -24.774 -17.514
    3    HB   VAL 808           HB       VAL 808  37.154 -22.594 -17.614
    4   HG12  VAL 808          HG11      VAL 808  38.451 -23.542 -20.163
    5   HG11  VAL 808          HG12      VAL 808  39.265 -23.222 -18.634
    6   HG13  VAL 808          HG13      VAL 808  38.526 -21.896 -19.532
    7   HG23  VAL 808          HG21      VAL 808  35.930 -23.260 -20.264
    8   HG22  VAL 808          HG22      VAL 808  36.126 -21.637 -19.597
    9   HG21  VAL 808          HG23      VAL 808  35.036 -22.798 -18.813

  No H/Q in entry =           9
  In of MODEL   27
    1    H    ASN 809           H        ASN 809  34.893 -25.932 -18.874
    2    HA   ASN 809           HA       ASN 809  34.268 -27.249 -20.591
    3    HB2  ASN 809           HB2      ASN 809  36.180 -25.388 -21.824
    4    HB3  ASN 809           HB3      ASN 809  35.769 -26.820 -22.776
    5   HD21  ASN 809          HD21      ASN 809  34.679 -23.813 -21.460
    6   HD22  ASN 809          HD22      ASN 809  33.165 -23.769 -22.271

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLY 810           H        GLY 810  36.428 -28.047 -18.770
    2    HA3  GLY 810           HA2      GLY 810  37.267 -30.130 -18.460
    3    HA2  GLY 810           HA3      GLY 810  37.157 -30.458 -20.204

  No H/Q in entry =           3
  In of MODEL   27
    1    H    LYS 811           H        LYS 811  38.543 -27.597 -20.127
    2    HA   LYS 811           HA       LYS 811  41.286 -28.670 -20.155
    3    HB2  LYS 811           HB2      LYS 811  40.051 -26.200 -21.366
    4    HB3  LYS 811           HB3      LYS 811  41.739 -26.662 -21.500
    5    HG2  LYS 811           HG2      LYS 811  41.196 -28.557 -22.838
    6    HG3  LYS 811           HG3      LYS 811  39.474 -28.358 -22.513
    7    HD2  LYS 811           HD2      LYS 811  40.108 -27.537 -24.747
    8    HD3  LYS 811           HD3      LYS 811  39.433 -26.274 -23.720
    9    HE2  LYS 811           HE2      LYS 811  41.704 -25.498 -23.194
   10    HE3  LYS 811           HE3      LYS 811  42.376 -26.744 -24.249
   11    HZ2  LYS 811           HZ1      LYS 811  42.242 -24.567 -25.289
   12    HZ1  LYS 811           HZ2      LYS 811  40.576 -24.549 -25.079
   13    HZ3  LYS 811           HZ3      LYS 811  41.286 -25.694 -26.105

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLU 812           H        GLU 812  42.922 -26.977 -19.383
    2    HA   GLU 812           HA       GLU 812  41.728 -25.270 -17.313
    3    HB2  GLU 812           HB2      GLU 812  44.485 -26.501 -17.373
    4    HB3  GLU 812           HB3      GLU 812  43.972 -25.303 -16.198
    5    HG2  GLU 812           HG2      GLU 812  42.271 -26.916 -15.392
    6    HG3  GLU 812           HG3      GLU 812  42.924 -28.110 -16.515

  No H/Q in entry =           6
  In of MODEL   27
    1    H    GLN 813           H        GLN 813  42.010 -23.177 -17.532
    2    HA   GLN 813           HA       GLN 813  44.083 -22.236 -19.398
    3    HB2  GLN 813           HB2      GLN 813  42.018 -22.183 -20.600
    4    HB3  GLN 813           HB3      GLN 813  41.168 -21.435 -19.255
    5    HG2  GLN 813           HG2      GLN 813  42.407 -19.423 -19.555
    6    HG3  GLN 813           HG3      GLN 813  43.359 -20.126 -20.884
    7   HE21  GLN 813          HE21      GLN 813  40.414 -18.727 -19.854
    8   HE22  GLN 813          HE22      GLN 813  39.650 -18.639 -21.395

  No H/Q in entry =           8
  In of MODEL   27
    1    H    THR 814           H        THR 814  45.090 -20.361 -18.793
    2    HA   THR 814           HA       THR 814  44.784 -19.479 -16.081
    3    HB   THR 814           HB       THR 814  46.356 -18.195 -18.319
    4    HG1  THR 814           HG1      THR 814  47.229 -20.145 -18.120
    5   HG23  THR 814          HG21      THR 814  47.713 -17.252 -16.507
    6   HG22  THR 814          HG22      THR 814  46.680 -18.057 -15.330
    7   HG21  THR 814          HG23      THR 814  46.014 -16.773 -16.347

  No H/Q in entry =           7
  In of MODEL   27
    1    H    MET 815           H        MET 815  43.408 -17.994 -15.478
    2    HA   MET 815           HA       MET 815  42.295 -16.107 -17.481
    3    HB2  MET 815           HB2      MET 815  40.940 -17.094 -14.989
    4    HB3  MET 815           HB3      MET 815  40.243 -16.113 -16.276
    5    HG2  MET 815           HG2      MET 815  40.862 -18.253 -17.716
    6    HG3  MET 815           HG3      MET 815  40.812 -18.921 -16.077
    7    HE3  MET 815           HE1      MET 815  37.528 -20.072 -17.863
    8    HE2  MET 815           HE2      MET 815  39.041 -20.601 -17.115
    9    HE1  MET 815           HE3      MET 815  39.090 -19.692 -18.614

  No H/Q in entry =           9
  In of MODEL   27
    1    H    SER 816           H        SER 816  41.518 -14.208 -16.432
    2    HA   SER 816           HA       SER 816  43.483 -13.254 -14.523
    3    HB2  SER 816           HB2      SER 816  41.261 -11.740 -15.931
    4    HB3  SER 816           HB3      SER 816  42.719 -11.067 -15.187
    5    HG   SER 816           HG       SER 816  42.320 -12.259 -17.635

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLU 817           H        GLU 817  42.654 -12.274 -12.573
    2    HA   GLU 817           HA       GLU 817  40.868 -13.700 -11.065
    3    HB2  GLU 817           HB2      GLU 817  42.543 -11.751 -10.566
    4    HB3  GLU 817           HB3      GLU 817  41.078 -10.783 -10.751
    5    HG2  GLU 817           HG2      GLU 817  40.869 -11.105  -8.564
    6    HG3  GLU 817           HG3      GLU 817  40.239 -12.684  -9.080

  No H/Q in entry =           6
  In of MODEL   27
    1    H    CYS 818           H        CYS 818  40.312 -10.886 -13.119
    2    HA   CYS 818           HA       CYS 818  37.731 -10.225 -12.288
    3    HB2  CYS 818           HB2      CYS 818  37.663  -8.972 -14.474
    4    HB3  CYS 818           HB3      CYS 818  39.025  -8.585 -13.438

  No H/Q in entry =           4
  In of MODEL   27
    1    H    GLU 819           H        GLU 819  38.670 -11.664 -15.303
    2    HA   GLU 819           HA       GLU 819  36.235 -12.521 -16.212
    3    HB2  GLU 819           HB2      GLU 819  37.638 -14.219 -17.641
    4    HB3  GLU 819           HB3      GLU 819  38.025 -12.493 -17.661
    5    HG2  GLU 819           HG2      GLU 819  39.634 -12.722 -16.311
    6    HG3  GLU 819           HG3      GLU 819  39.409 -14.484 -16.155

  No H/Q in entry =           6
  In of MODEL   27
    1    H    ALA 820           H        ALA 820  38.550 -14.628 -14.573
    2    HA   ALA 820           HA       ALA 820  37.086 -16.888 -14.465
    3    HB2  ALA 820           HB1      ALA 820  38.664 -17.452 -12.739
    4    HB3  ALA 820           HB2      ALA 820  38.945 -15.691 -12.526
    5    HB1  ALA 820           HB3      ALA 820  39.341 -16.444 -14.059

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLY 821           H        GLY 821  37.192 -14.184 -12.103
    2    HA3  GLY 821           HA2      GLY 821  35.349 -15.353 -10.278
    3    HA2  GLY 821           HA3      GLY 821  35.866 -13.667 -10.312

  No H/Q in entry =           3
  In of MODEL   27
    1    H    ALA 822           H        ALA 822  35.069 -13.000 -12.864
    2    HA   ALA 822           HA       ALA 822  32.382 -12.314 -12.521
    3    HB1  ALA 822           HB1      ALA 822  34.034 -12.373 -15.045
    4    HB2  ALA 822           HB2      ALA 822  33.899 -11.037 -13.899
    5    HB3  ALA 822           HB3      ALA 822  32.475 -11.551 -14.820

  No H/Q in entry =           5
  In of MODEL   27
    1    H    LEU 823           H        LEU 823  33.933 -14.837 -14.400
    2    HA   LEU 823           HA       LEU 823  31.641 -15.849 -15.593
    3    HB2  LEU 823           HB2      LEU 823  34.253 -17.180 -14.911
    4    HB3  LEU 823           HB3      LEU 823  32.985 -17.984 -15.823
    5    HG   LEU 823           HG       LEU 823  34.307 -15.412 -16.685
    6   HD12  LEU 823          HD11      LEU 823  34.847 -18.209 -17.669
    7   HD11  LEU 823          HD12      LEU 823  35.921 -17.225 -16.665
    8   HD13  LEU 823          HD13      LEU 823  35.539 -16.703 -18.297
    9   HD22  LEU 823          HD21      LEU 823  32.103 -15.648 -17.608
   10   HD21  LEU 823          HD22      LEU 823  32.411 -17.309 -18.069
   11   HD23  LEU 823          HD23      LEU 823  33.278 -15.992 -18.876

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ARG 824           H        ARG 824  33.223 -16.691 -12.541
    2    HA   ARG 824           HA       ARG 824  31.486 -18.735 -11.703
    3    HB2  ARG 824           HB2      ARG 824  33.027 -16.686 -10.095
    4    HB3  ARG 824           HB3      ARG 824  32.157 -18.026  -9.369
    5    HG2  ARG 824           HG2      ARG 824  33.631 -19.604 -10.484
    6    HG3  ARG 824           HG3      ARG 824  34.443 -18.272 -11.313
    7    HD2  ARG 824           HD2      ARG 824  35.699 -19.116  -9.363
    8    HD3  ARG 824           HD3      ARG 824  35.276 -17.412  -9.240
    9    HE   ARG 824           HE       ARG 824  33.250 -18.562  -7.951
   10   HH11  ARG 824          HH11      ARG 824  36.728 -19.183  -7.576
   11   HH12  ARG 824          HH12      ARG 824  36.598 -19.600  -5.928
   12   HH21  ARG 824          HH21      ARG 824  33.116 -19.047  -5.727
   13   HH22  ARG 824          HH22      ARG 824  34.491 -19.461  -4.828

  No H/Q in entry =          13
  In of MODEL   27
    1    H    CYS 825           H        CYS 825  31.425 -15.299 -11.283
    2    HA   CYS 825           HA       CYS 825  29.083 -15.137  -9.740
    3    HB2  CYS 825           HB2      CYS 825  30.875 -13.262 -11.113
    4    HB3  CYS 825           HB3      CYS 825  29.356 -12.642 -10.522

  No H/Q in entry =           4
  In of MODEL   27
    1    H    ARG 826           H        ARG 826  29.474 -15.383 -13.181
    2    HA   ARG 826           HA       ARG 826  26.864 -14.157 -13.542
    3    HB2  ARG 826           HB2      ARG 826  27.233 -14.272 -15.883
    4    HB3  ARG 826           HB3      ARG 826  28.654 -13.562 -15.116
    5    HG2  ARG 826           HG2      ARG 826  29.808 -15.677 -15.364
    6    HG3  ARG 826           HG3      ARG 826  28.373 -16.391 -16.089
    7    HD2  ARG 826           HD2      ARG 826  29.944 -14.071 -17.197
    8    HD3  ARG 826           HD3      ARG 826  29.884 -15.710 -17.862
    9    HE   ARG 826           HE       ARG 826  27.391 -15.242 -17.981
   10   HH11  ARG 826          HH11      ARG 826  29.932 -12.896 -18.708
   11   HH12  ARG 826          HH12      ARG 826  28.914 -11.815 -19.542
   12   HH21  ARG 826          HH21      ARG 826  26.015 -13.847 -19.144
   13   HH22  ARG 826          HH22      ARG 826  26.609 -12.410 -19.868

  No H/Q in entry =          13
  In of MODEL   27
    1    H    GLY 827           H        GLY 827  28.116 -17.170 -12.989
    2    HA3  GLY 827           HA2      GLY 827  26.470 -18.959 -12.681
    3    HA2  GLY 827           HA3      GLY 827  25.676 -18.337 -14.125

  No H/Q in entry =           3
  In of MODEL   27
    1    H    GLN 828           H        GLN 828  28.708 -18.098 -14.989
    2    HA   GLN 828           HA       GLN 828  28.651 -20.396 -16.656
    3    HB2  GLN 828           HB2      GLN 828  29.843 -18.355 -17.344
    4    HB3  GLN 828           HB3      GLN 828  30.957 -18.546 -16.002
    5    HG2  GLN 828           HG2      GLN 828  31.999 -19.290 -18.085
    6    HG3  GLN 828           HG3      GLN 828  31.779 -20.630 -16.969
    7   HE21  GLN 828          HE21      GLN 828  29.184 -19.256 -18.883
    8   HE22  GLN 828          HE22      GLN 828  28.966 -20.632 -19.891

  No H/Q in entry =           8
  In of MODEL   27
    1    H    SER 829           H        SER 829  29.697 -22.382 -16.429
    2    HA   SER 829           HA       SER 829  30.590 -22.935 -13.726
    3    HB2  SER 829           HB2      SER 829  30.197 -24.877 -16.000
    4    HB3  SER 829           HB3      SER 829  30.329 -25.249 -14.284
    5    HG   SER 829           HG       SER 829  28.385 -23.489 -14.518

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ILE 830           H        ILE 830  32.580 -22.626 -13.306
    2    HA   ILE 830           HA       ILE 830  34.648 -23.739 -14.982
    3    HB   ILE 830           HB       ILE 830  36.104 -21.788 -14.777
    4   HG12  ILE 830          HG12      ILE 830  35.122 -20.868 -12.664
    5   HG13  ILE 830          HG13      ILE 830  35.455 -19.618 -13.838
    6   HG22  ILE 830          HG21      ILE 830  35.013 -20.190 -16.297
    7   HG21  ILE 830          HG22      ILE 830  33.498 -21.065 -16.011
    8   HG23  ILE 830          HG23      ILE 830  34.849 -21.884 -16.789
    9   HD11  ILE 830          HD11      ILE 830  33.061 -19.643 -14.440
   10   HD13  ILE 830          HD12      ILE 830  33.370 -19.194 -12.765
   11   HD12  ILE 830          HD13      ILE 830  32.788 -20.812 -13.152

  No H/Q in entry =          11
  In of MODEL   27
    1    H    SER 831           H        SER 831  36.485 -24.251 -13.702
    2    HA   SER 831           HA       SER 831  35.899 -24.216 -10.829
    3    HB2  SER 831           HB2      SER 831  37.228 -26.265 -12.551
    4    HB3  SER 831           HB3      SER 831  37.061 -26.393 -10.813
    5    HG   SER 831           HG       SER 831  34.663 -25.858 -11.849

  No H/Q in entry =           5
  In of MODEL   27
    1    H    VAL 832           H        VAL 832  37.382 -22.697  -9.971
    2    HA   VAL 832           HA       VAL 832  39.942 -22.463 -11.220
    3    HB   VAL 832           HB       VAL 832  39.136 -20.429 -10.201
    4   HG12  VAL 832          HG11      VAL 832  39.157 -21.840  -7.545
    5   HG11  VAL 832          HG12      VAL 832  37.727 -21.328  -8.442
    6   HG13  VAL 832          HG13      VAL 832  38.840 -20.122  -7.791
    7   HG22  VAL 832          HG21      VAL 832  41.033 -19.774  -8.773
    8   HG21  VAL 832          HG22      VAL 832  41.540 -20.670 -10.205
    9   HG23  VAL 832          HG23      VAL 832  41.488 -21.472  -8.636

  No H/Q in entry =           9
  In of MODEL   27
    1    H    THR 833           H        THR 833  41.278 -24.014 -11.218
    2    HA   THR 833           HA       THR 833  41.236 -25.987  -9.155
    3    HB   THR 833           HB       THR 833  42.989 -27.070 -10.637
    4    HG1  THR 833           HG1      THR 833  43.271 -26.136 -12.695
    5   HG23  THR 833          HG21      THR 833  40.609 -27.640 -10.862
    6   HG22  THR 833          HG22      THR 833  41.379 -27.604 -12.453
    7   HG21  THR 833          HG23      THR 833  40.375 -26.262 -11.935

  No H/Q in entry =           7
  In of MODEL   27
    1    H    SER 834           H        SER 834  43.342 -23.415 -10.236
    2    HA   SER 834           HA       SER 834  44.922 -23.735  -7.809
    3    HB2  SER 834           HB2      SER 834  46.197 -23.544 -10.547
    4    HB3  SER 834           HB3      SER 834  47.021 -23.651  -9.000
    5    HG   SER 834           HG       SER 834  45.761 -25.605 -10.498

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ILE 835           H        ILE 835  45.714 -21.781  -7.082
    2    HA   ILE 835           HA       ILE 835  44.655 -19.472  -8.401
    3    HB   ILE 835           HB       ILE 835  45.587 -18.182  -6.467
    4   HG12  ILE 835          HG12      ILE 835  46.119 -19.636  -4.408
    5   HG13  ILE 835          HG13      ILE 835  46.442 -20.931  -5.547
    6   HG23  ILE 835          HG21      ILE 835  43.973 -19.007  -4.887
    7   HG22  ILE 835          HG22      ILE 835  43.827 -20.501  -5.822
    8   HG21  ILE 835          HG23      ILE 835  43.311 -18.968  -6.532
    9   HD13  ILE 835          HD11      ILE 835  48.480 -19.844  -4.825
   10   HD12  ILE 835          HD12      ILE 835  47.838 -18.293  -5.389
   11   HD11  ILE 835          HD13      ILE 835  48.203 -19.569  -6.554

  No H/Q in entry =          11
  In of MODEL   27
    1    H    ARG 836           H        ARG 836  47.194 -21.181  -9.056
    2    HA   ARG 836           HA       ARG 836  49.144 -19.047  -9.531
    3    HB2  ARG 836           HB2      ARG 836  49.303 -22.012 -10.052
    4    HB3  ARG 836           HB3      ARG 836  50.620 -20.861 -10.185
    5    HG2  ARG 836           HG2      ARG 836  50.593 -20.505  -7.807
    6    HG3  ARG 836           HG3      ARG 836  49.186 -21.564  -7.645
    7    HD2  ARG 836           HD2      ARG 836  50.514 -23.361  -8.689
    8    HD3  ARG 836           HD3      ARG 836  51.922 -22.309  -8.607
    9    HE   ARG 836           HE       ARG 836  51.747 -22.323  -6.232
   10   HH11  ARG 836          HH11      ARG 836  49.963 -24.921  -7.914
   11   HH12  ARG 836          HH12      ARG 836  49.845 -25.921  -6.556
   12   HH21  ARG 836          HH21      ARG 836  51.567 -23.747  -4.331
   13   HH22  ARG 836          HH22      ARG 836  50.768 -25.218  -4.480

  No H/Q in entry =          13
  In of MODEL   27
    1    HA   PRO 837           HA       PRO 837  47.738 -19.097 -13.816
    2    HB2  PRO 837           HB2      PRO 837  50.079 -18.335 -15.040
    3    HB3  PRO 837           HB3      PRO 837  48.988 -17.187 -14.261
    4    HG2  PRO 837           HG2      PRO 837  51.515 -18.405 -13.227
    5    HG3  PRO 837           HG3      PRO 837  50.923 -16.743 -13.058
    6    HD2  PRO 837           HD2      PRO 837  50.734 -18.565 -11.069
    7    HD3  PRO 837           HD3      PRO 837  49.521 -17.291 -11.307

  No H/Q in entry =           7
  In of MODEL   27
    1    H    CYS 838           H        CYS 838  47.891 -20.655 -15.522
    2    HA   CYS 838           HA       CYS 838  49.703 -22.788 -14.829
    3    HB2  CYS 838           HB2      CYS 838  48.364 -24.151 -16.485
    4    HB3  CYS 838           HB3      CYS 838  47.446 -23.626 -15.092

  No H/Q in entry =           4
  In of MODEL   27
    1    H    ALA 839           H        ALA 839  50.203 -24.081 -17.215
    2    HA   ALA 839           HA       ALA 839  51.878 -22.172 -18.578
    3    HB3  ALA 839           HB1      ALA 839  52.710 -24.429 -18.098
    4    HB2  ALA 839           HB2      ALA 839  52.672 -24.127 -19.837
    5    HB1  ALA 839           HB3      ALA 839  51.423 -25.120 -19.085

  No H/Q in entry =           5
  In of MODEL   27
    1    H    ALA 840           H        ALA 840  48.752 -23.125 -18.732
    2    HA   ALA 840           HA       ALA 840  48.381 -22.756 -21.574
    3    HB2  ALA 840           HB1      ALA 840  46.467 -23.257 -19.314
    4    HB1  ALA 840           HB2      ALA 840  47.028 -24.446 -20.491
    5    HB3  ALA 840           HB3      ALA 840  45.983 -23.110 -21.003

  No H/Q in entry =           5
  In of MODEL   27
    1    H    GLU 841           H        GLU 841  49.401 -20.680 -21.356
    2    HA   GLU 841           HA       GLU 841  47.393 -18.617 -21.091
    3    HB2  GLU 841           HB2      GLU 841  49.095 -17.143 -19.935
    4    HB3  GLU 841           HB3      GLU 841  48.360 -18.404 -18.957
    5    HG2  GLU 841           HG2      GLU 841  50.676 -18.279 -18.377
    6    HG3  GLU 841           HG3      GLU 841  50.439 -19.758 -19.285

  No H/Q in entry =           6
  In of MODEL   27
    1    H    THR 842           H        THR 842  48.802 -20.081 -23.097
    2    HA   THR 842           HA       THR 842  50.938 -18.867 -24.326
    3    HB   THR 842           HB       THR 842  48.665 -20.266 -25.713
    4    HG1  THR 842           HG1      THR 842  50.899 -21.249 -24.247
    5   HG22  THR 842          HG21      THR 842  51.642 -20.138 -26.278
    6   HG21  THR 842          HG22      THR 842  50.391 -19.292 -27.190
    7   HG23  THR 842          HG23      THR 842  50.459 -21.054 -27.216

  No H/Q in entry =           7
  In of MODEL   27
    1    H    GLN 843           H        GLN 843  51.111 -16.914 -25.083
    2    HA   GLN 843           HA       GLN 843  49.159 -15.803 -26.880
    3    HB2  GLN 843           HB2      GLN 843  48.462 -14.947 -24.655
    4    HB3  GLN 843           HB3      GLN 843  50.083 -14.339 -24.385
    5    HG2  GLN 843           HG2      GLN 843  49.771 -12.906 -26.420
    6    HG3  GLN 843           HG3      GLN 843  48.079 -13.394 -26.409
    7   HE21  GLN 843          HE21      GLN 843  48.001 -13.437 -23.466
    8   HE22  GLN 843          HE22      GLN 843  47.965 -11.782 -22.987

  No H/Q in entry =           8
  In of MODEL   28
    1    H1   GLY 689           H2       GLY 689  66.936   2.845 -19.953
    2    H2   GLY 689           H1       GLY 689  68.464   2.349 -19.481
    3    H3   GLY 689           H3       GLY 689  67.495   1.305 -20.393
    4    HA2  GLY 689           HA2      GLY 689  67.575   0.703 -18.040
    5    HA3  GLY 689           HA3      GLY 689  65.948   1.113 -18.577

  No H/Q in entry =           5
  In of MODEL   28
    1    H    SER 690           H        SER 690  66.100   1.322 -15.984
    2    HA   SER 690           HA       SER 690  65.725   4.081 -15.515
    3    HB2  SER 690           HB2      SER 690  65.664   1.753 -13.591
    4    HB3  SER 690           HB3      SER 690  65.079   3.381 -13.236
    5    HG   SER 690           HG       SER 690  63.309   2.440 -13.900

  No H/Q in entry =           5
  In of MODEL   28
    1    H    HIS 691           H        HIS 691  68.361   2.279 -15.485
    2    HA   HIS 691           HA       HIS 691  69.936   3.463 -13.424
    3    HB2  HIS 691           HB2      HIS 691  70.584   1.352 -14.562
    4    HB3  HIS 691           HB3      HIS 691  70.818   2.248 -16.052
    5    HD1  HIS 691           HD1      HIS 691  72.428   1.522 -12.759
    6    HD2  HIS 691           HD2      HIS 691  73.232   3.674 -16.210
    7    HE1  HIS 691           HE1      HIS 691  74.849   2.072 -12.651
    8    HE2  HIS 691           HE2      HIS 691  75.353   3.066 -14.891

  No H/Q in entry =           8
  In of MODEL   28
    1    H    MET 692           H        MET 692  69.091   4.351 -16.681
    2    HA   MET 692           HA       MET 692  70.886   6.627 -16.776
    3    HB2  MET 692           HB2      MET 692  68.495   5.995 -18.528
    4    HB3  MET 692           HB3      MET 692  69.692   7.235 -18.832
    5    HG2  MET 692           HG2      MET 692  71.396   5.479 -19.114
    6    HG3  MET 692           HG3      MET 692  70.142   4.269 -18.841
    7    HE2  MET 692           HE1      MET 692  70.331   7.097 -22.479
    8    HE1  MET 692           HE2      MET 692  71.542   7.042 -21.198
    9    HE3  MET 692           HE3      MET 692  69.934   7.684 -20.866

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ASN 693           H        ASN 693  67.389   6.122 -16.773
    2    HA   ASN 693           HA       ASN 693  66.845   8.073 -14.809
    3    HB2  ASN 693           HB2      ASN 693  67.297   9.475 -16.906
    4    HB3  ASN 693           HB3      ASN 693  65.981   8.622 -17.686
    5   HD21  ASN 693          HD21      ASN 693  66.413  11.462 -17.088
    6   HD22  ASN 693          HD22      ASN 693  65.030  11.980 -16.195

  No H/Q in entry =           6
  In of MODEL   28
    1    HA   PRO 694           HA       PRO 694  63.746   4.812 -14.563
    2    HB2  PRO 694           HB2      PRO 694  61.789   6.385 -13.310
    3    HB3  PRO 694           HB3      PRO 694  63.020   5.423 -12.490
    4    HG2  PRO 694           HG2      PRO 694  62.997   8.333 -13.122
    5    HG3  PRO 694           HG3      PRO 694  63.642   7.501 -11.696
    6    HD2  PRO 694           HD2      PRO 694  65.242   8.439 -13.600
    7    HD3  PRO 694           HD3      PRO 694  65.600   6.892 -12.795

  No H/Q in entry =           7
  In of MODEL   28
    1    H    LEU 695           H        LEU 695  62.393   4.152 -16.063
    2    HA   LEU 695           HA       LEU 695  61.575   5.902 -18.122
    3    HB2  LEU 695           HB2      LEU 695  60.769   3.032 -17.628
    4    HB3  LEU 695           HB3      LEU 695  60.306   3.953 -19.035
    5    HG   LEU 695           HG       LEU 695  62.053   2.544 -19.708
    6   HD13  LEU 695          HD11      LEU 695  63.813   4.040 -20.423
    7   HD12  LEU 695          HD12      LEU 695  63.261   5.253 -19.278
    8   HD11  LEU 695          HD13      LEU 695  62.217   4.767 -20.615
    9   HD21  LEU 695          HD21      LEU 695  63.670   3.532 -17.368
   10   HD23  LEU 695          HD22      LEU 695  64.248   2.446 -18.630
   11   HD22  LEU 695          HD23      LEU 695  62.961   1.927 -17.540

  No H/Q in entry =          11
  In of MODEL   28
    1    H    THR 696           H        THR 696  60.019   7.252 -18.033
    2    HA   THR 696           HA       THR 696  57.828   6.757 -16.241
    3    HB   THR 696           HB       THR 696  57.212   9.173 -17.138
    4    HG1  THR 696           HG1      THR 696  60.036   9.214 -17.543
    5   HG21  THR 696          HG21      THR 696  59.582   8.657 -15.327
    6   HG23  THR 696          HG22      THR 696  57.891   8.660 -14.832
    7   HG22  THR 696          HG23      THR 696  58.648  10.153 -15.380

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLN 697           H        GLN 697  55.648   6.777 -16.948
    2    HA   GLN 697           HA       GLN 697  53.978   5.915 -18.166
    3    HB2  GLN 697           HB2      GLN 697  55.509   7.217 -20.438
    4    HB3  GLN 697           HB3      GLN 697  54.039   6.313 -20.735
    5    HG2  GLN 697           HG2      GLN 697  53.577   8.689 -20.671
    6    HG3  GLN 697           HG3      GLN 697  52.789   7.887 -19.322
    7   HE21  GLN 697          HE21      GLN 697  53.425   8.399 -17.243
    8   HE22  GLN 697          HE22      GLN 697  54.480   9.714 -16.895

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ALA 698           H        ALA 698  55.603   4.182 -17.269
    2    HA   ALA 698           HA       ALA 698  55.664   2.078 -19.271
    3    HB3  ALA 698           HB1      ALA 698  57.976   2.751 -17.442
    4    HB1  ALA 698           HB2      ALA 698  57.951   2.972 -19.188
    5    HB2  ALA 698           HB3      ALA 698  57.877   1.345 -18.502

  No H/Q in entry =           5
  In of MODEL   28
    1    H    VAL 699           H        VAL 699  55.291   0.064 -18.365
    2    HA   VAL 699           HA       VAL 699  54.071   0.117 -15.763
    3    HB   VAL 699           HB       VAL 699  52.946  -1.115 -17.580
    4   HG11  VAL 699          HG11      VAL 699  55.346  -2.926 -17.601
    5   HG13  VAL 699          HG12      VAL 699  54.834  -1.838 -18.889
    6   HG12  VAL 699          HG13      VAL 699  53.833  -3.224 -18.455
    7   HG21  VAL 699          HG21      VAL 699  52.535  -1.886 -15.307
    8   HG23  VAL 699          HG22      VAL 699  53.928  -2.962 -15.408
    9   HG22  VAL 699          HG23      VAL 699  52.522  -3.247 -16.431

  No H/Q in entry =           9
  In of MODEL   28
    1    HA   PRO 700           HA       PRO 700  57.743  -1.367 -13.608
    2    HB2  PRO 700           HB2      PRO 700  55.767  -2.321 -11.640
    3    HB3  PRO 700           HB3      PRO 700  57.140  -1.244 -11.391
    4    HG2  PRO 700           HG2      PRO 700  54.611  -0.328 -11.363
    5    HG3  PRO 700           HG3      PRO 700  55.957   0.639 -11.985
    6    HD2  PRO 700           HD2      PRO 700  53.819  -0.810 -13.476
    7    HD3  PRO 700           HD3      PRO 700  54.667   0.697 -13.867

  No H/Q in entry =           7
  In of MODEL   28
    1    H    LYS 701           H        LYS 701  58.707  -3.202 -13.860
    2    HA   LYS 701           HA       LYS 701  57.171  -5.450 -14.811
    3    HB2  LYS 701           HB2      LYS 701  60.184  -5.079 -14.717
    4    HB3  LYS 701           HB3      LYS 701  59.375  -6.468 -15.405
    5    HG2  LYS 701           HG2      LYS 701  60.000  -5.110 -17.246
    6    HG3  LYS 701           HG3      LYS 701  58.267  -4.862 -17.013
    7    HD2  LYS 701           HD2      LYS 701  58.706  -2.776 -15.848
    8    HD3  LYS 701           HD3      LYS 701  60.442  -3.018 -16.049
    9    HE2  LYS 701           HE2      LYS 701  58.480  -2.791 -18.328
   10    HE3  LYS 701           HE3      LYS 701  59.413  -1.442 -17.688
   11    HZ2  LYS 701           HZ1      LYS 701  60.526  -3.900 -18.948
   12    HZ1  LYS 701           HZ2      LYS 701  61.429  -2.661 -18.249
   13    HZ3  LYS 701           HZ3      LYS 701  60.490  -2.341 -19.607

  No H/Q in entry =          13
  In of MODEL   28
    1    H    CYS 702           H        CYS 702  56.201  -5.984 -12.841
    2    HA   CYS 702           HA       CYS 702  57.890  -7.675 -11.165
    3    HB2  CYS 702           HB2      CYS 702  55.805  -5.762 -10.025
    4    HB3  CYS 702           HB3      CYS 702  56.836  -6.858  -9.142

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLN 703           H        GLN 703  56.573  -9.295 -10.025
    2    HA   GLN 703           HA       GLN 703  54.507 -10.244 -11.735
    3    HB2  GLN 703           HB2      GLN 703  55.703 -11.285  -9.185
    4    HB3  GLN 703           HB3      GLN 703  54.400 -12.104 -10.033
    5    HG2  GLN 703           HG2      GLN 703  57.096 -11.465 -11.202
    6    HG3  GLN 703           HG3      GLN 703  56.598 -13.033 -10.564
    7   HE21  GLN 703          HE21      GLN 703  57.426 -12.281 -13.248
    8   HE22  GLN 703          HE22      GLN 703  56.141 -12.735 -14.298

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ARG 704           H        ARG 704  52.658 -11.378 -10.302
    2    HA   ARG 704           HA       ARG 704  51.007  -9.083  -9.760
    3    HB2  ARG 704           HB2      ARG 704  50.201 -12.003  -9.642
    4    HB3  ARG 704           HB3      ARG 704  49.100 -10.644  -9.554
    5    HG2  ARG 704           HG2      ARG 704  48.870 -11.243 -11.759
    6    HG3  ARG 704           HG3      ARG 704  50.146 -10.037 -11.886
    7    HD2  ARG 704           HD2      ARG 704  51.786 -12.017 -11.726
    8    HD3  ARG 704           HD3      ARG 704  50.383 -13.035 -11.982
    9    HE   ARG 704           HE       ARG 704  50.558 -10.985 -13.926
   10   HH11  ARG 704          HH11      ARG 704  51.821 -14.273 -13.216
   11   HH12  ARG 704          HH12      ARG 704  52.297 -14.523 -14.824
   12   HH21  ARG 704          HH21      ARG 704  51.286 -11.376 -16.029
   13   HH22  ARG 704          HH22      ARG 704  51.998 -12.853 -16.458

  No H/Q in entry =          13
  In of MODEL   28
    1    H    TRP 705           H        TRP 705  52.949 -10.888  -7.811
    2    HA   TRP 705           HA       TRP 705  51.400 -10.149  -5.424
    3    HB2  TRP 705           HB2      TRP 705  52.764 -11.887  -4.243
    4    HB3  TRP 705           HB3      TRP 705  51.734 -12.559  -5.490
    5    HD1  TRP 705           HD1      TRP 705  55.362 -12.159  -4.488
    6    HE1  TRP 705           HE1      TRP 705  56.858 -13.443  -6.120
    7    HE3  TRP 705           HE3      TRP 705  51.865 -13.391  -8.001
    8    HZ2  TRP 705           HZ2      TRP 705  56.582 -14.851  -8.560
    9    HZ3  TRP 705           HZ3      TRP 705  52.550 -14.711  -9.935
   10    HH2  TRP 705           HH2      TRP 705  54.872 -15.436 -10.214

  No H/Q in entry =          10
  In of MODEL   28
    1    H    GLU 706           H        GLU 706  53.494  -8.810  -7.289
    2    HA   GLU 706           HA       GLU 706  55.372  -8.046  -5.180
    3    HB2  GLU 706           HB2      GLU 706  55.902  -8.367  -8.116
    4    HB3  GLU 706           HB3      GLU 706  57.038  -7.708  -6.929
    5    HG2  GLU 706           HG2      GLU 706  57.048  -9.880  -5.830
    6    HG3  GLU 706           HG3      GLU 706  55.952 -10.496  -7.073

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LYS 707           H        LYS 707  56.356  -6.013  -5.552
    2    HA   LYS 707           HA       LYS 707  55.035  -4.149  -7.305
    3    HB2  LYS 707           HB2      LYS 707  54.701  -2.463  -5.554
    4    HB3  LYS 707           HB3      LYS 707  53.763  -3.903  -5.198
    5    HG2  LYS 707           HG2      LYS 707  55.365  -4.567  -3.502
    6    HG3  LYS 707           HG3      LYS 707  56.406  -3.205  -3.923
    7    HD2  LYS 707           HD2      LYS 707  54.554  -1.665  -3.320
    8    HD3  LYS 707           HD3      LYS 707  53.612  -3.055  -2.800
    9    HE2  LYS 707           HE2      LYS 707  55.215  -3.571  -1.075
   10    HE3  LYS 707           HE3      LYS 707  56.298  -2.304  -1.652
   11    HZ2  LYS 707           HZ1      LYS 707  53.597  -1.873  -0.464
   12    HZ1  LYS 707           HZ2      LYS 707  54.592  -0.678  -1.104
   13    HZ3  LYS 707           HZ3      LYS 707  55.088  -1.519   0.254

  No H/Q in entry =          13
  In of MODEL   28
    1    H    LEU 708           H        LEU 708  56.326  -2.273  -7.624
    2    HA   LEU 708           HA       LEU 708  59.162  -2.869  -7.416
    3    HB2  LEU 708           HB2      LEU 708  58.211  -2.258  -9.582
    4    HB3  LEU 708           HB3      LEU 708  57.634  -0.743  -8.921
    5    HG   LEU 708           HG       LEU 708  60.013  -0.069  -8.565
    6   HD11  LEU 708          HD11      LEU 708  60.598  -2.549 -10.167
    7   HD13  LEU 708          HD12      LEU 708  61.049  -2.250  -8.485
    8   HD12  LEU 708          HD13      LEU 708  61.757  -1.278  -9.773
    9   HD23  LEU 708          HD21      LEU 708  59.247  -0.746 -11.403
   10   HD22  LEU 708          HD22      LEU 708  60.437   0.460 -10.909
   11   HD21  LEU 708          HD23      LEU 708  58.735   0.683 -10.507

  No H/Q in entry =          11
  In of MODEL   28
    1    H    GLN 709           H        GLN 709  60.175  -2.128  -5.629
    2    HA   GLN 709           HA       GLN 709  59.980   0.697  -5.063
    3    HB2  GLN 709           HB2      GLN 709  59.431   0.573  -2.761
    4    HB3  GLN 709           HB3      GLN 709  58.346  -0.619  -3.458
    5    HG2  GLN 709           HG2      GLN 709  59.778  -2.379  -2.731
    6    HG3  GLN 709           HG3      GLN 709  60.996  -1.236  -2.185
    7   HE21  GLN 709          HE21      GLN 709  59.840  -3.164  -0.635
    8   HE22  GLN 709          HE22      GLN 709  58.927  -2.452   0.656

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ASN 710           H        ASN 710  61.843   1.462  -4.147
    2    HA   ASN 710           HA       ASN 710  64.102   1.583  -3.724
    3    HB2  ASN 710           HB2      ASN 710  63.282  -0.029  -1.888
    4    HB3  ASN 710           HB3      ASN 710  63.938  -1.330  -2.846
    5   HD21  ASN 710          HD21      ASN 710  64.692  -0.571  -0.207
    6   HD22  ASN 710          HD22      ASN 710  66.350  -0.120  -0.212

  No H/Q in entry =           6
  In of MODEL   28
    1    H    SER 711           H        SER 711  63.083   0.782  -6.274
    2    HA   SER 711           HA       SER 711  63.780   0.265  -8.326
    3    HB2  SER 711           HB2      SER 711  65.825   1.513  -7.696
    4    HB3  SER 711           HB3      SER 711  66.527   0.030  -7.060
    5    HG   SER 711           HG       SER 711  65.986  -0.745  -9.319

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ARG 712           H        ARG 712  63.132  -1.905  -6.238
    2    HA   ARG 712           HA       ARG 712  64.048  -4.098  -7.925
    3    HB2  ARG 712           HB2      ARG 712  64.336  -5.494  -5.928
    4    HB3  ARG 712           HB3      ARG 712  65.499  -4.172  -6.009
    5    HG2  ARG 712           HG2      ARG 712  64.148  -2.929  -4.358
    6    HG3  ARG 712           HG3      ARG 712  63.016  -4.271  -4.326
    7    HD2  ARG 712           HD2      ARG 712  64.741  -5.758  -3.505
    8    HD3  ARG 712           HD3      ARG 712  65.939  -4.472  -3.622
    9    HE   ARG 712           HE       ARG 712  63.944  -3.532  -1.950
   10   HH11  ARG 712          HH11      ARG 712  66.176  -6.267  -1.949
   11   HH12  ARG 712          HH12      ARG 712  66.366  -6.293  -0.263
   12   HH21  ARG 712          HH21      ARG 712  64.203  -3.590   0.388
   13   HH22  ARG 712          HH22      ARG 712  65.208  -4.753   1.097

  No H/Q in entry =          13
  In of MODEL   28
    1    H    CYS 713           H        CYS 713  62.788  -6.097  -7.420
    2    HA   CYS 713           HA       CYS 713  59.998  -5.333  -7.146
    3    HB2  CYS 713           HB2      CYS 713  59.575  -7.587  -8.186
    4    HB3  CYS 713           HB3      CYS 713  60.488  -6.477  -9.206

  No H/Q in entry =           4
  In of MODEL   28
    1    H    VAL 714           H        VAL 714  59.128  -5.668  -5.251
    2    HA   VAL 714           HA       VAL 714  60.227  -7.811  -3.558
    3    HB   VAL 714           HB       VAL 714  59.605  -6.496  -1.577
    4   HG12  VAL 714          HG11      VAL 714  61.297  -4.915  -3.483
    5   HG11  VAL 714          HG12      VAL 714  61.860  -6.222  -2.439
    6   HG13  VAL 714          HG13      VAL 714  61.268  -4.714  -1.732
    7   HG22  VAL 714          HG21      VAL 714  58.865  -4.162  -1.772
    8   HG21  VAL 714          HG22      VAL 714  57.719  -5.267  -2.530
    9   HG23  VAL 714          HG23      VAL 714  58.824  -4.327  -3.528

  No H/Q in entry =           9
  In of MODEL   28
    1    H    CYS 715           H        CYS 715  58.481  -8.305  -1.787
    2    HA   CYS 715           HA       CYS 715  56.109  -8.991  -3.295
    3    HB2  CYS 715           HB2      CYS 715  55.553 -10.330  -1.250
    4    HB3  CYS 715           HB3      CYS 715  57.129 -10.750  -1.899

  No H/Q in entry =           4
  In of MODEL   28
    1    H    LYS 716           H        LYS 716  54.096  -8.180  -2.799
    2    HA   LYS 716           HA       LYS 716  54.103  -5.639  -1.456
    3    HB2  LYS 716           HB2      LYS 716  51.701  -5.515  -2.129
    4    HB3  LYS 716           HB3      LYS 716  52.774  -5.838  -3.477
    5    HG2  LYS 716           HG2      LYS 716  52.171  -8.248  -3.284
    6    HG3  LYS 716           HG3      LYS 716  50.994  -7.792  -2.053
    7    HD2  LYS 716           HD2      LYS 716  51.013  -6.771  -4.900
    8    HD3  LYS 716           HD3      LYS 716  49.992  -8.077  -4.309
    9    HE2  LYS 716           HE2      LYS 716  48.927  -6.524  -2.737
   10    HE3  LYS 716           HE3      LYS 716  49.959  -5.224  -3.328
   11    HZ2  LYS 716           HZ1      LYS 716  47.931  -6.702  -4.917
   12    HZ1  LYS 716           HZ2      LYS 716  48.969  -5.518  -5.526
   13    HZ3  LYS 716           HZ3      LYS 716  47.827  -5.104  -4.363

  No H/Q in entry =          13
  In of MODEL   28
    1    H    MET 717           H        MET 717  51.678  -5.504  -0.118
    2    HA   MET 717           HA       MET 717  52.314  -7.275   2.120
    3    HB2  MET 717           HB2      MET 717  50.625  -4.766   2.077
    4    HB3  MET 717           HB3      MET 717  51.006  -5.711   3.512
    5    HG2  MET 717           HG2      MET 717  52.935  -4.171   1.787
    6    HG3  MET 717           HG3      MET 717  52.429  -3.785   3.432
    7    HE1  MET 717           HE1      MET 717  53.216  -5.129   5.581
    8    HE3  MET 717           HE2      MET 717  54.172  -6.609   5.509
    9    HE2  MET 717           HE3      MET 717  52.512  -6.603   4.911

  No H/Q in entry =           9
  In of MODEL   28
    1    HA   PRO 718           HA       PRO 718  48.907  -9.794   1.028
    2    HB2  PRO 718           HB2      PRO 718  48.492 -11.076   3.422
    3    HB3  PRO 718           HB3      PRO 718  49.769 -11.493   2.280
    4    HG2  PRO 718           HG2      PRO 718  49.910  -9.835   4.755
    5    HG3  PRO 718           HG3      PRO 718  51.070 -11.025   4.138
    6    HD2  PRO 718           HD2      PRO 718  51.445  -8.359   3.878
    7    HD3  PRO 718           HD3      PRO 718  52.013  -9.520   2.663

  No H/Q in entry =           7
  In of MODEL   28
    1    H    TYR 719           H        TYR 719  48.610  -7.749   3.835
    2    HA   TYR 719           HA       TYR 719  45.744  -8.039   3.902
    3    HB2  TYR 719           HB2      TYR 719  45.754  -6.387   5.689
    4    HB3  TYR 719           HB3      TYR 719  46.992  -7.595   5.977
    5    HD1  TYR 719           HD1      TYR 719  46.264  -4.129   5.659
    6    HD2  TYR 719           HD2      TYR 719  49.435  -6.963   5.391
    7    HE1  TYR 719           HE1      TYR 719  47.899  -2.326   5.965
    8    HE2  TYR 719           HE2      TYR 719  51.060  -5.157   5.715
    9    HH   TYR 719           HH       TYR 719  50.115  -2.078   6.736

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLU 720           H        GLU 720  47.880  -6.368   2.019
    2    HA   GLU 720           HA       GLU 720  46.008  -4.242   1.299
    3    HB2  GLU 720           HB2      GLU 720  48.427  -3.693   1.726
    4    HB3  GLU 720           HB3      GLU 720  48.874  -4.796   0.443
    5    HG2  GLU 720           HG2      GLU 720  49.009  -2.493  -0.294
    6    HG3  GLU 720           HG3      GLU 720  47.759  -3.362  -1.181

  No H/Q in entry =           6
  In of MODEL   28
    1    H    CYS 721           H        CYS 721  46.373  -7.361   0.771
    2    HA   CYS 721           HA       CYS 721  46.049  -7.303  -2.095
    3    HB2  CYS 721           HB2      CYS 721  46.155  -9.632  -0.187
    4    HB3  CYS 721           HB3      CYS 721  46.100  -9.742  -1.940

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLY 722           H        GLY 722  44.143  -6.180  -2.045
    2    HA3  GLY 722           HA2      GLY 722  41.782  -7.421  -0.916
    3    HA2  GLY 722           HA3      GLY 722  41.848  -5.895  -1.796

  No H/Q in entry =           3
  In of MODEL   28
    1    HA   PRO 723           HA       PRO 723  40.539  -7.818  -5.538
    2    HB2  PRO 723           HB2      PRO 723  42.389  -6.999  -7.426
    3    HB3  PRO 723           HB3      PRO 723  41.051  -6.000  -6.849
    4    HG2  PRO 723           HG2      PRO 723  43.921  -5.970  -6.052
    5    HG3  PRO 723           HG3      PRO 723  42.797  -4.618  -6.262
    6    HD2  PRO 723           HD2      PRO 723  43.472  -5.561  -3.822
    7    HD3  PRO 723           HD3      PRO 723  41.872  -4.889  -4.174

  No H/Q in entry =           7
  In of MODEL   28
    1    H    SER 724           H        SER 724  40.816  -9.925  -5.011
    2    HA   SER 724           HA       SER 724  42.495 -11.581  -6.562
    3    HB2  SER 724           HB2      SER 724  43.629 -12.563  -4.480
    4    HB3  SER 724           HB3      SER 724  44.304 -11.093  -5.180
    5    HG   SER 724           HG       SER 724  42.566 -10.262  -3.468

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU 725           H        LEU 725  41.839 -13.628  -6.593
    2    HA   LEU 725           HA       LEU 725  39.229 -14.250  -5.718
    3    HB2  LEU 725           HB2      LEU 725  41.463 -15.617  -7.037
    4    HB3  LEU 725           HB3      LEU 725  40.206 -16.633  -6.418
    5    HG   LEU 725           HG       LEU 725  39.876 -14.411  -8.461
    6   HD11  LEU 725          HD11      LEU 725  39.799 -17.402  -8.739
    7   HD13  LEU 725          HD12      LEU 725  41.076 -16.312  -9.301
    8   HD12  LEU 725          HD13      LEU 725  39.463 -16.223 -10.012
    9   HD22  LEU 725          HD21      LEU 725  37.842 -14.697  -7.137
   10   HD21  LEU 725          HD22      LEU 725  37.890 -16.433  -7.436
   11   HD23  LEU 725          HD23      LEU 725  37.630 -15.315  -8.773

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ASP 726           H        ASP 726  38.528 -14.881  -3.847
    2    HA   ASP 726           HA       ASP 726  40.364 -15.793  -1.834
    3    HB2  ASP 726           HB2      ASP 726  37.357 -15.610  -1.745
    4    HB3  ASP 726           HB3      ASP 726  38.407 -16.025  -0.402

  No H/Q in entry =           4
  In of MODEL   28
    1    H    VAL 727           H        VAL 727  40.705 -17.663  -1.040
    2    HA   VAL 727           HA       VAL 727  39.466 -19.984  -2.278
    3    HB   VAL 727           HB       VAL 727  41.720 -21.022  -2.650
    4   HG12  VAL 727          HG11      VAL 727  41.180 -18.533  -4.266
    5   HG11  VAL 727          HG12      VAL 727  40.469 -20.124  -4.540
    6   HG13  VAL 727          HG13      VAL 727  42.202 -19.882  -4.766
    7   HG23  VAL 727          HG21      VAL 727  42.734 -18.204  -2.243
    8   HG22  VAL 727          HG22      VAL 727  43.690 -19.556  -2.851
    9   HG21  VAL 727          HG23      VAL 727  43.059 -19.592  -1.203

  No H/Q in entry =           9
  In of MODEL   28
    1    H    CYS 728           H        CYS 728  40.125 -21.976  -1.173
    2    HA   CYS 728           HA       CYS 728  40.353 -21.500   1.701
    3    HB2  CYS 728           HB2      CYS 728  39.657 -24.004   0.203
    4    HB3  CYS 728           HB3      CYS 728  39.376 -23.674   1.916

  No H/Q in entry =           4
  In of MODEL   28
    1    H    ALA 729           H        ALA 729  42.274 -21.959   2.670
    2    HA   ALA 729           HA       ALA 729  44.066 -23.781   1.253
    3    HB2  ALA 729           HB1      ALA 729  45.925 -22.351   1.856
    4    HB1  ALA 729           HB2      ALA 729  44.815 -21.226   2.631
    5    HB3  ALA 729           HB3      ALA 729  44.750 -21.461   0.883

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLN 730           H        GLN 730  45.444 -24.922   2.562
    2    HA   GLN 730           HA       GLN 730  44.636 -25.061   5.350
    3    HB2  GLN 730           HB2      GLN 730  44.563 -27.251   4.308
    4    HB3  GLN 730           HB3      GLN 730  46.141 -27.010   3.609
    5    HG2  GLN 730           HG2      GLN 730  47.214 -27.132   5.757
    6    HG3  GLN 730           HG3      GLN 730  45.657 -27.212   6.572
    7   HE21  GLN 730          HE21      GLN 730  44.734 -29.173   6.876
    8   HE22  GLN 730          HE22      GLN 730  45.331 -30.631   6.189

  No H/Q in entry =           8
  In of MODEL   28
    1    H    ASP 731           H        ASP 731  45.914 -24.219   6.793
    2    HA   ASP 731           HA       ASP 731  48.507 -23.093   6.236
    3    HB2  ASP 731           HB2      ASP 731  47.005 -22.235   8.054
    4    HB3  ASP 731           HB3      ASP 731  47.187 -23.767   8.873

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLU 732           H        GLU 732  50.419 -24.186   6.201
    2    HA   GLU 732           HA       GLU 732  50.311 -27.003   6.633
    3    HB2  GLU 732           HB2      GLU 732  52.591 -25.203   5.929
    4    HB3  GLU 732           HB3      GLU 732  52.765 -26.956   6.036
    5    HG2  GLU 732           HG2      GLU 732  50.755 -26.919   4.347
    6    HG3  GLU 732           HG3      GLU 732  51.318 -25.267   4.079

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ARG 733           H        ARG 733  51.015 -24.440   8.685
    2    HA   ARG 733           HA       ARG 733  52.696 -25.969  10.446
    3    HB2  ARG 733           HB2      ARG 733  52.916 -23.506  10.193
    4    HB3  ARG 733           HB3      ARG 733  51.302 -23.315  10.853
    5    HG2  ARG 733           HG2      ARG 733  52.930 -22.811  12.538
    6    HG3  ARG 733           HG3      ARG 733  52.095 -24.301  12.976
    7    HD2  ARG 733           HD2      ARG 733  53.965 -25.607  12.088
    8    HD3  ARG 733           HD3      ARG 733  54.797 -24.112  11.652
    9    HE   ARG 733           HE       ARG 733  54.152 -24.024  14.353
   10   HH11  ARG 733          HH11      ARG 733  56.403 -25.692  12.147
   11   HH12  ARG 733          HH12      ARG 733  57.488 -26.111  13.382
   12   HH21  ARG 733          HH21      ARG 733  55.695 -24.609  16.033
   13   HH22  ARG 733          HH22      ARG 733  57.103 -25.482  15.596

  No H/Q in entry =          13
  In of MODEL   28
    1    H    SER 734           H        SER 734  49.410 -24.678  10.494
    2    HA   SER 734           HA       SER 734  48.773 -26.102  12.936
    3    HB2  SER 734           HB2      SER 734  46.995 -24.339  11.276
    4    HB3  SER 734           HB3      SER 734  46.833 -24.722  12.993
    5    HG   SER 734           HG       SER 734  48.744 -23.155  11.659

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LYS 735           H        LYS 735  48.328 -26.579   9.512
    2    HA   LYS 735           HA       LYS 735  47.308 -28.069   8.255
    3    HB2  LYS 735           HB2      LYS 735  47.100 -29.701  10.786
    4    HB3  LYS 735           HB3      LYS 735  46.863 -30.315   9.166
    5    HG2  LYS 735           HG2      LYS 735  49.451 -29.125  10.165
    6    HG3  LYS 735           HG3      LYS 735  49.111 -30.849  10.047
    7    HD2  LYS 735           HD2      LYS 735  49.020 -28.957   7.691
    8    HD3  LYS 735           HD3      LYS 735  50.441 -29.877   8.132
    9    HE2  LYS 735           HE2      LYS 735  49.168 -31.966   7.848
   10    HE3  LYS 735           HE3      LYS 735  47.742 -31.027   7.418
   11    HZ1  LYS 735           HZ1      LYS 735  50.282 -30.954   5.894
   12    HZ3  LYS 735           HZ2      LYS 735  48.800 -30.272   5.434
   13    HZ2  LYS 735           HZ3      LYS 735  48.985 -31.930   5.489

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ARG 736           H        ARG 736  45.711 -26.009   9.216
    2    HA   ARG 736           HA       ARG 736  43.135 -27.385   9.162
    3    HB2  ARG 736           HB2      ARG 736  42.152 -25.563  10.466
    4    HB3  ARG 736           HB3      ARG 736  43.367 -26.467  11.354
    5    HG2  ARG 736           HG2      ARG 736  44.965 -24.702  10.965
    6    HG3  ARG 736           HG3      ARG 736  43.750 -23.796  10.057
    7    HD2  ARG 736           HD2      ARG 736  43.978 -23.054  12.327
    8    HD3  ARG 736           HD3      ARG 736  42.347 -23.654  12.009
    9    HE   ARG 736           HE       ARG 736  43.845 -25.770  13.042
   10   HH11  ARG 736          HH11      ARG 736  42.579 -22.679  14.196
   11   HH12  ARG 736          HH12      ARG 736  42.485 -23.188  15.815
   12   HH21  ARG 736          HH21      ARG 736  43.724 -26.444  15.228
   13   HH22  ARG 736          HH22      ARG 736  43.182 -25.381  16.436

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ILE 737           H        ILE 737  41.424 -26.263   8.063
    2    HA   ILE 737           HA       ILE 737  42.403 -24.895   5.734
    3    HB   ILE 737           HB       ILE 737  39.532 -25.416   6.534
    4   HG12  ILE 737          HG12      ILE 737  40.787 -27.554   6.539
    5   HG13  ILE 737          HG13      ILE 737  39.610 -27.481   5.238
    6   HG22  ILE 737          HG21      ILE 737  40.827 -24.995   3.841
    7   HG21  ILE 737          HG22      ILE 737  39.878 -23.798   4.732
    8   HG23  ILE 737          HG23      ILE 737  39.101 -25.253   4.128
    9   HD12  ILE 737          HD11      ILE 737  41.683 -28.490   4.507
   10   HD11  ILE 737          HD12      ILE 737  42.566 -27.032   4.979
   11   HD13  ILE 737          HD13      ILE 737  41.377 -26.965   3.671

  No H/Q in entry =          11
  In of MODEL   28
    1    H    LEU 738           H        LEU 738  42.511 -22.770   5.633
    2    HA   LEU 738           HA       LEU 738  40.550 -21.269   7.085
    3    HB2  LEU 738           HB2      LEU 738  42.080 -19.513   7.752
    4    HB3  LEU 738           HB3      LEU 738  42.578 -21.028   8.467
    5    HG   LEU 738           HG       LEU 738  43.903 -19.716   6.081
    6   HD11  LEU 738          HD11      LEU 738  44.159 -18.406   8.141
    7   HD13  LEU 738          HD12      LEU 738  45.682 -19.151   7.656
    8   HD12  LEU 738          HD13      LEU 738  44.741 -19.848   8.974
    9   HD21  LEU 738          HD21      LEU 738  44.089 -22.104   6.180
   10   HD23  LEU 738          HD22      LEU 738  44.691 -22.009   7.832
   11   HD22  LEU 738          HD23      LEU 738  45.658 -21.358   6.486

  No H/Q in entry =          11
  In of MODEL   28
    1    HA   PRO 739           HA       PRO 739  39.867 -19.415   3.261
    2    HB2  PRO 739           HB2      PRO 739  38.710 -17.138   4.120
    3    HB3  PRO 739           HB3      PRO 739  37.909 -18.719   4.212
    4    HG2  PRO 739           HG2      PRO 739  39.368 -17.216   6.348
    5    HG3  PRO 739           HG3      PRO 739  37.803 -18.046   6.442
    6    HD2  PRO 739           HD2      PRO 739  40.113 -19.234   7.303
    7    HD3  PRO 739           HD3      PRO 739  38.776 -20.138   6.535

  No H/Q in entry =           7
  In of MODEL   28
    1    H    LEU 740           H        LEU 740  41.452 -18.623   2.073
    2    HA   LEU 740           HA       LEU 740  42.811 -16.171   2.931
    3    HB2  LEU 740           HB2      LEU 740  43.953 -18.575   1.531
    4    HB3  LEU 740           HB3      LEU 740  44.730 -17.011   1.500
    5    HG   LEU 740           HG       LEU 740  44.256 -18.715   3.943
    6   HD12  LEU 740          HD11      LEU 740  46.702 -18.887   3.913
    7   HD11  LEU 740          HD12      LEU 740  46.729 -17.964   2.396
    8   HD13  LEU 740          HD13      LEU 740  45.966 -19.544   2.448
    9   HD21  LEU 740          HD21      LEU 740  45.602 -16.027   3.625
   10   HD23  LEU 740          HD22      LEU 740  45.652 -17.019   5.081
   11   HD22  LEU 740          HD23      LEU 740  44.121 -16.343   4.532

  No H/Q in entry =          11
  In of MODEL   28
    1    H    THR 741           H        THR 741  44.058 -15.507   0.735
    2    HA   THR 741           HA       THR 741  42.122 -15.636  -1.432
    3    HB   THR 741           HB       THR 741  43.626 -13.115  -0.793
    4    HG1  THR 741           HG1      THR 741  40.970 -13.631   0.145
    5   HG22  THR 741          HG21      THR 741  40.948 -13.638  -2.034
    6   HG21  THR 741          HG22      THR 741  42.463 -13.482  -2.908
    7   HG23  THR 741          HG23      THR 741  41.829 -12.104  -2.008

  No H/Q in entry =           7
  In of MODEL   28
    1    H    VAL 742           H        VAL 742  43.150 -15.476  -3.495
    2    HA   VAL 742           HA       VAL 742  45.545 -16.799  -3.671
    3    HB   VAL 742           HB       VAL 742  45.666 -16.222  -6.038
    4   HG11  VAL 742          HG11      VAL 742  44.280 -17.941  -5.325
    5   HG13  VAL 742          HG12      VAL 742  43.632 -17.114  -6.759
    6   HG12  VAL 742          HG13      VAL 742  42.914 -16.825  -5.153
    7   HG23  VAL 742          HG21      VAL 742  43.410 -14.374  -5.507
    8   HG22  VAL 742          HG22      VAL 742  44.107 -14.847  -7.082
    9   HG21  VAL 742          HG23      VAL 742  45.095 -13.967  -5.895

  No H/Q in entry =           9
  In of MODEL   28
    1    H    CYS 743           H        CYS 743  45.147 -13.278  -3.760
    2    HA   CYS 743           HA       CYS 743  47.920 -13.040  -4.328
    3    HB2  CYS 743           HB2      CYS 743  46.319 -11.350  -5.133
    4    HB3  CYS 743           HB3      CYS 743  45.992 -10.845  -3.486

  No H/Q in entry =           4
  In of MODEL   28
    1    H    LYS 744           H        LYS 744  45.916 -12.871  -1.416
    2    HA   LYS 744           HA       LYS 744  47.903 -12.069   0.396
    3    HB2  LYS 744           HB2      LYS 744  45.612 -14.001   0.766
    4    HB3  LYS 744           HB3      LYS 744  46.643 -13.447   2.068
    5    HG2  LYS 744           HG2      LYS 744  45.850 -11.124   1.614
    6    HG3  LYS 744           HG3      LYS 744  44.743 -11.778   0.401
    7    HD2  LYS 744           HD2      LYS 744  43.680 -13.162   2.134
    8    HD3  LYS 744           HD3      LYS 744  44.778 -12.505   3.338
    9    HE2  LYS 744           HE2      LYS 744  42.652 -11.391   3.526
   10    HE3  LYS 744           HE3      LYS 744  43.827 -10.247   2.887
   11    HZ1  LYS 744           HZ1      LYS 744  41.928 -11.776   1.192
   12    HZ3  LYS 744           HZ2      LYS 744  42.826 -10.416   0.709
   13    HZ2  LYS 744           HZ3      LYS 744  41.583 -10.275   1.813

  No H/Q in entry =          13
  In of MODEL   28
    1    H    MET 745           H        MET 745  46.820 -15.300  -0.492
    2    HA   MET 745           HA       MET 745  48.730 -16.879   0.748
    3    HB2  MET 745           HB2      MET 745  47.082 -18.112  -0.038
    4    HB3  MET 745           HB3      MET 745  46.820 -17.171  -1.500
    5    HG2  MET 745           HG2      MET 745  47.574 -19.260  -2.261
    6    HG3  MET 745           HG3      MET 745  49.000 -18.249  -2.316
    7    HE3  MET 745           HE1      MET 745  47.252 -20.076   0.737
    8    HE2  MET 745           HE2      MET 745  48.130 -21.613   0.632
    9    HE1  MET 745           HE3      MET 745  47.126 -21.078  -0.702

  No H/Q in entry =           9
  In of MODEL   28
    1    H    HIS 746           H        HIS 746  48.750 -15.603  -2.618
    2    HA   HIS 746           HA       HIS 746  51.074 -16.779  -3.259
    3    HB2  HIS 746           HB2      HIS 746  49.585 -14.616  -4.487
    4    HB3  HIS 746           HB3      HIS 746  51.313 -14.569  -4.857
    5    HD1  HIS 746           HD1      HIS 746  52.263 -16.599  -6.233
    6    HD2  HIS 746           HD2      HIS 746  48.148 -16.648  -5.645
    7    HE1  HIS 746           HE1      HIS 746  51.365 -18.172  -7.935
    8    HE2  HIS 746           HE2      HIS 746  48.860 -17.905  -7.758

  No H/Q in entry =           8
  In of MODEL   28
    1    H    VAL 747           H        VAL 747  50.563 -13.508  -2.004
    2    HA   VAL 747           HA       VAL 747  53.194 -12.563  -1.989
    3    HB   VAL 747           HB       VAL 747  50.725 -11.839  -0.401
    4   HG13  VAL 747          HG11      VAL 747  51.881  -9.845   0.398
    5   HG12  VAL 747          HG12      VAL 747  53.379 -10.370  -0.359
    6   HG11  VAL 747          HG13      VAL 747  52.696 -11.283   0.989
    7   HG21  VAL 747          HG21      VAL 747  50.739 -11.354  -2.766
    8   HG23  VAL 747          HG22      VAL 747  52.265 -10.492  -2.579
    9   HG22  VAL 747          HG23      VAL 747  50.797  -9.866  -1.815

  No H/Q in entry =           9
  In of MODEL   28
    1    H    LEU 748           H        LEU 748  51.244 -13.879   0.607
    2    HA   LEU 748           HA       LEU 748  53.200 -13.958   2.544
    3    HB2  LEU 748           HB2      LEU 748  51.155 -14.113   3.476
    4    HB3  LEU 748           HB3      LEU 748  50.478 -14.918   2.097
    5    HG   LEU 748           HG       LEU 748  52.058 -16.406   4.189
    6   HD13  LEU 748          HD11      LEU 748  50.183 -15.186   5.246
    7   HD12  LEU 748          HD12      LEU 748  49.872 -16.923   5.188
    8   HD11  LEU 748          HD13      LEU 748  49.086 -15.851   4.035
    9   HD21  LEU 748          HD21      LEU 748  51.631 -17.514   1.996
   10   HD23  LEU 748          HD22      LEU 748  49.898 -17.270   2.240
   11   HD22  LEU 748          HD23      LEU 748  50.806 -18.299   3.335

  No H/Q in entry =          11
  In of MODEL   28
    1    H    HIS 749           H        HIS 749  52.436 -16.264   0.046
    2    HA   HIS 749           HA       HIS 749  54.037 -18.402   1.002
    3    HB2  HIS 749           HB2      HIS 749  52.209 -18.324  -0.893
    4    HB3  HIS 749           HB3      HIS 749  53.566 -17.902  -1.926
    5    HD1  HIS 749           HD1      HIS 749  55.292 -19.835  -2.456
    6    HD2  HIS 749           HD2      HIS 749  52.125 -20.916   0.003
    7    HE1  HIS 749           HE1      HIS 749  55.355 -22.297  -2.363
    8    HE2  HIS 749           HE2      HIS 749  53.554 -22.953  -0.738

  No H/Q in entry =           8
  In of MODEL   28
    1    H    CYS 750           H        CYS 750  54.576 -15.641  -1.146
    2    HA   CYS 750           HA       CYS 750  57.209 -16.311  -1.937
    3    HB2  CYS 750           HB2      CYS 750  55.793 -14.839  -3.273
    4    HB3  CYS 750           HB3      CYS 750  55.701 -13.688  -1.949

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLN 751           H        GLN 751  55.798 -14.464   0.687
    2    HA   GLN 751           HA       GLN 751  58.155 -13.324   1.664
    3    HB2  GLN 751           HB2      GLN 751  55.636 -14.072   3.139
    4    HB3  GLN 751           HB3      GLN 751  56.906 -13.044   3.786
    5    HG2  GLN 751           HG2      GLN 751  56.511 -11.452   1.940
    6    HG3  GLN 751           HG3      GLN 751  55.229 -12.495   1.366
    7   HE21  GLN 751          HE21      GLN 751  55.146  -9.742   2.348
    8   HE22  GLN 751          HE22      GLN 751  53.986  -9.744   3.635

  No H/Q in entry =           8
  In of MODEL   28
    1    H    GLY 752           H        GLY 752  56.991 -16.538   1.823
    2    HA3  GLY 752           HA2      GLY 752  58.630 -18.257   2.366
    3    HA2  GLY 752           HA3      GLY 752  59.190 -17.222   3.671

  No H/Q in entry =           3
  In of MODEL   28
    1    H    ARG 753           H        ARG 753  55.786 -17.746   3.000
    2    HA   ARG 753           HA       ARG 753  55.623 -19.311   5.480
    3    HB2  ARG 753           HB2      ARG 753  53.455 -17.824   4.011
    4    HB3  ARG 753           HB3      ARG 753  53.292 -18.620   5.565
    5    HG2  ARG 753           HG2      ARG 753  55.082 -16.233   5.070
    6    HG3  ARG 753           HG3      ARG 753  53.438 -16.114   5.675
    7    HD2  ARG 753           HD2      ARG 753  54.851 -15.961   7.558
    8    HD3  ARG 753           HD3      ARG 753  54.155 -17.572   7.577
    9    HE   ARG 753           HE       ARG 753  56.586 -17.848   6.321
   10   HH11  ARG 753          HH11      ARG 753  55.557 -16.555   9.468
   11   HH12  ARG 753          HH12      ARG 753  56.934 -17.137  10.287
   12   HH21  ARG 753          HH21      ARG 753  58.513 -18.610   7.511
   13   HH22  ARG 753          HH22      ARG 753  58.584 -18.307   9.186

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ASN 754           H        ASN 754  54.333 -21.225   5.426
    2    HA   ASN 754           HA       ASN 754  54.075 -22.320   2.712
    3    HB2  ASN 754           HB2      ASN 754  54.504 -23.779   5.318
    4    HB3  ASN 754           HB3      ASN 754  54.283 -24.523   3.756
    5   HD21  ASN 754          HD21      ASN 754  56.537 -24.425   5.670
    6   HD22  ASN 754          HD22      ASN 754  57.879 -23.959   4.688

  No H/Q in entry =           6
  In of MODEL   28
    1    H    TYR 755           H        TYR 755  52.156 -22.761   1.984
    2    HA   TYR 755           HA       TYR 755  50.061 -23.619   3.775
    3    HB2  TYR 755           HB2      TYR 755  49.858 -21.208   1.979
    4    HB3  TYR 755           HB3      TYR 755  48.451 -22.137   2.479
    5    HD1  TYR 755           HD1      TYR 755  47.355 -21.563   4.443
    6    HD2  TYR 755           HD2      TYR 755  51.326 -20.216   3.863
    7    HE1  TYR 755           HE1      TYR 755  47.171 -20.159   6.445
    8    HE2  TYR 755           HE2      TYR 755  51.152 -18.808   5.855
    9    HH   TYR 755           HH       TYR 755  48.767 -19.231   8.104

  No H/Q in entry =           9
  In of MODEL   28
    1    H    THR 756           H        THR 756  48.467 -24.757   2.715
    2    HA   THR 756           HA       THR 756  49.279 -25.854   0.113
    3    HB   THR 756           HB       THR 756  47.812 -27.030   2.470
    4    HG1  THR 756           HG1      THR 756  50.313 -26.708   1.997
    5   HG21  THR 756          HG21      THR 756  46.947 -27.940   0.386
    6   HG23  THR 756          HG22      THR 756  47.882 -29.156   1.264
    7   HG22  THR 756          HG23      THR 756  48.590 -28.323  -0.138

  No H/Q in entry =           7
  In of MODEL   28
    1    H    LEU 757           H        LEU 757  47.689 -25.939  -1.537
    2    HA   LEU 757           HA       LEU 757  45.273 -24.435  -0.987
    3    HB2  LEU 757           HB2      LEU 757  46.532 -25.335  -3.574
    4    HB3  LEU 757           HB3      LEU 757  44.912 -24.685  -3.509
    5    HG   LEU 757           HG       LEU 757  46.410 -22.977  -4.235
    6   HD11  LEU 757          HD11      LEU 757  44.573 -22.272  -2.841
    7   HD13  LEU 757          HD12      LEU 757  45.975 -21.238  -2.594
    8   HD12  LEU 757          HD13      LEU 757  45.566 -22.458  -1.394
    9   HD21  LEU 757          HD21      LEU 757  48.498 -23.847  -3.298
   10   HD23  LEU 757          HD22      LEU 757  47.953 -23.422  -1.678
   11   HD22  LEU 757          HD23      LEU 757  48.265 -22.153  -2.862

  No H/Q in entry =          11
  In of MODEL   28
    1    H    THR 758           H        THR 758  43.669 -25.437  -0.256
    2    HA   THR 758           HA       THR 758  43.223 -28.216  -0.911
    3    HB   THR 758           HB       THR 758  41.432 -27.871   0.958
    4    HG1  THR 758           HG1      THR 758  41.929 -25.420   0.673
    5   HG22  THR 758          HG21      THR 758  43.151 -28.134   2.680
    6   HG21  THR 758          HG22      THR 758  44.382 -27.555   1.554
    7   HG23  THR 758          HG23      THR 758  43.557 -29.085   1.252

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLY 759           H        GLY 759  40.436 -28.300  -0.528
    2    HA3  GLY 759           HA2      GLY 759  39.633 -27.519  -3.135
    3    HA2  GLY 759           HA3      GLY 759  38.657 -28.369  -1.950

  No H/Q in entry =           3
  In of MODEL   28
    1    H    ARG 760           H        ARG 760  37.719 -26.313  -3.576
    2    HA   ARG 760           HA       ARG 760  37.742 -23.824  -2.165
    3    HB2  ARG 760           HB2      ARG 760  36.056 -23.079  -3.857
    4    HB3  ARG 760           HB3      ARG 760  37.577 -23.684  -4.485
    5    HG2  ARG 760           HG2      ARG 760  35.808 -24.499  -5.927
    6    HG3  ARG 760           HG3      ARG 760  36.505 -25.813  -4.967
    7    HD2  ARG 760           HD2      ARG 760  34.014 -25.920  -5.187
    8    HD3  ARG 760           HD3      ARG 760  34.683 -25.924  -3.552
    9    HE   ARG 760           HE       ARG 760  34.128 -23.314  -4.069
   10   HH11  ARG 760          HH11      ARG 760  32.081 -26.178  -4.322
   11   HH12  ARG 760          HH12      ARG 760  30.767 -25.485  -3.474
   12   HH21  ARG 760          HH21      ARG 760  32.261 -22.355  -2.887
   13   HH22  ARG 760          HH22      ARG 760  30.887 -23.322  -2.665

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ASP 761           H        ASP 761  36.058 -26.579  -1.704
    2    HA   ASP 761           HA       ASP 761  33.818 -25.162  -0.447
    3    HB2  ASP 761           HB2      ASP 761  33.296 -27.044  -2.026
    4    HB3  ASP 761           HB3      ASP 761  34.113 -28.145  -0.928

  No H/Q in entry =           4
  In of MODEL   28
    1    H    SER 762           H        SER 762  36.793 -26.246   0.272
    2    HA   SER 762           HA       SER 762  36.405 -27.591   2.725
    3    HB2  SER 762           HB2      SER 762  38.852 -26.058   1.815
    4    HB3  SER 762           HB3      SER 762  38.804 -27.144   3.202
    5    HG   SER 762           HG       SER 762  37.789 -28.281   0.950

  No H/Q in entry =           5
  In of MODEL   28
    1    H    CYS 763           H        CYS 763  36.345 -24.164   2.046
    2    HA   CYS 763           HA       CYS 763  35.190 -23.850   4.617
    3    HB2  CYS 763           HB2      CYS 763  36.605 -21.958   5.372
    4    HB3  CYS 763           HB3      CYS 763  37.543 -23.430   5.206

  No H/Q in entry =           4
  In of MODEL   28
    1    H    THR 764           H        THR 764  34.790 -21.152   4.755
    2    HA   THR 764           HA       THR 764  33.347 -20.539   2.253
    3    HB   THR 764           HB       THR 764  32.921 -19.378   5.024
    4    HG1  THR 764           HG1      THR 764  32.649 -21.817   4.542
    5   HG22  THR 764          HG21      THR 764  30.682 -18.870   4.137
    6   HG21  THR 764          HG22      THR 764  31.118 -19.629   2.605
    7   HG23  THR 764          HG23      THR 764  31.940 -18.158   3.127

  No H/Q in entry =           7
  In of MODEL   28
    1    H    LEU 765           H        LEU 765  33.477 -18.207   1.568
    2    HA   LEU 765           HA       LEU 765  36.011 -17.296   2.470
    3    HB2  LEU 765           HB2      LEU 765  34.821 -17.159  -0.202
    4    HB3  LEU 765           HB3      LEU 765  36.070 -15.989   0.194
    5    HG   LEU 765           HG       LEU 765  37.190 -17.711  -0.925
    6   HD13  LEU 765          HD11      LEU 765  38.635 -18.795   0.642
    7   HD12  LEU 765          HD12      LEU 765  37.519 -18.510   1.949
    8   HD11  LEU 765          HD13      LEU 765  38.348 -17.144   1.196
    9   HD22  LEU 765          HD21      LEU 765  36.935 -20.015  -0.465
   10   HD21  LEU 765          HD22      LEU 765  35.382 -19.232  -0.923
   11   HD23  LEU 765          HD23      LEU 765  35.749 -19.595   0.794

  No H/Q in entry =          11
  In of MODEL   28
    1    HA   PRO 766           HA       PRO 766  34.604 -13.902   4.732
    2    HB2  PRO 766           HB2      PRO 766  36.980 -12.556   4.573
    3    HB3  PRO 766           HB3      PRO 766  36.644 -13.875   5.704
    4    HG2  PRO 766           HG2      PRO 766  37.975 -13.991   2.990
    5    HG3  PRO 766           HG3      PRO 766  38.495 -14.778   4.502
    6    HD2  PRO 766           HD2      PRO 766  37.354 -16.025   2.630
    7    HD3  PRO 766           HD3      PRO 766  36.830 -16.341   4.306

  No H/Q in entry =           7
  In of MODEL   28
    1    H    ALA 767           H        ALA 767  36.448 -13.073   1.801
    2    HA   ALA 767           HA       ALA 767  36.084 -10.291   2.127
    3    HB2  ALA 767           HB1      ALA 767  36.893 -11.656  -0.390
    4    HB1  ALA 767           HB2      ALA 767  37.940 -11.404   1.007
    5    HB3  ALA 767           HB3      ALA 767  37.271 -10.004   0.149

  No H/Q in entry =           5
  In of MODEL   28
    1    H    SER 768           H        SER 768  35.450  -8.798   0.758
    2    HA   SER 768           HA       SER 768  33.988  -7.594  -0.286
    3    HB2  SER 768           HB2      SER 768  32.219 -10.002  -0.532
    4    HB3  SER 768           HB3      SER 768  31.986  -8.399  -1.233
    5    HG   SER 768           HG       SER 768  34.335  -9.856  -1.740

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA 769           H        ALA 769  32.931  -6.194   0.772
    2    HA   ALA 769           HA       ALA 769  32.097  -6.497   3.396
    3    HB3  ALA 769           HB1      ALA 769  32.519  -4.307   2.454
    4    HB1  ALA 769           HB2      ALA 769  30.898  -4.433   3.191
    5    HB2  ALA 769           HB3      ALA 769  31.081  -4.490   1.429

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLU 770           H        GLU 770  30.164  -6.431   4.339
    2    HA   GLU 770           HA       GLU 770  28.278  -8.367   3.328
    3    HB2  GLU 770           HB2      GLU 770  27.355  -8.176   5.624
    4    HB3  GLU 770           HB3      GLU 770  29.061  -8.625   5.574
    5    HG2  GLU 770           HG2      GLU 770  28.289  -5.774   5.855
    6    HG3  GLU 770           HG3      GLU 770  28.228  -6.810   7.302

  No H/Q in entry =           6
  In of MODEL   28
    1    H    LYS 771           H        LYS 771  28.455  -5.543   2.502
    2    HA   LYS 771           HA       LYS 771  25.799  -4.572   3.223
    3    HB2  LYS 771           HB2      LYS 771  28.017  -3.393   1.670
    4    HB3  LYS 771           HB3      LYS 771  26.448  -2.613   1.994
    5    HG2  LYS 771           HG2      LYS 771  28.472  -3.444   4.102
    6    HG3  LYS 771           HG3      LYS 771  28.342  -1.805   3.471
    7    HD2  LYS 771           HD2      LYS 771  27.111  -1.651   5.419
    8    HD3  LYS 771           HD3      LYS 771  25.851  -2.005   4.249
    9    HE2  LYS 771           HE2      LYS 771  26.149  -4.507   4.998
   10    HE3  LYS 771           HE3      LYS 771  27.119  -3.834   6.267
   11    HZ1  LYS 771           HZ1      LYS 771  24.322  -2.998   5.814
   12    HZ3  LYS 771           HZ2      LYS 771  25.299  -2.569   7.107
   13    HZ2  LYS 771           HZ3      LYS 771  24.795  -4.168   6.937

  No H/Q in entry =          13
  In of MODEL   28
    1    H    ALA 772           H        ALA 772  24.254  -5.228   2.198
    2    HA   ALA 772           HA       ALA 772  24.377  -6.164  -0.528
    3    HB1  ALA 772           HB1      ALA 772  21.973  -6.578  -0.247
    4    HB2  ALA 772           HB2      ALA 772  22.003  -5.738   1.301
    5    HB3  ALA 772           HB3      ALA 772  22.883  -7.256   1.098

  No H/Q in entry =           5
  In of MODEL   28
    1    H    CYS 773           H        CYS 773  24.285  -4.832  -2.164
    2    HA   CYS 773           HA       CYS 773  22.795  -2.379  -2.071
    3    HB2  CYS 773           HB2      CYS 773  24.821  -0.992  -2.485
    4    HB3  CYS 773           HB3      CYS 773  24.705  -1.618  -0.835

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLY 774           H        GLY 774  25.268  -4.332  -3.696
    2    HA3  GLY 774           HA2      GLY 774  24.814  -5.061  -5.972
    3    HA2  GLY 774           HA3      GLY 774  24.101  -3.483  -6.262

  No H/Q in entry =           3
  In of MODEL   28
    1    H    ALA 775           H        ALA 775  27.011  -3.328  -4.383
    2    HA   ALA 775           HA       ALA 775  28.715  -3.154  -6.669
    3    HB1  ALA 775           HB1      ALA 775  28.215  -0.856  -4.758
    4    HB3  ALA 775           HB2      ALA 775  27.750  -0.899  -6.459
    5    HB2  ALA 775           HB3      ALA 775  29.454  -0.889  -6.012

  No H/Q in entry =           5
  In of MODEL   28
    1    H    CYS 776           H        CYS 776  30.785  -2.056  -5.411
    2    HA   CYS 776           HA       CYS 776  32.265  -1.959  -3.755
    3    HB2  CYS 776           HB2      CYS 776  31.009  -4.317  -2.318
    4    HB3  CYS 776           HB3      CYS 776  32.380  -3.379  -1.753

  No H/Q in entry =           4
  In of MODEL   28
    1    HA   PRO 777           HA       PRO 777  34.813  -5.807  -4.476
    2    HB2  PRO 777           HB2      PRO 777  33.362  -7.959  -5.728
    3    HB3  PRO 777           HB3      PRO 777  34.079  -7.914  -4.115
    4    HG2  PRO 777           HG2      PRO 777  31.386  -7.996  -4.535
    5    HG3  PRO 777           HG3      PRO 777  32.128  -7.230  -3.119
    6    HD2  PRO 777           HD2      PRO 777  31.180  -5.960  -5.666
    7    HD3  PRO 777           HD3      PRO 777  30.868  -5.457  -3.992

  No H/Q in entry =           7
  In of MODEL   28
    1    H    LEU 778           H        LEU 778  35.902  -6.970  -6.249
    2    HA   LEU 778           HA       LEU 778  35.854  -5.312  -8.557
    3    HB2  LEU 778           HB2      LEU 778  37.833  -6.510  -9.318
    4    HB3  LEU 778           HB3      LEU 778  37.975  -5.900  -7.687
    5    HG   LEU 778           HG       LEU 778  37.341  -8.783  -8.254
    6   HD12  LEU 778          HD11      LEU 778  39.760  -9.210  -7.997
    7   HD11  LEU 778          HD12      LEU 778  40.048  -7.468  -8.000
    8   HD13  LEU 778          HD13      LEU 778  39.389  -8.261  -9.432
    9   HD21  LEU 778          HD21      LEU 778  38.514  -7.326  -5.875
   10   HD23  LEU 778          HD22      LEU 778  38.491  -9.069  -6.047
   11   HD22  LEU 778          HD23      LEU 778  36.973  -8.196  -5.936

  No H/Q in entry =          11
  In of MODEL   28
    1    H    TRP 779           H        TRP 779  34.675  -8.513  -7.987
    2    HA   TRP 779           HA       TRP 779  33.707  -8.424 -10.773
    3    HB2  TRP 779           HB2      TRP 779  33.724 -10.917 -10.780
    4    HB3  TRP 779           HB3      TRP 779  35.339 -10.237 -10.596
    5    HD1  TRP 779           HD1      TRP 779  32.562 -11.808  -8.437
    6    HE1  TRP 779           HE1      TRP 779  33.622 -12.891  -6.411
    7    HE3  TRP 779           HE3      TRP 779  37.391 -10.525  -9.343
    8    HZ2  TRP 779           HZ2      TRP 779  36.228 -13.206  -5.349
    9    HZ3  TRP 779           HZ3      TRP 779  39.107 -11.263  -7.777
   10    HH2  TRP 779           HH2      TRP 779  38.546 -12.556  -5.825

  No H/Q in entry =          10
  In of MODEL   28
    1    H    GLY 780           H        GLY 780  32.957  -8.169  -7.669
    2    HA3  GLY 780           HA2      GLY 780  30.800  -7.915  -6.823
    3    HA2  GLY 780           HA3      GLY 780  30.195  -9.050  -8.040

  No H/Q in entry =           3
  In of MODEL   28
    1    H    LYS 781           H        LYS 781  29.157 -10.251  -6.302
    2    HA   LYS 781           HA       LYS 781  30.760 -12.413  -5.357
    3    HB2  LYS 781           HB2      LYS 781  31.192 -10.658  -3.575
    4    HB3  LYS 781           HB3      LYS 781  29.469 -10.763  -3.196
    5    HG2  LYS 781           HG2      LYS 781  29.639 -13.118  -2.794
    6    HG3  LYS 781           HG3      LYS 781  31.320 -13.110  -3.293
    7    HD2  LYS 781           HD2      LYS 781  31.800 -11.619  -1.403
    8    HD3  LYS 781           HD3      LYS 781  30.127 -11.869  -0.835
    9    HE2  LYS 781           HE2      LYS 781  30.521 -14.264  -0.903
   10    HE3  LYS 781           HE3      LYS 781  32.165 -13.948  -1.427
   11    HZ1  LYS 781           HZ1      LYS 781  32.527 -12.743   0.713
   12    HZ3  LYS 781           HZ2      LYS 781  32.180 -14.369   0.987
   13    HZ2  LYS 781           HZ3      LYS 781  30.987 -13.198   1.217

  No H/Q in entry =          13
  In of MODEL   28
    1    H    CYS 782           H        CYS 782  29.544 -14.110  -5.345
    2    HA   CYS 782           HA       CYS 782  26.675 -13.701  -4.963
    3    HB2  CYS 782           HB2      CYS 782  27.301 -14.633  -7.240
    4    HB3  CYS 782           HB3      CYS 782  28.031 -16.008  -6.416

  No H/Q in entry =           4
  In of MODEL   28
    1    H    ASP 783           H        ASP 783  26.792 -13.805  -2.784
    2    HA   ASP 783           HA       ASP 783  28.524 -15.611  -1.407
    3    HB2  ASP 783           HB2      ASP 783  27.713 -13.367  -0.559
    4    HB3  ASP 783           HB3      ASP 783  26.153 -14.123  -0.272

  No H/Q in entry =           4
  In of MODEL   28
    1    H    ALA 784           H        ALA 784  25.048 -15.338  -1.755
    2    HA   ALA 784           HA       ALA 784  24.308 -17.936  -2.156
    3    HB1  ALA 784           HB1      ALA 784  25.155 -18.414   0.136
    4    HB2  ALA 784           HB2      ALA 784  23.398 -18.494   0.120
    5    HB3  ALA 784           HB3      ALA 784  24.206 -17.068   0.768

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLU 785           H        GLU 785  21.854 -17.628  -0.554
    2    HA   GLU 785           HA       GLU 785  20.760 -15.268  -1.858
    3    HB2  GLU 785           HB2      GLU 785  19.501 -17.518  -0.271
    4    HB3  GLU 785           HB3      GLU 785  18.589 -16.088  -0.710
    5    HG2  GLU 785           HG2      GLU 785  18.159 -17.962  -2.234
    6    HG3  GLU 785           HG3      GLU 785  18.866 -16.588  -3.068

  No H/Q in entry =           6
  In of MODEL   28
    1    H    SER 786           H        SER 786  22.591 -15.638   0.601
    2    HA   SER 786           HA       SER 786  21.245 -14.254   2.713
    3    HB2  SER 786           HB2      SER 786  24.152 -14.959   2.462
    4    HB3  SER 786           HB3      SER 786  23.218 -14.696   3.934
    5    HG   SER 786           HG       SER 786  22.034 -16.555   3.453

  No H/Q in entry =           5
  In of MODEL   28
    1    H    SER 787           H        SER 787  20.851 -12.207   1.940
    2    HA   SER 787           HA       SER 787  21.150 -10.002   1.822
    3    HB2  SER 787           HB2      SER 787  23.890 -10.499   2.952
    4    HB3  SER 787           HB3      SER 787  22.961  -9.002   3.051
    5    HG   SER 787           HG       SER 787  22.867 -11.257   4.536

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LYS 788           H        LYS 788  24.518 -10.949   0.956
    2    HA   LYS 788           HA       LYS 788  24.422  -8.756  -0.946
    3    HB2  LYS 788           HB2      LYS 788  26.115  -8.569   0.745
    4    HB3  LYS 788           HB3      LYS 788  26.756 -10.147   0.336
    5    HG2  LYS 788           HG2      LYS 788  28.117  -8.216  -0.481
    6    HG3  LYS 788           HG3      LYS 788  27.613  -9.343  -1.744
    7    HD2  LYS 788           HD2      LYS 788  25.880  -7.865  -2.467
    8    HD3  LYS 788           HD3      LYS 788  26.135  -6.818  -1.066
    9    HE2  LYS 788           HE2      LYS 788  28.208  -7.333  -3.161
   10    HE3  LYS 788           HE3      LYS 788  27.072  -5.998  -3.249
   11    HZ1  LYS 788           HZ1      LYS 788  27.874  -5.274  -1.055
   12    HZ3  LYS 788           HZ2      LYS 788  29.050  -5.184  -2.251
   13    HZ2  LYS 788           HZ3      LYS 788  29.094  -6.447  -1.091

  No H/Q in entry =          13
  In of MODEL   28
    1    H    CYS 789           H        CYS 789  24.204  -9.045  -2.990
    2    HA   CYS 789           HA       CYS 789  25.747 -11.077  -4.346
    3    HB2  CYS 789           HB2      CYS 789  22.778 -10.729  -4.735
    4    HB3  CYS 789           HB3      CYS 789  23.847 -11.593  -5.845

  No H/Q in entry =           4
  In of MODEL   28
    1    H    VAL 790           H        VAL 790  26.649 -10.300  -6.099
    2    HA   VAL 790           HA       VAL 790  25.408  -8.455  -7.812
    3    HB   VAL 790           HB       VAL 790  26.193  -6.770  -6.254
    4   HG13  VAL 790          HG11      VAL 790  27.879  -8.005  -5.082
    5   HG12  VAL 790          HG12      VAL 790  28.601  -6.510  -5.700
    6   HG11  VAL 790          HG13      VAL 790  28.884  -8.051  -6.521
    7   HG22  VAL 790          HG21      VAL 790  26.398  -6.154  -8.592
    8   HG21  VAL 790          HG22      VAL 790  28.007  -6.859  -8.670
    9   HG23  VAL 790          HG23      VAL 790  27.717  -5.430  -7.672

  No H/Q in entry =           9
  In of MODEL   28
    1    H    CYS 791           H        CYS 791  26.570  -8.506  -9.878
    2    HA   CYS 791           HA       CYS 791  29.150  -9.784  -9.858
    3    HB2  CYS 791           HB2      CYS 791  28.548 -11.459 -11.523
    4    HB3  CYS 791           HB3      CYS 791  27.695 -11.705 -10.007

  No H/Q in entry =           4
  In of MODEL   28
    1    H    ARG 792           H        ARG 792  30.427  -9.066 -11.354
    2    HA   ARG 792           HA       ARG 792  29.360  -7.310 -13.424
    3    HB2  ARG 792           HB2      ARG 792  32.223  -7.916 -12.599
    4    HB3  ARG 792           HB3      ARG 792  31.783  -6.850 -13.916
    5    HG2  ARG 792           HG2      ARG 792  30.708  -5.326 -12.315
    6    HG3  ARG 792           HG3      ARG 792  31.184  -6.402 -10.995
    7    HD2  ARG 792           HD2      ARG 792  33.534  -6.109 -11.581
    8    HD3  ARG 792           HD3      ARG 792  33.086  -5.080 -12.932
    9    HE   ARG 792           HE       ARG 792  32.010  -3.838 -10.779
   10   HH11  ARG 792          HH11      ARG 792  35.276  -5.051 -11.435
   11   HH12  ARG 792          HH12      ARG 792  36.110  -3.832 -10.646
   12   HH21  ARG 792          HH21      ARG 792  33.135  -2.058  -9.686
   13   HH22  ARG 792          HH22      ARG 792  34.839  -2.044  -9.631

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLU 793           H        GLU 793  30.758  -7.720 -15.603
    2    HA   GLU 793           HA       GLU 793  30.646 -10.600 -16.087
    3    HB2  GLU 793           HB2      GLU 793  30.702  -8.328 -18.086
    4    HB3  GLU 793           HB3      GLU 793  30.566 -10.033 -18.477
    5    HG2  GLU 793           HG2      GLU 793  28.442 -10.097 -17.195
    6    HG3  GLU 793           HG3      GLU 793  28.562  -8.350 -17.005

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ALA 794           H        ALA 794  32.351 -11.234 -17.866
    2    HA   ALA 794           HA       ALA 794  34.860 -10.981 -16.541
    3    HB2  ALA 794           HB1      ALA 794  34.205 -13.019 -17.714
    4    HB3  ALA 794           HB2      ALA 794  35.729 -12.364 -18.301
    5    HB1  ALA 794           HB3      ALA 794  34.257 -12.150 -19.257

  No H/Q in entry =           5
  In of MODEL   28
    1    H    SER 795           H        SER 795  33.402  -9.424 -19.264
    2    HA   SER 795           HA       SER 795  35.807  -8.257 -20.196
    3    HB2  SER 795           HB2      SER 795  32.944  -7.574 -20.850
    4    HB3  SER 795           HB3      SER 795  34.370  -7.110 -21.784
    5    HG   SER 795           HG       SER 795  34.611  -9.102 -22.479

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLU 796           H        GLU 796  33.906  -7.586 -17.522
    2    HA   GLU 796           HA       GLU 796  34.139  -4.688 -17.691
    3    HB2  GLU 796           HB2      GLU 796  32.918  -6.425 -15.556
    4    HB3  GLU 796           HB3      GLU 796  32.852  -4.669 -15.588
    5    HG2  GLU 796           HG2      GLU 796  31.568  -6.581 -17.524
    6    HG3  GLU 796           HG3      GLU 796  30.751  -5.560 -16.343

  No H/Q in entry =           6
  In of MODEL   28
    1    H    CYS 797           H        CYS 797  36.395  -6.649 -17.269
    2    HA   CYS 797           HA       CYS 797  37.439  -6.279 -14.643
    3    HB2  CYS 797           HB2      CYS 797  38.121  -8.120 -16.149
    4    HB3  CYS 797           HB3      CYS 797  38.865  -6.940 -17.225

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLU 798           H        GLU 798  38.006  -4.338 -13.869
    2    HA   GLU 798           HA       GLU 798  39.287  -2.459 -15.721
    3    HB2  GLU 798           HB2      GLU 798  38.424  -0.637 -14.169
    4    HB3  GLU 798           HB3      GLU 798  37.234  -1.439 -15.178
    5    HG2  GLU 798           HG2      GLU 798  36.459  -2.731 -13.307
    6    HG3  GLU 798           HG3      GLU 798  37.756  -2.102 -12.293

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU 799           H        GLU 799  39.461  -4.037 -12.697
    2    HA   GLU 799           HA       GLU 799  41.869  -2.606 -12.014
    3    HB2  GLU 799           HB2      GLU 799  41.726  -3.922  -9.858
    4    HB3  GLU 799           HB3      GLU 799  40.452  -2.752 -10.137
    5    HG2  GLU 799           HG2      GLU 799  40.167  -5.646 -10.769
    6    HG3  GLU 799           HG3      GLU 799  39.799  -4.994  -9.168

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLU 800           H        GLU 800  43.330  -4.515 -10.648
    2    HA   GLU 800           HA       GLU 800  44.064  -6.358 -12.773
    3    HB2  GLU 800           HB2      GLU 800  45.998  -4.544 -11.338
    4    HB3  GLU 800           HB3      GLU 800  46.383  -5.706 -12.595
    5    HG2  GLU 800           HG2      GLU 800  45.124  -4.400 -14.202
    6    HG3  GLU 800           HG3      GLU 800  44.701  -3.240 -12.945

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLY 801           H        GLY 801  43.335  -7.955 -11.472
    2    HA3  GLY 801           HA2      GLY 801  44.739  -8.464  -8.948
    3    HA2  GLY 801           HA3      GLY 801  43.397  -9.411  -9.591

  No H/Q in entry =           3
  In of MODEL   28
    1    H    PHE 802           H        PHE 802  44.498 -11.375  -9.387
    2    HA   PHE 802           HA       PHE 802  46.974 -11.800 -10.761
    3    HB2  PHE 802           HB2      PHE 802  45.205 -13.314  -8.980
    4    HB3  PHE 802           HB3      PHE 802  46.044 -14.271 -10.193
    5    HD1  PHE 802           HD1      PHE 802  46.525 -11.941  -7.334
    6    HD2  PHE 802           HD2      PHE 802  48.294 -14.737 -10.017
    7    HE1  PHE 802           HE1      PHE 802  48.527 -11.980  -5.981
    8    HE2  PHE 802           HE2      PHE 802  50.302 -14.770  -8.641
    9    HZ   PHE 802           HZ       PHE 802  50.416 -13.390  -6.615

  No H/Q in entry =           9
  In of MODEL   28
    1    H    SER 803           H        SER 803  47.166 -13.667 -12.185
    2    HA   SER 803           HA       SER 803  44.854 -14.121 -13.883
    3    HB2  SER 803           HB2      SER 803  47.784 -14.473 -14.610
    4    HB3  SER 803           HB3      SER 803  46.372 -14.489 -15.677
    5    HG   SER 803           HG       SER 803  47.192 -12.519 -15.937

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ILE 804           H        ILE 804  44.075 -15.973 -13.215
    2    HA   ILE 804           HA       ILE 804  45.852 -17.980 -11.972
    3    HB   ILE 804           HB       ILE 804  44.063 -18.708 -10.548
    4   HG12  ILE 804          HG12      ILE 804  42.107 -18.470 -12.060
    5   HG13  ILE 804          HG13      ILE 804  41.805 -17.738 -10.494
    6   HG23  ILE 804          HG21      ILE 804  43.602 -16.720  -9.184
    7   HG22  ILE 804          HG22      ILE 804  44.145 -15.703 -10.504
    8   HG21  ILE 804          HG23      ILE 804  45.285 -16.800  -9.714
    9   HD13  ILE 804          HD11      ILE 804  40.856 -16.360 -12.151
   10   HD12  ILE 804          HD12      ILE 804  42.314 -16.356 -13.106
   11   HD11  ILE 804          HD13      ILE 804  42.283 -15.510 -11.546

  No H/Q in entry =          11
  In of MODEL   28
    1    H    CYS 805           H        CYS 805  44.490 -20.216 -11.940
    2    HA   CYS 805           HA       CYS 805  43.972 -20.767 -14.771
    3    HB2  CYS 805           HB2      CYS 805  45.983 -21.834 -13.908
    4    HB3  CYS 805           HB3      CYS 805  45.064 -22.537 -12.586

  No H/Q in entry =           4
  In of MODEL   28
    1    H    VAL 806           H        VAL 806  41.945 -21.335 -15.260
    2    HA   VAL 806           HA       VAL 806  40.316 -22.614 -13.195
    3    HB   VAL 806           HB       VAL 806  39.333 -20.593 -15.195
    4   HG13  VAL 806          HG11      VAL 806  37.634 -22.133 -14.558
    5   HG12  VAL 806          HG12      VAL 806  37.294 -20.569 -13.800
    6   HG11  VAL 806          HG13      VAL 806  37.973 -21.894 -12.852
    7   HG22  VAL 806          HG21      VAL 806  40.722 -19.404 -13.646
    8   HG21  VAL 806          HG22      VAL 806  39.902 -20.150 -12.269
    9   HG23  VAL 806          HG23      VAL 806  39.031 -19.028 -13.327

  No H/Q in entry =           9
  In of MODEL   28
    1    H    GLU 807           H        GLU 807  39.289 -24.376 -13.937
    2    HA   GLU 807           HA       GLU 807  39.703 -25.191 -16.661
    3    HB2  GLU 807           HB2      GLU 807  39.955 -26.779 -14.784
    4    HB3  GLU 807           HB3      GLU 807  38.267 -26.537 -14.367
    5    HG2  GLU 807           HG2      GLU 807  37.607 -27.480 -16.510
    6    HG3  GLU 807           HG3      GLU 807  39.302 -27.710 -16.931

  No H/Q in entry =           6
  In of MODEL   28
    1    H    VAL 808           H        VAL 808  38.352 -24.982 -18.179
    2    HA   VAL 808           HA       VAL 808  35.540 -24.517 -17.713
    3    HB   VAL 808           HB       VAL 808  36.671 -22.282 -17.751
    4   HG13  VAL 808          HG11      VAL 808  37.579 -21.376 -19.831
    5   HG12  VAL 808          HG12      VAL 808  37.463 -22.981 -20.552
    6   HG11  VAL 808          HG13      VAL 808  38.539 -22.709 -19.180
    7   HG22  VAL 808          HG21      VAL 808  34.371 -22.417 -18.441
    8   HG21  VAL 808          HG22      VAL 808  34.873 -22.831 -20.087
    9   HG23  VAL 808          HG23      VAL 808  35.235 -21.232 -19.426

  No H/Q in entry =           9
  In of MODEL   28
    1    H    ASN 809           H        ASN 809  34.373 -25.397 -19.393
    2    HA   ASN 809           HA       ASN 809  33.900 -26.556 -21.278
    3    HB2  ASN 809           HB2      ASN 809  36.351 -25.122 -22.073
    4    HB3  ASN 809           HB3      ASN 809  35.722 -26.329 -23.205
    5   HD21  ASN 809          HD21      ASN 809  35.503 -23.178 -21.878
    6   HD22  ASN 809          HD22      ASN 809  34.189 -22.586 -22.816

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLY 810           H        GLY 810  36.064 -27.502 -19.148
    2    HA3  GLY 810           HA2      GLY 810  36.472 -29.832 -18.848
    3    HA2  GLY 810           HA3      GLY 810  36.636 -29.980 -20.597

  No H/Q in entry =           3
  In of MODEL   28
    1    H    LYS 811           H        LYS 811  38.244 -27.336 -20.371
    2    HA   LYS 811           HA       LYS 811  40.783 -28.648 -19.644
    3    HB2  LYS 811           HB2      LYS 811  41.836 -27.332 -21.475
    4    HB3  LYS 811           HB3      LYS 811  40.652 -28.496 -22.051
    5    HG2  LYS 811           HG2      LYS 811  38.999 -26.626 -22.183
    6    HG3  LYS 811           HG3      LYS 811  40.310 -25.516 -21.785
    7    HD2  LYS 811           HD2      LYS 811  40.254 -27.367 -24.162
    8    HD3  LYS 811           HD3      LYS 811  39.854 -25.659 -24.216
    9    HE2  LYS 811           HE2      LYS 811  42.144 -25.130 -23.434
   10    HE3  LYS 811           HE3      LYS 811  42.534 -26.847 -23.498
   11    HZ2  LYS 811           HZ1      LYS 811  43.245 -25.613 -25.493
   12    HZ1  LYS 811           HZ2      LYS 811  41.643 -25.237 -25.829
   13    HZ3  LYS 811           HZ3      LYS 811  42.145 -26.844 -25.864

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLU 812           H        GLU 812  42.557 -26.983 -19.219
    2    HA   GLU 812           HA       GLU 812  41.407 -25.010 -17.396
    3    HB2  GLU 812           HB2      GLU 812  44.249 -25.978 -17.645
    4    HB3  GLU 812           HB3      GLU 812  43.658 -24.857 -16.429
    5    HG2  GLU 812           HG2      GLU 812  43.236 -26.591 -15.115
    6    HG3  GLU 812           HG3      GLU 812  42.019 -27.135 -16.272

  No H/Q in entry =           6
  In of MODEL   28
    1    H    GLN 813           H        GLN 813  41.278 -22.958 -17.902
    2    HA   GLN 813           HA       GLN 813  43.225 -21.859 -19.817
    3    HB2  GLN 813           HB2      GLN 813  41.057 -21.815 -20.822
    4    HB3  GLN 813           HB3      GLN 813  40.309 -21.183 -19.363
    5    HG2  GLN 813           HG2      GLN 813  41.459 -19.082 -19.654
    6    HG3  GLN 813           HG3      GLN 813  42.286 -19.688 -21.096
    7   HE21  GLN 813          HE21      GLN 813  39.870 -21.053 -22.006
    8   HE22  GLN 813          HE22      GLN 813  38.818 -19.833 -22.599

  No H/Q in entry =           8
  In of MODEL   28
    1    H    THR 814           H        THR 814  44.206 -19.917 -19.270
    2    HA   THR 814           HA       THR 814  44.139 -19.158 -16.501
    3    HB   THR 814           HB       THR 814  45.496 -17.840 -18.846
    4    HG1  THR 814           HG1      THR 814  47.252 -19.148 -18.347
    5   HG22  THR 814          HG21      THR 814  46.089 -17.706 -15.879
    6   HG21  THR 814          HG22      THR 814  45.365 -16.419 -16.840
    7   HG23  THR 814          HG23      THR 814  47.031 -16.916 -17.145

  No H/Q in entry =           7
  In of MODEL   28
    1    H    MET 815           H        MET 815  42.956 -17.554 -15.701
    2    HA   MET 815           HA       MET 815  41.564 -15.686 -17.546
    3    HB2  MET 815           HB2      MET 815  40.502 -16.797 -14.977
    4    HB3  MET 815           HB3      MET 815  39.648 -15.752 -16.110
    5    HG2  MET 815           HG2      MET 815  40.088 -17.811 -17.740
    6    HG3  MET 815           HG3      MET 815  40.321 -18.561 -16.160
    7    HE2  MET 815           HE1      MET 815  38.474 -20.303 -17.012
    8    HE1  MET 815           HE2      MET 815  38.234 -19.316 -18.438
    9    HE3  MET 815           HE3      MET 815  36.836 -19.806 -17.466

  No H/Q in entry =           9
  In of MODEL   28
    1    H    SER 816           H        SER 816  40.904 -13.760 -16.460
    2    HA   SER 816           HA       SER 816  43.029 -12.834 -14.699
    3    HB2  SER 816           HB2      SER 816  40.619 -11.352 -15.786
    4    HB3  SER 816           HB3      SER 816  42.056 -10.640 -15.059
    5    HG   SER 816           HG       SER 816  42.626 -12.288 -17.171

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLU 817           H        GLU 817  42.534 -12.042 -12.632
    2    HA   GLU 817           HA       GLU 817  41.054 -13.483 -10.912
    3    HB2  GLU 817           HB2      GLU 817  42.676 -11.480 -10.624
    4    HB3  GLU 817           HB3      GLU 817  41.199 -10.530 -10.563
    5    HG2  GLU 817           HG2      GLU 817  41.340 -10.987  -8.347
    6    HG3  GLU 817           HG3      GLU 817  40.609 -12.521  -8.873

  No H/Q in entry =           6
  In of MODEL   28
    1    H    CYS 818           H        CYS 818  40.046 -10.437 -12.399
    2    HA   CYS 818           HA       CYS 818  37.502 -10.312 -11.242
    3    HB2  CYS 818           HB2      CYS 818  38.426  -9.003 -13.788
    4    HB3  CYS 818           HB3      CYS 818  37.016  -8.547 -12.832

  No H/Q in entry =           4
  In of MODEL   28
    1    H    GLU 819           H        GLU 819  38.524 -11.796 -14.322
    2    HA   GLU 819           HA       GLU 819  35.819 -12.040 -15.143
    3    HB2  GLU 819           HB2      GLU 819  36.782 -13.369 -17.078
    4    HB3  GLU 819           HB3      GLU 819  37.596 -11.829 -16.809
    5    HG2  GLU 819           HG2      GLU 819  39.220 -13.165 -15.699
    6    HG3  GLU 819           HG3      GLU 819  38.239 -14.521 -16.340

  No H/Q in entry =           6
  In of MODEL   28
    1    H    ALA 820           H        ALA 820  38.253 -14.367 -14.134
    2    HA   ALA 820           HA       ALA 820  36.833 -16.640 -14.049
    3    HB1  ALA 820           HB1      ALA 820  39.097 -16.204 -13.807
    4    HB2  ALA 820           HB2      ALA 820  38.539 -17.265 -12.462
    5    HB3  ALA 820           HB3      ALA 820  38.858 -15.514 -12.223

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLY 821           H        GLY 821  37.135 -14.136 -11.526
    2    HA3  GLY 821           HA2      GLY 821  35.512 -15.434  -9.612
    3    HA2  GLY 821           HA3      GLY 821  35.924 -13.724  -9.630

  No H/Q in entry =           3
  In of MODEL   28
    1    H    ALA 822           H        ALA 822  34.841 -12.984 -12.061
    2    HA   ALA 822           HA       ALA 822  32.178 -12.432 -11.404
    3    HB3  ALA 822           HB1      ALA 822  32.000 -11.566 -13.667
    4    HB1  ALA 822           HB2      ALA 822  33.586 -12.298 -14.060
    5    HB2  ALA 822           HB3      ALA 822  33.474 -11.012 -12.868

  No H/Q in entry =           5
  In of MODEL   28
    1    H    LEU 823           H        LEU 823  33.646 -14.776 -13.521
    2    HA   LEU 823           HA       LEU 823  31.316 -15.756 -14.660
    3    HB2  LEU 823           HB2      LEU 823  33.971 -17.101 -14.210
    4    HB3  LEU 823           HB3      LEU 823  32.706 -17.766 -15.223
    5    HG   LEU 823           HG       LEU 823  34.060 -15.104 -15.681
    6   HD11  LEU 823          HD11      LEU 823  35.579 -16.959 -16.059
    7   HD13  LEU 823          HD12      LEU 823  35.192 -16.061 -17.505
    8   HD12  LEU 823          HD13      LEU 823  34.441 -17.647 -17.234
    9   HD23  LEU 823          HD21      LEU 823  32.947 -15.204 -17.886
   10   HD22  LEU 823          HD22      LEU 823  31.835 -15.046 -16.537
   11   HD21  LEU 823          HD23      LEU 823  32.028 -16.610 -17.330

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ARG 824           H        ARG 824  32.951 -16.685 -11.692
    2    HA   ARG 824           HA       ARG 824  31.221 -18.856 -10.970
    3    HB2  ARG 824           HB2      ARG 824  32.445 -16.904  -8.998
    4    HB3  ARG 824           HB3      ARG 824  31.991 -18.567  -8.696
    5    HG2  ARG 824           HG2      ARG 824  33.861 -19.297 -10.152
    6    HG3  ARG 824           HG3      ARG 824  34.316 -17.604 -10.362
    7    HD2  ARG 824           HD2      ARG 824  34.278 -19.206  -7.813
    8    HD3  ARG 824           HD3      ARG 824  35.695 -18.615  -8.664
    9    HE   ARG 824           HE       ARG 824  34.102 -16.418  -8.041
   10   HH11  ARG 824          HH11      ARG 824  36.096 -18.802  -6.311
   11   HH12  ARG 824          HH12      ARG 824  36.440 -17.823  -4.961
   12   HH21  ARG 824          HH21      ARG 824  34.553 -15.024  -6.131
   13   HH22  ARG 824          HH22      ARG 824  35.506 -15.587  -4.859

  No H/Q in entry =          13
  In of MODEL   28
    1    H    CYS 825           H        CYS 825  31.210 -15.442 -10.351
    2    HA   CYS 825           HA       CYS 825  28.942 -15.367  -8.717
    3    HB2  CYS 825           HB2      CYS 825  30.599 -13.360 -10.112
    4    HB3  CYS 825           HB3      CYS 825  29.189 -12.836  -9.225

  No H/Q in entry =           4
  In of MODEL   28
    1    H    ARG 826           H        ARG 826  29.221 -15.209 -12.196
    2    HA   ARG 826           HA       ARG 826  26.486 -14.240 -12.366
    3    HB2  ARG 826           HB2      ARG 826  26.798 -14.256 -14.773
    4    HB3  ARG 826           HB3      ARG 826  28.016 -13.256 -13.960
    5    HG2  ARG 826           HG2      ARG 826  29.636 -14.955 -14.340
    6    HG3  ARG 826           HG3      ARG 826  28.414 -16.052 -15.009
    7    HD2  ARG 826           HD2      ARG 826  29.270 -13.388 -16.149
    8    HD3  ARG 826           HD3      ARG 826  29.617 -14.982 -16.831
    9    HE   ARG 826           HE       ARG 826  27.070 -15.174 -16.840
   10   HH11  ARG 826          HH11      ARG 826  28.944 -12.362 -17.794
   11   HH12  ARG 826          HH12      ARG 826  27.688 -11.571 -18.622
   12   HH21  ARG 826          HH21      ARG 826  25.306 -14.162 -17.950
   13   HH22  ARG 826          HH22      ARG 826  25.516 -12.645 -18.685

  No H/Q in entry =          13
  In of MODEL   28
    1    H    GLY 827           H        GLY 827  27.968 -17.148 -12.045
    2    HA3  GLY 827           HA2      GLY 827  26.673 -19.138 -11.866
    3    HA2  GLY 827           HA3      GLY 827  25.521 -18.406 -12.983

  No H/Q in entry =           3
  In of MODEL   28
    1    H    GLN 828           H        GLN 828  28.601 -17.957 -14.141
    2    HA   GLN 828           HA       GLN 828  28.230 -19.805 -16.282
    3    HB2  GLN 828           HB2      GLN 828  29.529 -17.697 -16.527
    4    HB3  GLN 828           HB3      GLN 828  30.742 -18.346 -15.438
    5    HG2  GLN 828           HG2      GLN 828  31.422 -18.505 -17.815
    6    HG3  GLN 828           HG3      GLN 828  31.308 -20.072 -17.021
    7   HE21  GLN 828          HE21      GLN 828  29.784 -17.929 -19.333
    8   HE22  GLN 828          HE22      GLN 828  28.815 -19.142 -20.066

  No H/Q in entry =           8
  In of MODEL   28
    1    H    SER 829           H        SER 829  29.377 -21.760 -16.693
    2    HA   SER 829           HA       SER 829  30.036 -23.190 -14.281
    3    HB2  SER 829           HB2      SER 829  29.971 -24.135 -17.155
    4    HB3  SER 829           HB3      SER 829  29.998 -25.155 -15.715
    5    HG   SER 829           HG       SER 829  28.009 -24.011 -15.129

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ILE 830           H        ILE 830  32.010 -22.900 -13.500
    2    HA   ILE 830           HA       ILE 830  34.342 -23.430 -15.160
    3    HB   ILE 830           HB       ILE 830  35.606 -21.553 -14.394
    4   HG12  ILE 830          HG12      ILE 830  34.683 -21.318 -12.101
    5   HG13  ILE 830          HG13      ILE 830  34.807 -19.762 -12.878
    6   HG22  ILE 830          HG21      ILE 830  34.469 -19.585 -15.351
    7   HG21  ILE 830          HG22      ILE 830  32.986 -20.545 -15.415
    8   HG23  ILE 830          HG23      ILE 830  34.388 -21.035 -16.359
    9   HD13  ILE 830          HD11      ILE 830  32.774 -19.917 -11.621
   10   HD12  ILE 830          HD12      ILE 830  32.314 -21.382 -12.478
   11   HD11  ILE 830          HD13      ILE 830  32.390 -19.844 -13.340

  No H/Q in entry =          11
  In of MODEL   28
    1    H    SER 831           H        SER 831  36.141 -24.055 -13.883
    2    HA   SER 831           HA       SER 831  35.566 -24.519 -11.064
    3    HB2  SER 831           HB2      SER 831  36.729 -26.381 -13.096
    4    HB3  SER 831           HB3      SER 831  36.788 -26.629 -11.354
    5    HG   SER 831           HG       SER 831  34.471 -26.308 -12.967

  No H/Q in entry =           5
  In of MODEL   28
    1    H    VAL 832           H        VAL 832  37.032 -23.177 -10.066
    2    HA   VAL 832           HA       VAL 832  39.522 -22.455 -11.285
    3    HB   VAL 832           HB       VAL 832  38.689 -22.140  -8.384
    4   HG12  VAL 832          HG11      VAL 832  40.885 -20.742  -9.944
    5   HG11  VAL 832          HG12      VAL 832  41.138 -21.970  -8.721
    6   HG13  VAL 832          HG13      VAL 832  40.451 -20.407  -8.267
    7   HG23  VAL 832          HG21      VAL 832  38.130 -19.813  -8.986
    8   HG22  VAL 832          HG22      VAL 832  37.141 -20.979  -9.865
    9   HG21  VAL 832          HG23      VAL 832  38.484 -20.178 -10.675

  No H/Q in entry =           9
  In of MODEL   28
    1    H    THR 833           H        THR 833  41.184 -23.779 -11.477
    2    HA   THR 833           HA       THR 833  41.282 -26.122  -9.797
    3    HB   THR 833           HB       THR 833  43.107 -26.791 -11.375
    4    HG1  THR 833           HG1      THR 833  43.327 -25.481 -13.250
    5   HG21  THR 833          HG21      THR 833  40.775 -27.469 -11.736
    6   HG23  THR 833          HG22      THR 833  41.594 -27.185 -13.270
    7   HG22  THR 833          HG23      THR 833  40.478 -25.979 -12.625

  No H/Q in entry =           7
  In of MODEL   28
    1    H    SER 834           H        SER 834  43.106 -23.181 -10.452
    2    HA   SER 834           HA       SER 834  44.625 -23.629  -8.087
    3    HB2  SER 834           HB2      SER 834  46.783 -23.414  -9.435
    4    HB3  SER 834           HB3      SER 834  45.955 -24.981  -9.369
    5    HG   SER 834           HG       SER 834  44.932 -24.308 -11.369

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ILE 835           H        ILE 835  46.002 -21.922  -7.542
    2    HA   ILE 835           HA       ILE 835  44.938 -19.284  -8.225
    3    HB   ILE 835           HB       ILE 835  46.154 -18.542  -6.286
    4   HG12  ILE 835          HG12      ILE 835  47.628 -21.213  -6.459
    5   HG13  ILE 835          HG13      ILE 835  48.265 -19.583  -6.687
    6   HG21  ILE 835          HG21      ILE 835  44.112 -19.890  -5.848
    7   HG23  ILE 835          HG22      ILE 835  45.293 -20.053  -4.548
    8   HG22  ILE 835          HG23      ILE 835  45.113 -21.337  -5.739
    9   HD13  ILE 835          HD11      ILE 835  47.980 -19.074  -4.419
   10   HD12  ILE 835          HD12      ILE 835  48.900 -20.583  -4.607
   11   HD11  ILE 835          HD13      ILE 835  47.198 -20.633  -4.133

  No H/Q in entry =          11
  In of MODEL   28
    1    H    ARG 836           H        ARG 836  47.135 -21.258  -9.452
    2    HA   ARG 836           HA       ARG 836  49.245 -19.326 -10.121
    3    HB2  ARG 836           HB2      ARG 836  48.952 -22.225 -10.946
    4    HB3  ARG 836           HB3      ARG 836  50.393 -21.238 -11.060
    5    HG2  ARG 836           HG2      ARG 836  49.123 -22.117  -8.478
    6    HG3  ARG 836           HG3      ARG 836  50.455 -22.954  -9.266
    7    HD2  ARG 836           HD2      ARG 836  51.784 -20.856  -9.084
    8    HD3  ARG 836           HD3      ARG 836  50.451 -20.156  -8.165
    9    HE   ARG 836           HE       ARG 836  50.936 -22.420  -6.819
   10   HH11  ARG 836          HH11      ARG 836  53.114 -19.824  -7.862
   11   HH12  ARG 836          HH12      ARG 836  54.223 -20.085  -6.604
   12   HH21  ARG 836          HH21      ARG 836  52.535 -22.776  -5.120
   13   HH22  ARG 836          HH22      ARG 836  53.891 -21.757  -5.067

  No H/Q in entry =          13
  In of MODEL   28
    1    HA   PRO 837           HA       PRO 837  47.278 -18.830 -14.116
    2    HB2  PRO 837           HB2      PRO 837  49.439 -18.208 -15.657
    3    HB3  PRO 837           HB3      PRO 837  48.692 -17.046 -14.559
    4    HG2  PRO 837           HG2      PRO 837  51.155 -18.691 -14.179
    5    HG3  PRO 837           HG3      PRO 837  50.848 -17.006 -13.717
    6    HD2  PRO 837           HD2      PRO 837  50.740 -19.086 -11.951
    7    HD3  PRO 837           HD3      PRO 837  49.774 -17.607 -11.774

  No H/Q in entry =           7
  In of MODEL   28
    1    H    CYS 838           H        CYS 838  47.103 -20.033 -16.085
    2    HA   CYS 838           HA       CYS 838  48.385 -22.649 -15.932
    3    HB2  CYS 838           HB2      CYS 838  45.879 -22.490 -16.220
    4    HB3  CYS 838           HB3      CYS 838  46.174 -21.618 -17.718

  No H/Q in entry =           4
  In of MODEL   28
    1    H    ALA 839           H        ALA 839  49.125 -23.510 -18.069
    2    HA   ALA 839           HA       ALA 839  50.805 -21.675 -19.408
    3    HB3  ALA 839           HB1      ALA 839  51.354 -24.056 -19.203
    4    HB2  ALA 839           HB2      ALA 839  51.322 -23.541 -20.887
    5    HB1  ALA 839           HB3      ALA 839  49.970 -24.462 -20.221

  No H/Q in entry =           5
  In of MODEL   28
    1    H    ALA 840           H        ALA 840  47.574 -22.668 -19.772
    2    HA   ALA 840           HA       ALA 840  47.248 -21.790 -22.481
    3    HB2  ALA 840           HB1      ALA 840  45.200 -22.541 -20.411
    4    HB1  ALA 840           HB2      ALA 840  45.902 -23.624 -21.615
    5    HB3  ALA 840           HB3      ALA 840  44.878 -22.279 -22.126

  No H/Q in entry =           5
  In of MODEL   28
    1    H    GLU 841           H        GLU 841  48.363 -19.741 -21.447
    2    HA   GLU 841           HA       GLU 841  46.163 -17.803 -21.217
    3    HB2  GLU 841           HB2      GLU 841  47.719 -16.190 -20.202
    4    HB3  GLU 841           HB3      GLU 841  47.602 -17.648 -19.239
    5    HG2  GLU 841           HG2      GLU 841  49.752 -18.384 -19.991
    6    HG3  GLU 841           HG3      GLU 841  49.836 -17.067 -21.162

  No H/Q in entry =           6
  In of MODEL   28
    1    H    THR 842           H        THR 842  48.650 -18.991 -23.058
    2    HA   THR 842           HA       THR 842  48.579 -16.708 -24.875
    3    HB   THR 842           HB       THR 842  50.292 -19.165 -25.071
    4    HG1  THR 842           HG1      THR 842  50.810 -16.715 -23.659
    5   HG23  THR 842          HG21      THR 842  51.784 -17.665 -26.357
    6   HG22  THR 842          HG22      THR 842  50.641 -16.344 -26.108
    7   HG21  THR 842          HG23      THR 842  50.172 -17.747 -27.066

  No H/Q in entry =           7
  In of MODEL   28
    1    H    GLN 843           H        GLN 843  46.642 -17.111 -25.787
    2    HA   GLN 843           HA       GLN 843  46.058 -19.794 -26.782
    3    HB2  GLN 843           HB2      GLN 843  44.209 -17.412 -26.498
    4    HB3  GLN 843           HB3      GLN 843  43.732 -19.038 -26.963
    5    HG2  GLN 843           HG2      GLN 843  44.891 -18.243 -24.296
    6    HG3  GLN 843           HG3      GLN 843  43.187 -18.553 -24.623
    7   HE21  GLN 843          HE21      GLN 843  42.520 -20.666 -24.926
    8   HE22  GLN 843          HE22      GLN 843  43.489 -22.030 -24.480

  No H/Q in entry =           8
  In of MODEL   29
    1    H1   GLY 689           H3       GLY 689  59.825  21.971 -24.020
    2    H2   GLY 689           H2       GLY 689  59.616  20.425 -24.674
    3    H3   GLY 689           H1       GLY 689  58.270  21.292 -24.118
    4    HA2  GLY 689           HA2      GLY 689  58.956  19.567 -22.587
    5    HA3  GLY 689           HA3      GLY 689  59.131  21.175 -21.883

  No H/Q in entry =           5
  In of MODEL   29
    1    H    SER 690           H        SER 690  60.506  18.731 -21.275
    2    HA   SER 690           HA       SER 690  62.478  17.871 -20.834
    3    HB2  SER 690           HB2      SER 690  63.433  19.344 -23.290
    4    HB3  SER 690           HB3      SER 690  64.363  18.121 -22.418
    5    HG   SER 690           HG       SER 690  63.219  17.301 -24.207

  No H/Q in entry =           5
  In of MODEL   29
    1    H    HIS 691           H        HIS 691  64.154  18.162 -19.625
    2    HA   HIS 691           HA       HIS 691  65.286  20.801 -19.103
    3    HB2  HIS 691           HB2      HIS 691  64.392  18.752 -17.021
    4    HB3  HIS 691           HB3      HIS 691  65.385  20.143 -16.656
    5    HD1  HIS 691           HD1      HIS 691  64.159  22.425 -16.419
    6    HD2  HIS 691           HD2      HIS 691  61.668  19.233 -17.308
    7    HE1  HIS 691           HE1      HIS 691  61.836  23.244 -15.978
    8    HE2  HIS 691           HE2      HIS 691  60.371  21.250 -16.338

  No H/Q in entry =           8
  In of MODEL   29
    1    H    MET 692           H        MET 692  67.197  19.692 -17.230
    2    HA   MET 692           HA       MET 692  68.724  18.064 -19.011
    3    HB2  MET 692           HB2      MET 692  69.150  18.530 -16.041
    4    HB3  MET 692           HB3      MET 692  70.303  17.763 -17.120
    5    HG2  MET 692           HG2      MET 692  69.397  20.631 -17.166
    6    HG3  MET 692           HG3      MET 692  70.991  20.016 -16.747
    7    HE2  MET 692           HE1      MET 692  71.368  17.769 -19.042
    8    HE1  MET 692           HE2      MET 692  72.646  18.882 -18.555
    9    HE3  MET 692           HE3      MET 692  72.234  18.706 -20.260

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ASN 693           H        ASN 693  66.678  17.524 -16.258
    2    HA   ASN 693           HA       ASN 693  66.609  14.667 -16.942
    3    HB2  ASN 693           HB2      ASN 693  67.249  15.161 -14.595
    4    HB3  ASN 693           HB3      ASN 693  65.758  16.076 -14.399
    5   HD21  ASN 693          HD21      ASN 693  65.004  14.747 -12.735
    6   HD22  ASN 693          HD22      ASN 693  64.491  13.130 -13.051

  No H/Q in entry =           6
  In of MODEL   29
    1    HA   PRO 694           HA       PRO 694  62.566  15.991 -18.354
    2    HB2  PRO 694           HB2      PRO 694  61.876  13.793 -19.695
    3    HB3  PRO 694           HB3      PRO 694  63.159  14.854 -20.292
    4    HG2  PRO 694           HG2      PRO 694  63.378  12.250 -18.840
    5    HG3  PRO 694           HG3      PRO 694  64.336  12.854 -20.202
    6    HD2  PRO 694           HD2      PRO 694  65.124  12.941 -17.548
    7    HD3  PRO 694           HD3      PRO 694  65.770  13.981 -18.832

  No H/Q in entry =           7
  In of MODEL   29
    1    H    LEU 695           H        LEU 695  60.300  14.946 -18.300
    2    HA   LEU 695           HA       LEU 695  59.907  13.674 -15.715
    3    HB2  LEU 695           HB2      LEU 695  58.527  15.676 -16.593
    4    HB3  LEU 695           HB3      LEU 695  57.823  14.565 -17.736
    5    HG   LEU 695           HG       LEU 695  57.550  14.322 -14.724
    6   HD11  LEU 695          HD11      LEU 695  55.630  15.421 -16.762
    7   HD13  LEU 695          HD12      LEU 695  56.479  16.342 -15.520
    8   HD12  LEU 695          HD13      LEU 695  55.269  15.144 -15.060
    9   HD21  LEU 695          HD21      LEU 695  57.242  12.178 -15.903
   10   HD23  LEU 695          HD22      LEU 695  56.046  12.933 -16.957
   11   HD22  LEU 695          HD23      LEU 695  55.717  12.762 -15.234

  No H/Q in entry =          11
  In of MODEL   29
    1    H    THR 696           H        THR 696  60.194  11.520 -15.810
    2    HA   THR 696           HA       THR 696  59.042  10.123 -18.091
    3    HB   THR 696           HB       THR 696  61.494  10.421 -18.444
    4    HG1  THR 696           HG1      THR 696  61.247   8.653 -19.443
    5   HG22  THR 696          HG21      THR 696  61.774   8.726 -15.956
    6   HG21  THR 696          HG22      THR 696  62.240  10.419 -16.115
    7   HG23  THR 696          HG23      THR 696  63.087   9.178 -17.044

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLN 697           H        GLN 697  58.746   7.752 -17.587
    2    HA   GLN 697           HA       GLN 697  58.283   7.303 -14.725
    3    HB2  GLN 697           HB2      GLN 697  56.256   8.271 -16.019
    4    HB3  GLN 697           HB3      GLN 697  56.192   6.725 -16.837
    5    HG2  GLN 697           HG2      GLN 697  55.890   7.121 -13.858
    6    HG3  GLN 697           HG3      GLN 697  54.554   6.989 -14.987
    7   HE21  GLN 697          HE21      GLN 697  56.978   5.320 -13.202
    8   HE22  GLN 697          HE22      GLN 697  56.485   3.738 -13.591

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ALA 698           H        ALA 698  59.259   5.411 -14.274
    2    HA   ALA 698           HA       ALA 698  59.761   3.438 -16.390
    3    HB1  ALA 698           HB1      ALA 698  61.657   4.171 -14.950
    4    HB2  ALA 698           HB2      ALA 698  61.293   2.450 -14.790
    5    HB3  ALA 698           HB3      ALA 698  60.763   3.580 -13.547

  No H/Q in entry =           5
  In of MODEL   29
    1    H    VAL 699           H        VAL 699  58.396   2.022 -16.749
    2    HA   VAL 699           HA       VAL 699  56.333   1.441 -15.023
    3    HB   VAL 699           HB       VAL 699  55.843  -0.340 -16.649
    4   HG12  VAL 699          HG11      VAL 699  56.303   2.433 -17.749
    5   HG11  VAL 699          HG12      VAL 699  54.884   1.879 -16.860
    6   HG13  VAL 699          HG13      VAL 699  55.224   1.232 -18.464
    7   HG23  VAL 699          HG21      VAL 699  58.221   0.766 -18.155
    8   HG22  VAL 699          HG22      VAL 699  57.053  -0.398 -18.787
    9   HG21  VAL 699          HG23      VAL 699  58.089  -0.835 -17.427

  No H/Q in entry =           9
  In of MODEL   29
    1    HA   PRO 700           HA       PRO 700  58.397  -1.748 -12.724
    2    HB2  PRO 700           HB2      PRO 700  56.179  -2.549 -11.308
    3    HB3  PRO 700           HB3      PRO 700  57.239  -1.213 -10.871
    4    HG2  PRO 700           HG2      PRO 700  54.505  -1.109 -11.802
    5    HG3  PRO 700           HG3      PRO 700  55.538   0.207 -11.232
    6    HD2  PRO 700           HD2      PRO 700  54.821  -0.503 -13.958
    7    HD3  PRO 700           HD3      PRO 700  55.641   0.942 -13.327

  No H/Q in entry =           7
  In of MODEL   29
    1    H    LYS 701           H        LYS 701  58.889  -3.721 -13.168
    2    HA   LYS 701           HA       LYS 701  56.822  -5.326 -14.431
    3    HB2  LYS 701           HB2      LYS 701  59.806  -5.789 -14.464
    4    HB3  LYS 701           HB3      LYS 701  58.627  -6.869 -15.189
    5    HG2  LYS 701           HG2      LYS 701  59.378  -5.650 -17.022
    6    HG3  LYS 701           HG3      LYS 701  57.923  -4.779 -16.516
    7    HD2  LYS 701           HD2      LYS 701  59.257  -3.160 -15.335
    8    HD3  LYS 701           HD3      LYS 701  60.738  -4.012 -15.794
    9    HE2  LYS 701           HE2      LYS 701  58.756  -2.760 -17.684
   10    HE3  LYS 701           HE3      LYS 701  60.298  -2.050 -17.211
   11    HZ1  LYS 701           HZ1      LYS 701  61.395  -3.990 -18.215
   12    HZ3  LYS 701           HZ2      LYS 701  60.488  -3.098 -19.316
   13    HZ2  LYS 701           HZ3      LYS 701  59.884  -4.562 -18.743

  No H/Q in entry =          13
  In of MODEL   29
    1    H    CYS 702           H        CYS 702  55.850  -5.619 -12.442
    2    HA   CYS 702           HA       CYS 702  57.180  -7.552 -10.694
    3    HB2  CYS 702           HB2      CYS 702  55.383  -6.640  -9.078
    4    HB3  CYS 702           HB3      CYS 702  56.856  -5.722  -9.234

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLN 703           H        GLN 703  55.825  -9.190  -9.853
    2    HA   GLN 703           HA       GLN 703  53.493  -9.750 -11.447
    3    HB2  GLN 703           HB2      GLN 703  54.570 -11.047  -8.936
    4    HB3  GLN 703           HB3      GLN 703  53.236 -11.655  -9.903
    5    HG2  GLN 703           HG2      GLN 703  56.110 -11.416 -10.774
    6    HG3  GLN 703           HG3      GLN 703  55.249 -12.901 -10.376
    7   HE21  GLN 703          HE21      GLN 703  55.760 -10.442 -12.725
    8   HE22  GLN 703          HE22      GLN 703  54.899 -11.184 -14.024

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ARG 704           H        ARG 704  51.439 -10.173 -10.114
    2    HA   ARG 704           HA       ARG 704  50.849  -7.548  -9.145
    3    HB2  ARG 704           HB2      ARG 704  49.099  -9.982  -9.336
    4    HB3  ARG 704           HB3      ARG 704  48.517  -8.417  -8.785
    5    HG2  ARG 704           HG2      ARG 704  49.065  -7.414 -10.909
    6    HG3  ARG 704           HG3      ARG 704  49.826  -8.935 -11.409
    7    HD2  ARG 704           HD2      ARG 704  47.802 -10.062 -11.414
    8    HD3  ARG 704           HD3      ARG 704  46.926  -8.708 -10.687
    9    HE   ARG 704           HE       ARG 704  47.478  -7.488 -12.813
   10   HH11  ARG 704          HH11      ARG 704  47.420 -11.019 -12.870
   11   HH12  ARG 704          HH12      ARG 704  46.823 -11.179 -14.428
   12   HH21  ARG 704          HH21      ARG 704  46.696  -7.591 -14.909
   13   HH22  ARG 704          HH22      ARG 704  46.344  -9.071 -15.696

  No H/Q in entry =          13
  In of MODEL   29
    1    H    TRP 705           H        TRP 705  51.889 -10.289  -7.578
    2    HA   TRP 705           HA       TRP 705  50.980  -9.333  -4.983
    3    HB2  TRP 705           HB2      TRP 705  52.037 -11.442  -4.114
    4    HB3  TRP 705           HB3      TRP 705  50.736 -11.698  -5.267
    5    HD1  TRP 705           HD1      TRP 705  54.517 -12.091  -4.889
    6    HE1  TRP 705           HE1      TRP 705  55.376 -13.608  -6.768
    7    HE3  TRP 705           HE3      TRP 705  50.245 -12.497  -7.620
    8    HZ2  TRP 705           HZ2      TRP 705  54.366 -14.815  -9.111
    9    HZ3  TRP 705           HZ3      TRP 705  50.263 -13.826  -9.647
   10    HH2  TRP 705           HH2      TRP 705  52.289 -14.988 -10.387

  No H/Q in entry =          10
  In of MODEL   29
    1    H    GLU 706           H        GLU 706  53.309  -8.367  -6.999
    2    HA   GLU 706           HA       GLU 706  55.192  -7.897  -4.851
    3    HB2  GLU 706           HB2      GLU 706  55.775  -8.201  -7.819
    4    HB3  GLU 706           HB3      GLU 706  56.926  -7.805  -6.564
    5    HG2  GLU 706           HG2      GLU 706  56.608  -9.991  -5.564
    6    HG3  GLU 706           HG3      GLU 706  55.427 -10.389  -6.815

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LYS 707           H        LYS 707  56.420  -5.880  -5.410
    2    HA   LYS 707           HA       LYS 707  54.987  -3.987  -7.050
    3    HB2  LYS 707           HB2      LYS 707  54.839  -2.298  -5.281
    4    HB3  LYS 707           HB3      LYS 707  53.892  -3.719  -4.860
    5    HG2  LYS 707           HG2      LYS 707  55.408  -4.385  -3.206
    6    HG3  LYS 707           HG3      LYS 707  56.688  -3.348  -3.839
    7    HD2  LYS 707           HD2      LYS 707  55.794  -2.368  -1.816
    8    HD3  LYS 707           HD3      LYS 707  55.355  -1.369  -3.195
    9    HE2  LYS 707           HE2      LYS 707  53.120  -2.513  -3.188
   10    HE3  LYS 707           HE3      LYS 707  53.598  -3.298  -1.686
   11    HZ3  LYS 707           HZ1      LYS 707  52.398  -1.406  -1.046
   12    HZ2  LYS 707           HZ2      LYS 707  53.169  -0.416  -2.178
   13    HZ1  LYS 707           HZ3      LYS 707  54.010  -0.962  -0.831

  No H/Q in entry =          13
  In of MODEL   29
    1    H    LEU 708           H        LEU 708  56.283  -1.991  -7.254
    2    HA   LEU 708           HA       LEU 708  59.085  -2.575  -6.881
    3    HB2  LEU 708           HB2      LEU 708  58.309  -2.172  -9.194
    4    HB3  LEU 708           HB3      LEU 708  57.696  -0.606  -8.712
    5    HG   LEU 708           HG       LEU 708  60.588  -1.254  -8.395
    6   HD12  LEU 708          HD11      LEU 708  59.241  -0.226 -10.910
    7   HD11  LEU 708          HD12      LEU 708  60.001  -1.805 -10.724
    8   HD13  LEU 708          HD13      LEU 708  60.983  -0.343 -10.666
    9   HD21  LEU 708          HD21      LEU 708  59.112   1.325  -8.958
   10   HD23  LEU 708          HD22      LEU 708  60.857   1.171  -8.788
   11   HD22  LEU 708          HD23      LEU 708  59.805   0.831  -7.411

  No H/Q in entry =          11
  In of MODEL   29
    1    H    GLN 709           H        GLN 709  60.057  -1.573  -5.314
    2    HA   GLN 709           HA       GLN 709  59.283   1.128  -4.628
    3    HB2  GLN 709           HB2      GLN 709  59.155   0.736  -2.257
    4    HB3  GLN 709           HB3      GLN 709  58.095  -0.446  -3.005
    5    HG2  GLN 709           HG2      GLN 709  59.824  -2.161  -2.738
    6    HG3  GLN 709           HG3      GLN 709  60.886  -0.986  -2.002
    7   HE21  GLN 709          HE21      GLN 709  61.004  -2.122  -0.066
    8   HE22  GLN 709          HE22      GLN 709  59.705  -2.196   1.047

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ASN 710           H        ASN 710  61.042   2.259  -3.856
    2    HA   ASN 710           HA       ASN 710  63.231   2.830  -3.549
    3    HB2  ASN 710           HB2      ASN 710  62.891   0.833  -1.770
    4    HB3  ASN 710           HB3      ASN 710  63.888  -0.019  -2.915
    5   HD21  ASN 710          HD21      ASN 710  65.342  -0.236  -1.298
    6   HD22  ASN 710          HD22      ASN 710  66.409   1.045  -0.859

  No H/Q in entry =           6
  In of MODEL   29
    1    H    SER 711           H        SER 711  62.236   1.893  -6.068
    2    HA   SER 711           HA       SER 711  62.860   1.611  -8.171
    3    HB2  SER 711           HB2      SER 711  65.642   1.899  -7.055
    4    HB3  SER 711           HB3      SER 711  65.259   1.908  -8.788
    5    HG   SER 711           HG       SER 711  64.044   3.733  -8.483

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ARG 712           H        ARG 712  62.771  -0.766  -6.188
    2    HA   ARG 712           HA       ARG 712  63.734  -2.673  -8.177
    3    HB2  ARG 712           HB2      ARG 712  64.643  -4.131  -6.477
    4    HB3  ARG 712           HB3      ARG 712  65.437  -2.569  -6.413
    5    HG2  ARG 712           HG2      ARG 712  64.129  -1.966  -4.442
    6    HG3  ARG 712           HG3      ARG 712  63.253  -3.484  -4.560
    7    HD2  ARG 712           HD2      ARG 712  65.435  -4.697  -4.394
    8    HD3  ARG 712           HD3      ARG 712  66.213  -3.151  -4.085
    9    HE   ARG 712           HE       ARG 712  64.667  -3.060  -2.086
   10   HH11  ARG 712          HH11      ARG 712  65.863  -6.131  -3.427
   11   HH12  ARG 712          HH12      ARG 712  65.770  -6.949  -1.940
   12   HH21  ARG 712          HH21      ARG 712  64.573  -4.181  -0.092
   13   HH22  ARG 712          HH22      ARG 712  65.032  -5.816   0.018

  No H/Q in entry =          13
  In of MODEL   29
    1    H    CYS 713           H        CYS 713  62.755  -4.890  -7.754
    2    HA   CYS 713           HA       CYS 713  59.985  -4.469  -6.958
    3    HB2  CYS 713           HB2      CYS 713  60.337  -5.339  -9.249
    4    HB3  CYS 713           HB3      CYS 713  61.229  -6.708  -8.591

  No H/Q in entry =           4
  In of MODEL   29
    1    H    VAL 714           H        VAL 714  59.177  -5.443  -5.256
    2    HA   VAL 714           HA       VAL 714  60.573  -7.684  -4.002
    3    HB   VAL 714           HB       VAL 714  60.149  -6.715  -1.747
    4   HG12  VAL 714          HG11      VAL 714  61.935  -5.035  -1.726
    5   HG11  VAL 714          HG12      VAL 714  61.865  -4.960  -3.487
    6   HG13  VAL 714          HG13      VAL 714  62.363  -6.449  -2.690
    7   HG23  VAL 714          HG21      VAL 714  59.616  -4.312  -1.511
    8   HG22  VAL 714          HG22      VAL 714  58.314  -5.209  -2.287
    9   HG21  VAL 714          HG23      VAL 714  59.394  -4.208  -3.257

  No H/Q in entry =           9
  In of MODEL   29
    1    H    CYS 715           H        CYS 715  58.951  -8.530  -2.202
    2    HA   CYS 715           HA       CYS 715  56.439  -8.764  -3.606
    3    HB2  CYS 715           HB2      CYS 715  55.943 -10.506  -1.883
    4    HB3  CYS 715           HB3      CYS 715  57.371 -10.855  -2.841

  No H/Q in entry =           4
  In of MODEL   29
    1    H    LYS 716           H        LYS 716  54.443  -8.371  -2.599
    2    HA   LYS 716           HA       LYS 716  54.395  -6.109  -0.849
    3    HB2  LYS 716           HB2      LYS 716  52.175  -7.931  -1.834
    4    HB3  LYS 716           HB3      LYS 716  51.936  -6.401  -1.003
    5    HG2  LYS 716           HG2      LYS 716  52.847  -5.170  -2.833
    6    HG3  LYS 716           HG3      LYS 716  53.395  -6.646  -3.621
    7    HD2  LYS 716           HD2      LYS 716  51.396  -5.782  -4.714
    8    HD3  LYS 716           HD3      LYS 716  51.060  -7.335  -3.956
    9    HE2  LYS 716           HE2      LYS 716  49.972  -6.229  -2.099
   10    HE3  LYS 716           HE3      LYS 716  50.400  -4.651  -2.751
   11    HZ2  LYS 716           HZ1      LYS 716  48.105  -5.220  -3.225
   12    HZ1  LYS 716           HZ2      LYS 716  48.552  -6.605  -4.069
   13    HZ3  LYS 716           HZ3      LYS 716  48.969  -5.100  -4.652

  No H/Q in entry =          13
  In of MODEL   29
    1    H    MET 717           H        MET 717  52.741  -6.368   1.109
    2    HA   MET 717           HA       MET 717  53.428  -8.773   2.616
    3    HB2  MET 717           HB2      MET 717  52.954  -5.907   3.359
    4    HB3  MET 717           HB3      MET 717  52.682  -7.173   4.537
    5    HG2  MET 717           HG2      MET 717  54.857  -6.141   4.778
    6    HG3  MET 717           HG3      MET 717  54.982  -7.861   4.383
    7    HE2  MET 717           HE1      MET 717  55.935  -4.386   1.513
    8    HE1  MET 717           HE2      MET 717  55.348  -4.208   3.183
    9    HE3  MET 717           HE3      MET 717  54.291  -4.876   1.937

  No H/Q in entry =           9
  In of MODEL   29
    1    HA   PRO 718           HA       PRO 718  49.196 -10.097   2.659
    2    HB2  PRO 718           HB2      PRO 718  48.700 -10.480   5.372
    3    HB3  PRO 718           HB3      PRO 718  49.461 -11.651   4.289
    4    HG2  PRO 718           HG2      PRO 718  50.730  -9.701   6.169
    5    HG3  PRO 718           HG3      PRO 718  51.177 -11.382   5.827
    6    HD2  PRO 718           HD2      PRO 718  52.580  -9.378   4.780
    7    HD3  PRO 718           HD3      PRO 718  52.213 -10.817   3.810

  No H/Q in entry =           7
  In of MODEL   29
    1    H    TYR 719           H        TYR 719  49.946  -7.276   4.467
    2    HA   TYR 719           HA       TYR 719  47.113  -6.648   4.806
    3    HB2  TYR 719           HB2      TYR 719  47.847  -4.728   6.172
    4    HB3  TYR 719           HB3      TYR 719  48.466  -6.254   6.779
    5    HD1  TYR 719           HD1      TYR 719  50.895  -6.812   6.425
    6    HD2  TYR 719           HD2      TYR 719  49.293  -2.985   5.504
    7    HE1  TYR 719           HE1      TYR 719  53.143  -5.850   6.515
    8    HE2  TYR 719           HE2      TYR 719  51.535  -2.015   5.568
    9    HH   TYR 719           HH       TYR 719  54.409  -3.942   5.802

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLU 720           H        GLU 720  49.292  -6.404   2.484
    2    HA   GLU 720           HA       GLU 720  48.480  -3.803   1.423
    3    HB2  GLU 720           HB2      GLU 720  50.473  -5.903   0.566
    4    HB3  GLU 720           HB3      GLU 720  50.175  -4.431  -0.353
    5    HG2  GLU 720           HG2      GLU 720  51.122  -4.447   2.499
    6    HG3  GLU 720           HG3      GLU 720  52.220  -4.464   1.118

  No H/Q in entry =           6
  In of MODEL   29
    1    H    CYS 721           H        CYS 721  46.984  -6.443   1.766
    2    HA   CYS 721           HA       CYS 721  46.447  -7.212  -0.998
    3    HB2  CYS 721           HB2      CYS 721  45.906  -8.648   1.588
    4    HB3  CYS 721           HB3      CYS 721  45.590  -9.283  -0.018

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLY 722           H        GLY 722  44.462  -6.932  -1.851
    2    HA3  GLY 722           HA2      GLY 722  42.202  -6.530  -0.069
    3    HA2  GLY 722           HA3      GLY 722  42.552  -5.294  -1.274

  No H/Q in entry =           3
  In of MODEL   29
    1    HA   PRO 723           HA       PRO 723  39.772  -7.417  -4.033
    2    HB2  PRO 723           HB2      PRO 723  41.627  -6.397  -6.127
    3    HB3  PRO 723           HB3      PRO 723  39.877  -6.220  -5.997
    4    HG2  PRO 723           HG2      PRO 723  41.454  -4.176  -5.447
    5    HG3  PRO 723           HG3      PRO 723  40.029  -4.501  -4.446
    6    HD2  PRO 723           HD2      PRO 723  42.908  -5.045  -3.878
    7    HD3  PRO 723           HD3      PRO 723  41.614  -4.474  -2.799

  No H/Q in entry =           7
  In of MODEL   29
    1    H    SER 724           H        SER 724  39.938  -9.596  -4.013
    2    HA   SER 724           HA       SER 724  41.385 -11.071  -5.930
    3    HB2  SER 724           HB2      SER 724  42.709 -12.341  -4.152
    4    HB3  SER 724           HB3      SER 724  43.355 -10.806  -4.721
    5    HG   SER 724           HG       SER 724  42.053 -10.012  -2.787

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU 725           H        LEU 725  40.873 -13.152  -5.988
    2    HA   LEU 725           HA       LEU 725  38.300 -13.985  -5.188
    3    HB2  LEU 725           HB2      LEU 725  40.724 -15.298  -6.301
    4    HB3  LEU 725           HB3      LEU 725  39.453 -16.349  -5.759
    5    HG   LEU 725           HG       LEU 725  39.110 -14.172  -7.842
    6   HD12  LEU 725          HD11      LEU 725  39.580 -17.135  -8.219
    7   HD11  LEU 725          HD12      LEU 725  40.738 -15.853  -8.591
    8   HD13  LEU 725          HD13      LEU 725  39.228 -15.962  -9.491
    9   HD22  LEU 725          HD21      LEU 725  37.104 -15.386  -8.434
   10   HD21  LEU 725          HD22      LEU 725  37.041 -14.898  -6.739
   11   HD23  LEU 725          HD23      LEU 725  37.415 -16.570  -7.167

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ASP 726           H        ASP 726  37.568 -14.746  -3.224
    2    HA   ASP 726           HA       ASP 726  39.431 -15.378  -1.127
    3    HB2  ASP 726           HB2      ASP 726  36.431 -15.342  -1.246
    4    HB3  ASP 726           HB3      ASP 726  37.220 -16.241   0.040

  No H/Q in entry =           4
  In of MODEL   29
    1    H    VAL 727           H        VAL 727  40.083 -17.277  -0.394
    2    HA   VAL 727           HA       VAL 727  39.019 -19.693  -1.616
    3    HB   VAL 727           HB       VAL 727  41.342 -20.516  -2.123
    4   HG11  VAL 727          HG11      VAL 727  40.421 -18.105  -3.682
    5   HG13  VAL 727          HG12      VAL 727  39.878 -19.766  -3.915
    6   HG12  VAL 727          HG13      VAL 727  41.552 -19.329  -4.261
    7   HG23  VAL 727          HG21      VAL 727  42.071 -17.601  -1.778
    8   HG22  VAL 727          HG22      VAL 727  43.132 -18.847  -2.437
    9   HG21  VAL 727          HG23      VAL 727  42.607 -18.934  -0.755

  No H/Q in entry =           9
  In of MODEL   29
    1    H    CYS 728           H        CYS 728  39.740 -21.627  -0.567
    2    HA   CYS 728           HA       CYS 728  40.326 -21.163   2.248
    3    HB2  CYS 728           HB2      CYS 728  39.365 -23.667   0.843
    4    HB3  CYS 728           HB3      CYS 728  39.449 -23.399   2.581

  No H/Q in entry =           4
  In of MODEL   29
    1    H    ALA 729           H        ALA 729  42.329 -21.606   2.967
    2    HA   ALA 729           HA       ALA 729  44.016 -23.227   1.214
    3    HB2  ALA 729           HB1      ALA 729  45.861 -21.747   1.692
    4    HB1  ALA 729           HB2      ALA 729  44.810 -20.744   2.693
    5    HB3  ALA 729           HB3      ALA 729  44.521 -20.864   0.957

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLN 730           H        GLN 730  45.515 -24.436   2.169
    2    HA   GLN 730           HA       GLN 730  45.101 -25.035   4.995
    3    HB2  GLN 730           HB2      GLN 730  44.838 -26.850   3.290
    4    HB3  GLN 730           HB3      GLN 730  46.506 -26.580   2.846
    5    HG2  GLN 730           HG2      GLN 730  47.315 -27.294   4.908
    6    HG3  GLN 730           HG3      GLN 730  45.716 -27.335   5.634
    7   HE21  GLN 730          HE21      GLN 730  45.761 -29.526   6.148
    8   HE22  GLN 730          HE22      GLN 730  45.748 -30.751   4.931

  No H/Q in entry =           8
  In of MODEL   29
    1    H    ASP 731           H        ASP 731  46.712 -24.467   6.397
    2    HA   ASP 731           HA       ASP 731  49.132 -23.303   5.437
    3    HB2  ASP 731           HB2      ASP 731  48.164 -22.526   7.541
    4    HB3  ASP 731           HB3      ASP 731  48.219 -24.154   8.182

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLU 732           H        GLU 732  51.120 -24.357   5.179
    2    HA   GLU 732           HA       GLU 732  50.973 -27.210   5.254
    3    HB2  GLU 732           HB2      GLU 732  53.062 -25.344   4.224
    4    HB3  GLU 732           HB3      GLU 732  53.313 -27.085   4.302
    5    HG2  GLU 732           HG2      GLU 732  51.106 -25.686   2.825
    6    HG3  GLU 732           HG3      GLU 732  52.543 -26.418   2.111

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ARG 733           H        ARG 733  51.708 -25.189   7.700
    2    HA   ARG 733           HA       ARG 733  53.783 -26.973   8.714
    3    HB2  ARG 733           HB2      ARG 733  54.255 -24.566   8.878
    4    HB3  ARG 733           HB3      ARG 733  52.749 -24.327   9.750
    5    HG2  ARG 733           HG2      ARG 733  54.630 -24.273  11.275
    6    HG3  ARG 733           HG3      ARG 733  53.608 -25.671  11.605
    7    HD2  ARG 733           HD2      ARG 733  55.151 -27.078  10.337
    8    HD3  ARG 733           HD3      ARG 733  56.191 -25.676  10.054
    9    HE   ARG 733           HE       ARG 733  55.678 -26.070  12.795
   10   HH11  ARG 733          HH11      ARG 733  57.698 -27.271  10.125
   11   HH12  ARG 733          HH12      ARG 733  58.880 -27.922  11.143
   12   HH21  ARG 733          HH21      ARG 733  57.317 -26.966  14.163
   13   HH22  ARG 733          HH22      ARG 733  58.688 -27.734  13.497

  No H/Q in entry =          13
  In of MODEL   29
    1    H    SER 734           H        SER 734  50.746 -25.478   9.624
    2    HA   SER 734           HA       SER 734  50.326 -27.278  11.842
    3    HB2  SER 734           HB2      SER 734  49.628 -24.729  11.671
    4    HB3  SER 734           HB3      SER 734  48.384 -25.349  10.638
    5    HG   SER 734           HG       SER 734  47.762 -25.107  12.857

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LYS 735           H        LYS 735  49.557 -27.100   8.462
    2    HA   LYS 735           HA       LYS 735  48.281 -28.198   7.024
    3    HB2  LYS 735           HB2      LYS 735  48.375 -30.381   9.120
    4    HB3  LYS 735           HB3      LYS 735  47.817 -30.617   7.469
    5    HG2  LYS 735           HG2      LYS 735  50.594 -29.764   8.290
    6    HG3  LYS 735           HG3      LYS 735  50.133 -31.376   7.759
    7    HD2  LYS 735           HD2      LYS 735  49.907 -28.873   6.073
    8    HD3  LYS 735           HD3      LYS 735  51.239 -30.011   5.990
    9    HE2  LYS 735           HE2      LYS 735  49.630 -31.790   5.352
   10    HE3  LYS 735           HE3      LYS 735  48.330 -30.605   5.392
   11    HZ3  LYS 735           HZ1      LYS 735  49.096 -30.941   3.133
   12    HZ2  LYS 735           HZ2      LYS 735  50.670 -30.575   3.560
   13    HZ1  LYS 735           HZ3      LYS 735  49.531 -29.375   3.592

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ARG 736           H        ARG 736  47.049 -26.399   8.505
    2    HA   ARG 736           HA       ARG 736  44.370 -27.453   9.086
    3    HB2  ARG 736           HB2      ARG 736  44.120 -25.561  10.620
    4    HB3  ARG 736           HB3      ARG 736  45.495 -26.534  11.078
    5    HG2  ARG 736           HG2      ARG 736  46.524 -24.485  11.269
    6    HG3  ARG 736           HG3      ARG 736  46.756 -24.798   9.584
    7    HD2  ARG 736           HD2      ARG 736  45.970 -22.525  10.077
    8    HD3  ARG 736           HD3      ARG 736  45.051 -23.497   8.915
    9    HE   ARG 736           HE       ARG 736  43.572 -23.924  11.018
   10   HH11  ARG 736          HH11      ARG 736  45.125 -20.800  10.392
   11   HH12  ARG 736          HH12      ARG 736  43.811 -19.895  10.987
   12   HH21  ARG 736          HH21      ARG 736  41.822 -22.695  11.814
   13   HH22  ARG 736          HH22      ARG 736  41.891 -20.991  11.824

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ILE 737           H        ILE 737  42.615 -26.076   8.376
    2    HA   ILE 737           HA       ILE 737  43.497 -24.579   6.075
    3    HB   ILE 737           HB       ILE 737  40.996 -26.187   6.545
    4   HG12  ILE 737          HG12      ILE 737  43.265 -26.462   4.603
    5   HG13  ILE 737          HG13      ILE 737  43.256 -27.221   6.182
    6   HG23  ILE 737          HG21      ILE 737  40.492 -24.164   5.189
    7   HG22  ILE 737          HG22      ILE 737  40.431 -25.627   4.220
    8   HG21  ILE 737          HG23      ILE 737  41.837 -24.559   4.114
    9   HD13  ILE 737          HD11      ILE 737  42.717 -28.731   4.560
   10   HD12  ILE 737          HD12      ILE 737  41.442 -27.678   3.898
   11   HD11  ILE 737          HD13      ILE 737  41.263 -28.419   5.530

  No H/Q in entry =          11
  In of MODEL   29
    1    H    LEU 738           H        LEU 738  42.981 -22.640   5.782
    2    HA   LEU 738           HA       LEU 738  41.172 -21.305   7.619
    3    HB2  LEU 738           HB2      LEU 738  42.748 -19.428   7.939
    4    HB3  LEU 738           HB3      LEU 738  43.373 -20.920   8.589
    5    HG   LEU 738           HG       LEU 738  44.263 -19.822   5.912
    6   HD13  LEU 738          HD11      LEU 738  44.750 -18.176   7.666
    7   HD12  LEU 738          HD12      LEU 738  46.228 -18.981   7.126
    8   HD11  LEU 738          HD13      LEU 738  45.477 -19.448   8.648
    9   HD23  LEU 738          HD21      LEU 738  45.508 -21.696   7.869
   10   HD22  LEU 738          HD22      LEU 738  46.131 -21.309   6.243
   11   HD21  LEU 738          HD23      LEU 738  44.594 -22.172   6.453

  No H/Q in entry =          11
  In of MODEL   29
    1    HA   PRO 739           HA       PRO 739  39.859 -19.227   3.965
    2    HB2  PRO 739           HB2      PRO 739  38.779 -17.009   5.085
    3    HB3  PRO 739           HB3      PRO 739  38.022 -18.599   5.246
    4    HG2  PRO 739           HG2      PRO 739  39.760 -17.125   7.192
    5    HG3  PRO 739           HG3      PRO 739  38.264 -18.029   7.499
    6    HD2  PRO 739           HD2      PRO 739  40.779 -19.129   7.926
    7    HD3  PRO 739           HD3      PRO 739  39.342 -20.071   7.456

  No H/Q in entry =           7
  In of MODEL   29
    1    H    LEU 740           H        LEU 740  41.192 -18.272   2.589
    2    HA   LEU 740           HA       LEU 740  42.558 -15.822   3.416
    3    HB2  LEU 740           HB2      LEU 740  43.689 -18.060   1.744
    4    HB3  LEU 740           HB3      LEU 740  44.373 -16.456   1.798
    5    HG   LEU 740           HG       LEU 740  44.234 -18.424   4.077
    6   HD12  LEU 740          HD11      LEU 740  46.672 -18.403   3.831
    7   HD11  LEU 740          HD12      LEU 740  46.504 -17.324   2.437
    8   HD13  LEU 740          HD13      LEU 740  45.858 -18.958   2.367
    9   HD23  LEU 740          HD21      LEU 740  45.580 -16.778   5.313
   10   HD22  LEU 740          HD22      LEU 740  43.991 -16.137   4.918
   11   HD21  LEU 740          HD23      LEU 740  45.401 -15.633   3.982

  No H/Q in entry =          11
  In of MODEL   29
    1    H    THR 741           H        THR 741  43.442 -14.902   1.208
    2    HA   THR 741           HA       THR 741  41.362 -15.170  -0.797
    3    HB   THR 741           HB       THR 741  42.623 -12.512  -0.091
    4    HG1  THR 741           HG1      THR 741  40.073 -13.395   0.891
    5   HG22  THR 741          HG21      THR 741  39.981 -13.276  -1.302
    6   HG21  THR 741          HG22      THR 741  41.445 -12.913  -2.195
    7   HG23  THR 741          HG23      THR 741  40.682 -11.648  -1.213

  No H/Q in entry =           7
  In of MODEL   29
    1    H    VAL 742           H        VAL 742  42.281 -14.644  -2.951
    2    HA   VAL 742           HA       VAL 742  44.779 -15.808  -3.098
    3    HB   VAL 742           HB       VAL 742  44.851 -15.502  -5.455
    4   HG12  VAL 742          HG11      VAL 742  42.174 -16.267  -4.494
    5   HG11  VAL 742          HG12      VAL 742  43.633 -17.289  -4.587
    6   HG13  VAL 742          HG13      VAL 742  42.872 -16.665  -6.071
    7   HG23  VAL 742          HG21      VAL 742  42.350 -13.945  -5.265
    8   HG22  VAL 742          HG22      VAL 742  43.154 -14.615  -6.712
    9   HG21  VAL 742          HG23      VAL 742  43.965 -13.350  -5.752

  No H/Q in entry =           9
  In of MODEL   29
    1    H    CYS 743           H        CYS 743  44.203 -12.404  -2.897
    2    HA   CYS 743           HA       CYS 743  46.821 -11.732  -3.787
    3    HB2  CYS 743           HB2      CYS 743  44.905 -10.042  -3.514
    4    HB3  CYS 743           HB3      CYS 743  45.148 -10.186  -1.791

  No H/Q in entry =           4
  In of MODEL   29
    1    H    LYS 744           H        LYS 744  45.344 -12.237  -0.659
    2    HA   LYS 744           HA       LYS 744  47.518 -11.895   1.038
    3    HB2  LYS 744           HB2      LYS 744  45.206 -13.808   1.238
    4    HB3  LYS 744           HB3      LYS 744  46.286 -13.395   2.555
    5    HG2  LYS 744           HG2      LYS 744  45.474 -11.144   2.605
    6    HG3  LYS 744           HG3      LYS 744  44.616 -11.363   1.077
    7    HD2  LYS 744           HD2      LYS 744  43.175 -13.049   2.185
    8    HD3  LYS 744           HD3      LYS 744  43.987 -12.699   3.711
    9    HE2  LYS 744           HE2      LYS 744  43.137 -10.495   3.774
   10    HE3  LYS 744           HE3      LYS 744  42.620 -10.563   2.086
   11    HZ1  LYS 744           HZ1      LYS 744  41.453 -12.153   4.317
   12    HZ3  LYS 744           HZ2      LYS 744  40.966 -12.191   2.702
   13    HZ2  LYS 744           HZ3      LYS 744  40.754 -10.802   3.601

  No H/Q in entry =          13
  In of MODEL   29
    1    H    MET 745           H        MET 745  46.206 -14.896  -0.291
    2    HA   MET 745           HA       MET 745  48.164 -16.680   0.531
    3    HB2  MET 745           HB2      MET 745  46.443 -17.789  -0.236
    4    HB3  MET 745           HB3      MET 745  46.027 -16.640  -1.505
    5    HG2  MET 745           HG2      MET 745  46.628 -18.672  -2.596
    6    HG3  MET 745           HG3      MET 745  47.986 -17.592  -2.796
    7    HE3  MET 745           HE1      MET 745  46.980 -19.744   0.380
    8    HE2  MET 745           HE2      MET 745  47.862 -21.227  -0.022
    9    HE1  MET 745           HE3      MET 745  46.568 -20.658  -1.067

  No H/Q in entry =           9
  In of MODEL   29
    1    H    HIS 746           H        HIS 746  47.981 -14.866  -2.548
    2    HA   HIS 746           HA       HIS 746  50.238 -16.117  -3.617
    3    HB2  HIS 746           HB2      HIS 746  48.633 -13.843  -4.412
    4    HB3  HIS 746           HB3      HIS 746  50.323 -13.684  -4.912
    5    HD1  HIS 746           HD1      HIS 746  51.140 -16.160  -6.134
    6    HD2  HIS 746           HD2      HIS 746  47.154 -14.990  -6.279
    7    HE1  HIS 746           HE1      HIS 746  50.172 -17.326  -8.113
    8    HE2  HIS 746           HE2      HIS 746  47.705 -16.813  -7.992

  No H/Q in entry =           8
  In of MODEL   29
    1    H    VAL 747           H        VAL 747  49.874 -13.055  -1.927
    2    HA   VAL 747           HA       VAL 747  52.518 -12.154  -2.053
    3    HB   VAL 747           HB       VAL 747  50.193 -11.605  -0.214
    4   HG12  VAL 747          HG11      VAL 747  52.916 -10.292  -0.087
    5   HG11  VAL 747          HG12      VAL 747  52.256 -11.376   1.124
    6   HG13  VAL 747          HG13      VAL 747  51.496  -9.817   0.842
    7   HG22  VAL 747          HG21      VAL 747  50.300  -9.412  -1.327
    8   HG21  VAL 747          HG22      VAL 747  50.114 -10.746  -2.481
    9   HG23  VAL 747          HG23      VAL 747  51.690  -9.997  -2.250

  No H/Q in entry =           9
  In of MODEL   29
    1    H    LEU 748           H        LEU 748  50.785 -13.803   0.498
    2    HA   LEU 748           HA       LEU 748  52.902 -14.156   2.236
    3    HB2  LEU 748           HB2      LEU 748  50.902 -14.391   3.276
    4    HB3  LEU 748           HB3      LEU 748  50.132 -15.052   1.873
    5    HG   LEU 748           HG       LEU 748  51.830 -16.749   3.715
    6   HD13  LEU 748          HD11      LEU 748  49.721 -17.333   4.807
    7   HD12  LEU 748          HD12      LEU 748  48.864 -16.169   3.801
    8   HD11  LEU 748          HD13      LEU 748  50.043 -15.609   4.989
    9   HD22  LEU 748          HD21      LEU 748  50.493 -18.552   2.764
   10   HD21  LEU 748          HD22      LEU 748  51.247 -17.657   1.454
   11   HD23  LEU 748          HD23      LEU 748  49.542 -17.405   1.826

  No H/Q in entry =          11
  In of MODEL   29
    1    H    HIS 749           H        HIS 749  51.759 -16.142  -0.395
    2    HA   HIS 749           HA       HIS 749  53.379 -18.409  -0.033
    3    HB2  HIS 749           HB2      HIS 749  51.389 -18.051  -1.621
    4    HB3  HIS 749           HB3      HIS 749  52.539 -17.276  -2.697
    5    HD1  HIS 749           HD1      HIS 749  54.047 -18.802  -4.078
    6    HD2  HIS 749           HD2      HIS 749  51.708 -20.747  -1.275
    7    HE1  HIS 749           HE1      HIS 749  54.300 -21.241  -4.586
    8    HE2  HIS 749           HE2      HIS 749  52.736 -22.389  -2.993

  No H/Q in entry =           8
  In of MODEL   29
    1    H    CYS 750           H        CYS 750  53.806 -15.429  -1.852
    2    HA   CYS 750           HA       CYS 750  56.344 -16.039  -2.925
    3    HB2  CYS 750           HB2      CYS 750  54.814 -14.362  -3.893
    4    HB3  CYS 750           HB3      CYS 750  55.030 -13.354  -2.472

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLN 751           H        GLN 751  55.280 -14.518   0.108
    2    HA   GLN 751           HA       GLN 751  57.851 -13.644   0.815
    3    HB2  GLN 751           HB2      GLN 751  55.509 -14.225   2.633
    4    HB3  GLN 751           HB3      GLN 751  56.979 -13.397   3.122
    5    HG2  GLN 751           HG2      GLN 751  56.437 -11.729   1.258
    6    HG3  GLN 751           HG3      GLN 751  54.849 -12.469   1.239
    7   HE21  GLN 751          HE21      GLN 751  55.624  -9.810   1.906
    8   HE22  GLN 751          HE22      GLN 751  55.092  -9.467   3.508

  No H/Q in entry =           8
  In of MODEL   29
    1    H    GLY 752           H        GLY 752  56.637 -16.754   0.625
    2    HA3  GLY 752           HA2      GLY 752  58.321 -18.526   0.844
    3    HA2  GLY 752           HA3      GLY 752  58.846 -17.728   2.319

  No H/Q in entry =           3
  In of MODEL   29
    1    H    ARG 753           H        ARG 753  55.556 -17.628   2.173
    2    HA   ARG 753           HA       ARG 753  55.377 -19.669   4.208
    3    HB2  ARG 753           HB2      ARG 753  53.396 -17.738   3.050
    4    HB3  ARG 753           HB3      ARG 753  53.045 -18.830   4.386
    5    HG2  ARG 753           HG2      ARG 753  55.248 -16.782   4.477
    6    HG3  ARG 753           HG3      ARG 753  53.607 -16.432   5.006
    7    HD2  ARG 753           HD2      ARG 753  55.323 -18.670   6.107
    8    HD3  ARG 753           HD3      ARG 753  55.083 -17.101   6.882
    9    HE   ARG 753           HE       ARG 753  52.660 -17.678   6.787
   10   HH11  ARG 753          HH11      ARG 753  55.185 -20.124   7.372
   11   HH12  ARG 753          HH12      ARG 753  54.096 -21.248   8.063
   12   HH21  ARG 753          HH21      ARG 753  51.221 -19.232   7.730
   13   HH22  ARG 753          HH22      ARG 753  51.776 -20.749   8.232

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ASN 754           H        ASN 754  54.792 -21.679   3.788
    2    HA   ASN 754           HA       ASN 754  53.814 -22.324   1.128
    3    HB2  ASN 754           HB2      ASN 754  54.755 -24.154   3.350
    4    HB3  ASN 754           HB3      ASN 754  54.172 -24.700   1.791
    5   HD21  ASN 754          HD21      ASN 754  56.740 -23.197   3.505
    6   HD22  ASN 754          HD22      ASN 754  57.910 -23.282   2.225

  No H/Q in entry =           6
  In of MODEL   29
    1    H    TYR 755           H        TYR 755  51.829 -22.653   0.726
    2    HA   TYR 755           HA       TYR 755  50.031 -23.701   2.748
    3    HB2  TYR 755           HB2      TYR 755  49.682 -21.158   1.164
    4    HB3  TYR 755           HB3      TYR 755  48.299 -22.082   1.718
    5    HD1  TYR 755           HD1      TYR 755  47.270 -21.091   3.515
    6    HD2  TYR 755           HD2      TYR 755  51.493 -20.869   3.278
    7    HE1  TYR 755           HE1      TYR 755  47.320 -19.814   5.601
    8    HE2  TYR 755           HE2      TYR 755  51.548 -19.612   5.374
    9    HH   TYR 755           HH       TYR 755  48.899 -19.316   7.436

  No H/Q in entry =           9
  In of MODEL   29
    1    H    THR 756           H        THR 756  48.221 -24.669   1.766
    2    HA   THR 756           HA       THR 756  48.578 -25.357  -1.078
    3    HB   THR 756           HB       THR 756  47.422 -27.036   1.177
    4    HG1  THR 756           HG1      THR 756  49.405 -27.467   1.488
    5   HG21  THR 756          HG21      THR 756  46.381 -27.497  -0.987
    6   HG23  THR 756          HG22      THR 756  47.368 -28.853  -0.443
    7   HG22  THR 756          HG23      THR 756  47.971 -27.763  -1.706

  No H/Q in entry =           7
  In of MODEL   29
    1    H    LEU 757           H        LEU 757  46.600 -25.421  -2.330
    2    HA   LEU 757           HA       LEU 757  44.453 -23.947  -1.074
    3    HB2  LEU 757           HB2      LEU 757  44.951 -24.644  -3.973
    4    HB3  LEU 757           HB3      LEU 757  43.476 -23.909  -3.400
    5    HG   LEU 757           HG       LEU 757  44.855 -22.232  -4.378
    6   HD11  LEU 757          HD11      LEU 757  43.509 -21.570  -2.497
    7   HD13  LEU 757          HD12      LEU 757  45.000 -20.640  -2.552
    8   HD12  LEU 757          HD13      LEU 757  44.824 -21.949  -1.385
    9   HD22  LEU 757          HD21      LEU 757  47.062 -23.255  -4.129
   10   HD21  LEU 757          HD22      LEU 757  46.992 -23.013  -2.385
   11   HD23  LEU 757          HD23      LEU 757  47.070 -21.621  -3.465

  No H/Q in entry =          11
  In of MODEL   29
    1    H    THR 758           H        THR 758  42.535 -24.699  -0.710
    2    HA   THR 758           HA       THR 758  42.084 -27.528  -1.273
    3    HB   THR 758           HB       THR 758  40.843 -27.537   0.975
    4    HG1  THR 758           HG1      THR 758  41.812 -24.976   0.922
    5   HG21  THR 758          HG21      THR 758  43.844 -27.138   0.986
    6   HG23  THR 758          HG22      THR 758  43.002 -28.660   0.686
    7   HG22  THR 758          HG23      THR 758  42.913 -27.902   2.274

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLY 759           H        GLY 759  39.520 -27.814  -0.503
    2    HA3  GLY 759           HA2      GLY 759  38.170 -26.275  -2.530
    3    HA2  GLY 759           HA3      GLY 759  37.495 -27.577  -1.552

  No H/Q in entry =           3
  In of MODEL   29
    1    H    ARG 760           H        ARG 760  36.001 -25.353  -1.992
    2    HA   ARG 760           HA       ARG 760  36.378 -23.345  -0.005
    3    HB2  ARG 760           HB2      ARG 760  34.176 -22.475  -0.675
    4    HB3  ARG 760           HB3      ARG 760  35.151 -22.849  -2.083
    5    HG2  ARG 760           HG2      ARG 760  33.047 -23.631  -2.687
    6    HG3  ARG 760           HG3      ARG 760  33.868 -25.079  -2.095
    7    HD2  ARG 760           HD2      ARG 760  32.794 -24.689   0.120
    8    HD3  ARG 760           HD3      ARG 760  31.851 -23.396  -0.619
    9    HE   ARG 760           HE       ARG 760  31.465 -25.595  -2.179
   10   HH11  ARG 760          HH11      ARG 760  30.874 -24.770   1.239
   11   HH12  ARG 760          HH12      ARG 760  29.551 -25.829   1.398
   12   HH21  ARG 760          HH21      ARG 760  29.632 -27.036  -1.932
   13   HH22  ARG 760          HH22      ARG 760  28.826 -27.137  -0.430

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ASP 761           H        ASP 761  35.073 -26.424   0.043
    2    HA   ASP 761           HA       ASP 761  33.261 -26.175   2.207
    3    HB2  ASP 761           HB2      ASP 761  32.963 -28.016   0.735
    4    HB3  ASP 761           HB3      ASP 761  34.629 -28.538   0.939

  No H/Q in entry =           4
  In of MODEL   29
    1    H    SER 762           H        SER 762  36.679 -26.528   1.949
    2    HA   SER 762           HA       SER 762  37.193 -28.020   4.255
    3    HB2  SER 762           HB2      SER 762  39.038 -26.167   2.779
    4    HB3  SER 762           HB3      SER 762  39.494 -27.466   3.893
    5    HG   SER 762           HG       SER 762  38.140 -28.813   2.367

  No H/Q in entry =           5
  In of MODEL   29
    1    H    CYS 763           H        CYS 763  36.593 -24.593   3.986
    2    HA   CYS 763           HA       CYS 763  36.629 -24.552   6.836
    3    HB2  CYS 763           HB2      CYS 763  37.972 -22.494   7.030
    4    HB3  CYS 763           HB3      CYS 763  38.914 -23.801   6.335

  No H/Q in entry =           4
  In of MODEL   29
    1    H    THR 764           H        THR 764  35.944 -21.966   7.345
    2    HA   THR 764           HA       THR 764  33.603 -21.697   5.671
    3    HB   THR 764           HB       THR 764  34.230 -20.478   8.377
    4    HG1  THR 764           HG1      THR 764  33.201 -22.856   7.474
    5   HG22  THR 764          HG21      THR 764  31.637 -20.606   6.808
    6   HG21  THR 764          HG22      THR 764  32.614 -19.158   7.038
    7   HG23  THR 764          HG23      THR 764  31.832 -19.924   8.425

  No H/Q in entry =           7
  In of MODEL   29
    1    H    LEU 765           H        LEU 765  33.784 -20.474   4.062
    2    HA   LEU 765           HA       LEU 765  35.750 -18.343   3.947
    3    HB2  LEU 765           HB2      LEU 765  35.317 -20.313   2.264
    4    HB3  LEU 765           HB3      LEU 765  33.985 -19.300   1.749
    5    HG   LEU 765           HG       LEU 765  35.566 -17.514   1.176
    6   HD12  LEU 765          HD11      LEU 765  37.985 -18.084   1.145
    7   HD11  LEU 765          HD12      LEU 765  37.575 -19.596   1.986
    8   HD13  LEU 765          HD13      LEU 765  37.302 -18.061   2.778
    9   HD22  LEU 765          HD21      LEU 765  34.864 -19.121  -0.526
   10   HD21  LEU 765          HD22      LEU 765  36.174 -20.202  -0.061
   11   HD23  LEU 765          HD23      LEU 765  36.539 -18.633  -0.779

  No H/Q in entry =          11
  In of MODEL   29
    1    HA   PRO 766           HA       PRO 766  32.402 -15.360   4.297
    2    HB2  PRO 766           HB2      PRO 766  33.630 -13.189   3.154
    3    HB3  PRO 766           HB3      PRO 766  33.907 -13.714   4.813
    4    HG2  PRO 766           HG2      PRO 766  35.595 -14.100   2.400
    5    HG3  PRO 766           HG3      PRO 766  36.081 -13.869   4.084
    6    HD2  PRO 766           HD2      PRO 766  36.072 -16.288   2.777
    7    HD3  PRO 766           HD3      PRO 766  35.972 -16.121   4.535

  No H/Q in entry =           7
  In of MODEL   29
    1    H    ALA 767           H        ALA 767  34.109 -15.445   1.157
    2    HA   ALA 767           HA       ALA 767  31.498 -15.026  -0.103
    3    HB3  ALA 767           HB1      ALA 767  32.602 -13.960  -1.955
    4    HB2  ALA 767           HB2      ALA 767  34.185 -14.263  -1.233
    5    HB1  ALA 767           HB3      ALA 767  33.063 -13.141  -0.460

  No H/Q in entry =           5
  In of MODEL   29
    1    H    SER 768           H        SER 768  30.834 -16.896  -0.354
    2    HA   SER 768           HA       SER 768  32.125 -18.442  -2.435
    3    HB2  SER 768           HB2      SER 768  31.338 -20.516  -1.169
    4    HB3  SER 768           HB3      SER 768  32.784 -19.719  -0.536
    5    HG   SER 768           HG       SER 768  30.592 -20.313   0.773

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA 769           H        ALA 769  29.262 -17.775  -0.514
    2    HA   ALA 769           HA       ALA 769  27.549 -18.461  -2.781
    3    HB3  ALA 769           HB1      ALA 769  26.998 -19.581  -0.657
    4    HB1  ALA 769           HB2      ALA 769  25.730 -18.452  -1.138
    5    HB2  ALA 769           HB3      ALA 769  26.868 -18.006   0.132

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLU 770           H        GLU 770  25.445 -16.827  -2.495
    2    HA   GLU 770           HA       GLU 770  26.613 -14.352  -3.276
    3    HB2  GLU 770           HB2      GLU 770  24.306 -13.641  -3.811
    4    HB3  GLU 770           HB3      GLU 770  24.748 -15.162  -4.567
    5    HG2  GLU 770           HG2      GLU 770  23.481 -16.388  -2.880
    6    HG3  GLU 770           HG3      GLU 770  23.081 -14.873  -2.075

  No H/Q in entry =           6
  In of MODEL   29
    1    H    LYS 771           H        LYS 771  26.887 -12.559  -2.243
    2    HA   LYS 771           HA       LYS 771  25.436 -12.140   0.259
    3    HB2  LYS 771           HB2      LYS 771  28.313 -11.343  -0.279
    4    HB3  LYS 771           HB3      LYS 771  27.399 -11.066   1.200
    5    HG2  LYS 771           HG2      LYS 771  28.197 -13.755   0.091
    6    HG3  LYS 771           HG3      LYS 771  28.942 -12.938   1.467
    7    HD2  LYS 771           HD2      LYS 771  26.990 -13.178   2.787
    8    HD3  LYS 771           HD3      LYS 771  26.005 -13.623   1.397
    9    HE2  LYS 771           HE2      LYS 771  26.441 -15.596   2.626
   10    HE3  LYS 771           HE3      LYS 771  27.363 -15.622   1.121
   11    HZ3  LYS 771           HZ1      LYS 771  29.374 -15.035   2.366
   12    HZ2  LYS 771           HZ2      LYS 771  28.662 -16.389   3.041
   13    HZ1  LYS 771           HZ3      LYS 771  28.491 -14.914   3.794

  No H/Q in entry =          13
  In of MODEL   29
    1    H    ALA 772           H        ALA 772  24.250 -10.452   0.172
    2    HA   ALA 772           HA       ALA 772  24.623  -8.545  -1.971
    3    HB2  ALA 772           HB1      ALA 772  22.430  -7.708  -1.343
    4    HB1  ALA 772           HB2      ALA 772  22.398  -8.803   0.042
    5    HB3  ALA 772           HB3      ALA 772  22.391  -9.453  -1.601

  No H/Q in entry =           5
  In of MODEL   29
    1    H    CYS 773           H        CYS 773  25.842  -6.925  -1.617
    2    HA   CYS 773           HA       CYS 773  25.604  -5.391   0.833
    3    HB2  CYS 773           HB2      CYS 773  28.142  -5.259   0.959
    4    HB3  CYS 773           HB3      CYS 773  27.447  -6.815   1.409

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLY 774           H        GLY 774  27.502  -5.643  -2.153
    2    HA3  GLY 774           HA2      GLY 774  26.716  -4.092  -3.926
    3    HA2  GLY 774           HA3      GLY 774  26.868  -2.838  -2.701

  No H/Q in entry =           3
  In of MODEL   29
    1    H    ALA 775           H        ALA 775  29.286  -4.236  -1.575
    2    HA   ALA 775           HA       ALA 775  31.192  -4.020  -3.734
    3    HB3  ALA 775           HB1      ALA 775  30.907  -1.714  -3.006
    4    HB2  ALA 775           HB2      ALA 775  32.528  -2.314  -2.650
    5    HB1  ALA 775           HB3      ALA 775  31.330  -2.176  -1.358

  No H/Q in entry =           5
  In of MODEL   29
    1    H    CYS 776           H        CYS 776  31.969  -5.966  -3.438
    2    HA   CYS 776           HA       CYS 776  33.860  -6.323  -1.377
    3    HB2  CYS 776           HB2      CYS 776  31.574  -8.364  -1.556
    4    HB3  CYS 776           HB3      CYS 776  33.131  -8.737  -0.846

  No H/Q in entry =           4
  In of MODEL   29
    1    HA   PRO 777           HA       PRO 777  34.831  -9.078  -5.089
    2    HB2  PRO 777           HB2      PRO 777  32.695  -9.020  -7.042
    3    HB3  PRO 777           HB3      PRO 777  33.344 -10.424  -6.195
    4    HG2  PRO 777           HG2      PRO 777  30.819  -9.468  -5.795
    5    HG3  PRO 777           HG3      PRO 777  31.742 -10.330  -4.552
    6    HD2  PRO 777           HD2      PRO 777  31.348  -7.387  -4.921
    7    HD3  PRO 777           HD3      PRO 777  31.276  -8.347  -3.429

  No H/Q in entry =           7
  In of MODEL   29
    1    H    LEU 778           H        LEU 778  35.884  -8.327  -6.981
    2    HA   LEU 778           HA       LEU 778  35.294  -5.554  -7.537
    3    HB2  LEU 778           HB2      LEU 778  37.562  -5.446  -8.663
    4    HB3  LEU 778           HB3      LEU 778  37.560  -5.685  -6.942
    5    HG   LEU 778           HG       LEU 778  39.362  -6.909  -8.063
    6   HD13  LEU 778          HD11      LEU 778  39.155  -9.048  -7.059
    7   HD12  LEU 778          HD12      LEU 778  37.418  -8.907  -6.953
    8   HD11  LEU 778          HD13      LEU 778  38.446  -7.847  -5.979
    9   HD23  LEU 778          HD21      LEU 778  38.860  -8.885  -9.448
   10   HD22  LEU 778          HD22      LEU 778  38.375  -7.352 -10.197
   11   HD21  LEU 778          HD23      LEU 778  37.166  -8.392  -9.432

  No H/Q in entry =          11
  In of MODEL   29
    1    H    TRP 779           H        TRP 779  34.642  -8.425  -8.843
    2    HA   TRP 779           HA       TRP 779  34.336  -7.440 -11.597
    3    HB2  TRP 779           HB2      TRP 779  33.769  -9.866 -12.061
    4    HB3  TRP 779           HB3      TRP 779  35.407  -9.613 -11.460
    5    HD1  TRP 779           HD1      TRP 779  31.968 -10.907 -10.247
    6    HE1  TRP 779           HE1      TRP 779  32.344 -12.402  -8.191
    7    HE3  TRP 779           HE3      TRP 779  36.998 -10.276  -9.668
    8    HZ2  TRP 779           HZ2      TRP 779  34.491 -13.180  -6.544
    9    HZ3  TRP 779           HZ3      TRP 779  38.124 -11.421  -7.827
   10    HH2  TRP 779           HH2      TRP 779  36.895 -12.847  -6.302

  No H/Q in entry =          10
  In of MODEL   29
    1    H    GLY 780           H        GLY 780  32.732  -7.495  -8.768
    2    HA3  GLY 780           HA2      GLY 780  30.095  -7.598  -9.990
    3    HA2  GLY 780           HA3      GLY 780  30.420  -8.685  -8.640

  No H/Q in entry =           3
  In of MODEL   29
    1    H    LYS 781           H        LYS 781  29.016  -5.884  -9.348
    2    HA   LYS 781           HA       LYS 781  29.522  -4.699  -6.706
    3    HB2  LYS 781           HB2      LYS 781  29.884  -3.241  -9.336
    4    HB3  LYS 781           HB3      LYS 781  29.790  -2.461  -7.778
    5    HG2  LYS 781           HG2      LYS 781  31.951  -4.397  -8.580
    6    HG3  LYS 781           HG3      LYS 781  32.068  -2.648  -8.764
    7    HD2  LYS 781           HD2      LYS 781  31.777  -4.183  -6.175
    8    HD3  LYS 781           HD3      LYS 781  33.231  -3.372  -6.752
    9    HE2  LYS 781           HE2      LYS 781  30.637  -2.109  -5.864
   10    HE3  LYS 781           HE3      LYS 781  32.206  -1.987  -5.098
   11    HZ1  LYS 781           HZ1      LYS 781  31.529  -0.826  -7.762
   12    HZ3  LYS 781           HZ2      LYS 781  33.017  -0.683  -6.990
   13    HZ2  LYS 781           HZ3      LYS 781  31.653   0.021  -6.327

  No H/Q in entry =          13
  In of MODEL   29
    1    H    CYS 782           H        CYS 782  27.945  -2.821  -6.493
    2    HA   CYS 782           HA       CYS 782  25.675  -3.237  -8.260
    3    HB2  CYS 782           HB2      CYS 782  24.441  -1.711  -6.656
    4    HB3  CYS 782           HB3      CYS 782  24.995  -3.200  -5.906

  No H/Q in entry =           4
  In of MODEL   29
    1    H    ASP 783           H        ASP 783  26.587  -2.399 -10.029
    2    HA   ASP 783           HA       ASP 783  28.102   0.059  -9.957
    3    HB2  ASP 783           HB2      ASP 783  28.445  -1.995 -11.506
    4    HB3  ASP 783           HB3      ASP 783  27.109  -1.325 -12.439

  No H/Q in entry =           4
  In of MODEL   29
    1    H    ALA 784           H        ALA 784  25.100  -1.131 -11.071
    2    HA   ALA 784           HA       ALA 784  24.008   1.578 -11.261
    3    HB1  ALA 784           HB1      ALA 784  23.015  -1.091 -12.309
    4    HB3  ALA 784           HB2      ALA 784  23.658   0.233 -13.284
    5    HB2  ALA 784           HB3      ALA 784  22.125   0.428 -12.435

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLU 785           H        GLU 785  21.515   1.299 -10.374
    2    HA   GLU 785           HA       GLU 785  21.986   0.144  -7.786
    3    HB2  GLU 785           HB2      GLU 785  20.868   2.389  -8.049
    4    HB3  GLU 785           HB3      GLU 785  19.440   1.524  -8.617
    5    HG2  GLU 785           HG2      GLU 785  19.323   2.063  -6.222
    6    HG3  GLU 785           HG3      GLU 785  19.311   0.321  -6.519

  No H/Q in entry =           6
  In of MODEL   29
    1    H    SER 786           H        SER 786  22.163  -1.859  -8.325
    2    HA   SER 786           HA       SER 786  19.896  -3.354  -9.387
    3    HB2  SER 786           HB2      SER 786  22.711  -4.221  -8.771
    4    HB3  SER 786           HB3      SER 786  21.529  -5.090  -9.741
    5    HG   SER 786           HG       SER 786  21.566  -2.931 -10.965

  No H/Q in entry =           5
  In of MODEL   29
    1    H    SER 787           H        SER 787  21.034  -2.380  -6.398
    2    HA   SER 787           HA       SER 787  20.772  -2.968  -4.281
    3    HB2  SER 787           HB2      SER 787  18.424  -3.523  -4.877
    4    HB3  SER 787           HB3      SER 787  18.922  -5.153  -5.323
    5    HG   SER 787           HG       SER 787  19.169  -4.004  -2.740

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LYS 788           H        LYS 788  20.932  -6.056  -6.023
    2    HA   LYS 788           HA       LYS 788  22.932  -7.019  -4.152
    3    HB2  LYS 788           HB2      LYS 788  22.713  -9.206  -5.060
    4    HB3  LYS 788           HB3      LYS 788  21.084  -8.573  -4.996
    5    HG2  LYS 788           HG2      LYS 788  22.750  -8.530  -7.484
    6    HG3  LYS 788           HG3      LYS 788  21.756  -9.915  -7.047
    7    HD2  LYS 788           HD2      LYS 788  19.768  -8.446  -7.106
    8    HD3  LYS 788           HD3      LYS 788  20.803  -7.098  -7.586
    9    HE2  LYS 788           HE2      LYS 788  21.428  -8.229  -9.614
   10    HE3  LYS 788           HE3      LYS 788  20.557  -9.679  -9.131
   11    HZ3  LYS 788           HZ1      LYS 788  19.296  -8.414 -10.723
   12    HZ2  LYS 788           HZ2      LYS 788  19.344  -7.034  -9.765
   13    HZ1  LYS 788           HZ3      LYS 788  18.492  -8.381  -9.247

  No H/Q in entry =          13
  In of MODEL   29
    1    H    CYS 789           H        CYS 789  24.787  -8.379  -5.441
    2    HA   CYS 789           HA       CYS 789  26.115  -6.218  -6.904
    3    HB2  CYS 789           HB2      CYS 789  27.233  -8.805  -5.795
    4    HB3  CYS 789           HB3      CYS 789  28.164  -7.439  -6.400

  No H/Q in entry =           4
  In of MODEL   29
    1    H    VAL 790           H        VAL 790  26.306  -6.388  -9.000
    2    HA   VAL 790           HA       VAL 790  25.601  -8.890 -10.351
    3    HB   VAL 790           HB       VAL 790  25.507  -6.025 -11.352
    4   HG12  VAL 790          HG11      VAL 790  24.186  -6.915 -13.213
    5   HG11  VAL 790          HG12      VAL 790  24.418  -8.554 -12.583
    6   HG13  VAL 790          HG13      VAL 790  25.806  -7.615 -13.146
    7   HG22  VAL 790          HG21      VAL 790  23.087  -6.217 -11.147
    8   HG21  VAL 790          HG22      VAL 790  23.940  -6.390  -9.601
    9   HG23  VAL 790          HG23      VAL 790  23.314  -7.823 -10.434

  No H/Q in entry =           9
  In of MODEL   29
    1    H    CYS 791           H        CYS 791  26.807  -9.264 -12.336
    2    HA   CYS 791           HA       CYS 791  29.604  -8.674 -11.814
    3    HB2  CYS 791           HB2      CYS 791  29.975 -10.595 -13.399
    4    HB3  CYS 791           HB3      CYS 791  29.117 -10.984 -11.907

  No H/Q in entry =           4
  In of MODEL   29
    1    H    ARG 792           H        ARG 792  30.708  -7.430 -13.016
    2    HA   ARG 792           HA       ARG 792  29.693  -6.510 -15.582
    3    HB2  ARG 792           HB2      ARG 792  31.992  -5.623 -13.816
    4    HB3  ARG 792           HB3      ARG 792  31.688  -4.923 -15.416
    5    HG2  ARG 792           HG2      ARG 792  29.435  -4.226 -14.551
    6    HG3  ARG 792           HG3      ARG 792  29.942  -4.784 -12.960
    7    HD2  ARG 792           HD2      ARG 792  30.259  -2.376 -13.143
    8    HD3  ARG 792           HD3      ARG 792  31.816  -3.182 -13.009
    9    HE   ARG 792           HE       ARG 792  31.256  -2.899 -15.714
   10   HH11  ARG 792          HH11      ARG 792  31.518  -0.544 -13.072
   11   HH12  ARG 792          HH12      ARG 792  32.467   0.559 -13.933
   12   HH21  ARG 792          HH21      ARG 792  32.485  -1.326 -16.966
   13   HH22  ARG 792          HH22      ARG 792  33.014   0.102 -16.229

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLU 793           H        GLU 793  31.198  -6.712 -17.444
    2    HA   GLU 793           HA       GLU 793  32.313  -9.357 -17.282
    3    HB2  GLU 793           HB2      GLU 793  32.244  -7.513 -19.666
    4    HB3  GLU 793           HB3      GLU 793  32.698  -9.214 -19.693
    5    HG2  GLU 793           HG2      GLU 793  30.368  -9.606 -18.659
    6    HG3  GLU 793           HG3      GLU 793  30.013  -7.988 -19.258

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ALA 794           H        ALA 794  34.452  -9.717 -18.625
    2    HA   ALA 794           HA       ALA 794  36.471  -8.902 -16.880
    3    HB2  ALA 794           HB1      ALA 794  36.532 -10.991 -18.136
    4    HB3  ALA 794           HB2      ALA 794  37.995 -10.043 -18.402
    5    HB1  ALA 794           HB3      ALA 794  36.738 -10.090 -19.639

  No H/Q in entry =           5
  In of MODEL   29
    1    H    SER 795           H        SER 795  35.375  -7.678 -19.908
    2    HA   SER 795           HA       SER 795  37.582  -6.035 -20.430
    3    HB2  SER 795           HB2      SER 795  34.765  -5.835 -21.489
    4    HB3  SER 795           HB3      SER 795  36.205  -5.134 -22.232
    5    HG   SER 795           HG       SER 795  37.012  -7.243 -22.540

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLU 796           H        GLU 796  35.011  -5.763 -18.202
    2    HA   GLU 796           HA       GLU 796  35.023  -2.829 -18.153
    3    HB2  GLU 796           HB2      GLU 796  33.265  -4.829 -16.800
    4    HB3  GLU 796           HB3      GLU 796  33.102  -3.091 -16.676
    5    HG2  GLU 796           HG2      GLU 796  32.655  -3.054 -19.125
    6    HG3  GLU 796           HG3      GLU 796  32.652  -4.823 -19.079

  No H/Q in entry =           6
  In of MODEL   29
    1    H    CYS 797           H        CYS 797  36.561  -5.389 -16.736
    2    HA   CYS 797           HA       CYS 797  36.316  -4.875 -14.018
    3    HB2  CYS 797           HB2      CYS 797  38.572  -6.165 -15.536
    4    HB3  CYS 797           HB3      CYS 797  38.371  -6.223 -13.785

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLU 798           H        GLU 798  36.736  -3.133 -13.018
    2    HA   GLU 798           HA       GLU 798  38.583  -1.107 -13.888
    3    HB2  GLU 798           HB2      GLU 798  36.982  -1.372 -11.344
    4    HB3  GLU 798           HB3      GLU 798  37.762   0.090 -11.930
    5    HG2  GLU 798           HG2      GLU 798  35.569  -1.371 -13.380
    6    HG3  GLU 798           HG3      GLU 798  35.315   0.009 -12.314

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU 799           H        GLU 799  39.019  -3.925 -12.385
    2    HA   GLU 799           HA       GLU 799  41.407  -3.082 -10.976
    3    HB2  GLU 799           HB2      GLU 799  39.536  -3.315  -9.342
    4    HB3  GLU 799           HB3      GLU 799  39.285  -4.957  -9.910
    5    HG2  GLU 799           HG2      GLU 799  40.513  -4.863  -7.800
    6    HG3  GLU 799           HG3      GLU 799  41.456  -5.608  -9.094

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLU 800           H        GLU 800  42.966  -4.792 -11.022
    2    HA   GLU 800           HA       GLU 800  42.210  -6.958 -12.743
    3    HB2  GLU 800           HB2      GLU 800  44.509  -6.995 -13.679
    4    HB3  GLU 800           HB3      GLU 800  43.572  -5.593 -14.165
    5    HG2  GLU 800           HG2      GLU 800  44.826  -4.198 -12.635
    6    HG3  GLU 800           HG3      GLU 800  45.660  -5.618 -11.999

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLY 801           H        GLY 801  41.838  -8.165 -11.224
    2    HA3  GLY 801           HA2      GLY 801  43.576  -8.831  -9.098
    3    HA2  GLY 801           HA3      GLY 801  42.241  -9.840  -9.653

  No H/Q in entry =           3
  In of MODEL   29
    1    H    PHE 802           H        PHE 802  43.984 -11.414  -9.001
    2    HA   PHE 802           HA       PHE 802  46.384 -11.613 -10.549
    3    HB2  PHE 802           HB2      PHE 802  45.097 -13.526  -8.638
    4    HB3  PHE 802           HB3      PHE 802  46.696 -13.762  -9.334
    5    HD1  PHE 802           HD1      PHE 802  48.514 -12.229  -8.778
    6    HD2  PHE 802           HD2      PHE 802  44.698 -11.934  -6.969
    7    HE1  PHE 802           HE1      PHE 802  49.441 -10.833  -7.080
    8    HE2  PHE 802           HE2      PHE 802  45.613 -10.529  -5.250
    9    HZ   PHE 802           HZ       PHE 802  48.015  -9.949  -5.264

  No H/Q in entry =           9
  In of MODEL   29
    1    H    SER 803           H        SER 803  47.024 -13.484 -11.720
    2    HA   SER 803           HA       SER 803  44.828 -14.445 -13.368
    3    HB2  SER 803           HB2      SER 803  47.833 -14.652 -13.771
    4    HB3  SER 803           HB3      SER 803  46.616 -15.276 -14.890
    5    HG   SER 803           HG       SER 803  46.406 -13.378 -15.670

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ILE 804           H        ILE 804  44.091 -16.470 -13.268
    2    HA   ILE 804           HA       ILE 804  45.524 -18.336 -11.522
    3    HB   ILE 804           HB       ILE 804  43.532 -19.072 -10.393
    4   HG12  ILE 804          HG12      ILE 804  41.910 -18.766 -12.296
    5   HG13  ILE 804          HG13      ILE 804  41.289 -18.264 -10.735
    6   HG23  ILE 804          HG21      ILE 804  42.833 -17.090  -9.128
    7   HG22  ILE 804          HG22      ILE 804  43.614 -16.070 -10.338
    8   HG21  ILE 804          HG23      ILE 804  44.581 -17.179  -9.366
    9   HD12  ILE 804          HD11      ILE 804  40.624 -16.745 -12.490
   10   HD11  ILE 804          HD12      ILE 804  42.313 -16.447 -12.907
   11   HD13  ILE 804          HD13      ILE 804  41.682 -15.945 -11.331

  No H/Q in entry =          11
  In of MODEL   29
    1    H    CYS 805           H        CYS 805  44.183 -20.559 -11.677
    2    HA   CYS 805           HA       CYS 805  43.868 -21.140 -14.556
    3    HB2  CYS 805           HB2      CYS 805  45.890 -22.171 -13.526
    4    HB3  CYS 805           HB3      CYS 805  44.846 -22.929 -12.328

  No H/Q in entry =           4
  In of MODEL   29
    1    H    VAL 806           H        VAL 806  41.949 -21.880 -15.125
    2    HA   VAL 806           HA       VAL 806  40.191 -22.930 -13.027
    3    HB   VAL 806           HB       VAL 806  39.201 -21.241 -15.300
    4   HG13  VAL 806          HG11      VAL 806  37.507 -22.507 -14.294
    5   HG12  VAL 806          HG12      VAL 806  37.338 -20.822 -13.739
    6   HG11  VAL 806          HG13      VAL 806  38.025 -22.046 -12.679
    7   HG23  VAL 806          HG21      VAL 806  39.063 -19.302 -13.795
    8   HG22  VAL 806          HG22      VAL 806  40.715 -19.778 -14.155
    9   HG21  VAL 806          HG23      VAL 806  40.004 -20.190 -12.587

  No H/Q in entry =           9
  In of MODEL   29
    1    H    GLU 807           H        GLU 807  39.325 -24.831 -13.578
    2    HA   GLU 807           HA       GLU 807  39.689 -25.950 -16.213
    3    HB2  GLU 807           HB2      GLU 807  39.997 -27.304 -14.162
    4    HB3  GLU 807           HB3      GLU 807  38.318 -27.047 -13.739
    5    HG2  GLU 807           HG2      GLU 807  37.700 -28.194 -15.868
    6    HG3  GLU 807           HG3      GLU 807  39.405 -28.589 -16.084

  No H/Q in entry =           6
  In of MODEL   29
    1    H    VAL 808           H        VAL 808  38.366 -25.347 -17.670
    2    HA   VAL 808           HA       VAL 808  35.491 -25.145 -17.164
    3    HB   VAL 808           HB       VAL 808  37.150 -23.231 -18.781
    4   HG11  VAL 808          HG11      VAL 808  35.007 -23.525 -19.752
    5   HG13  VAL 808          HG12      VAL 808  35.184 -21.904 -19.070
    6   HG12  VAL 808          HG13      VAL 808  34.224 -23.126 -18.215
    7   HG21  VAL 808          HG21      VAL 808  35.846 -22.766 -16.143
    8   HG23  VAL 808          HG22      VAL 808  36.556 -21.520 -17.160
    9   HG22  VAL 808          HG23      VAL 808  37.567 -22.804 -16.503

  No H/Q in entry =           9
  In of MODEL   29
    1    H    ASN 809           H        ASN 809  34.481 -26.368 -18.677
    2    HA   ASN 809           HA       ASN 809  33.996 -27.529 -20.589
    3    HB2  ASN 809           HB2      ASN 809  36.103 -25.698 -21.704
    4    HB3  ASN 809           HB3      ASN 809  35.514 -27.019 -22.685
    5   HD21  ASN 809          HD21      ASN 809  33.493 -25.259 -20.441
    6   HD22  ASN 809          HD22      ASN 809  32.552 -24.448 -21.624

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLY 810           H        GLY 810  36.168 -28.172 -18.624
    2    HA3  GLY 810           HA2      GLY 810  37.175 -30.272 -18.292
    3    HA2  GLY 810           HA3      GLY 810  37.115 -30.519 -20.044

  No H/Q in entry =           3
  In of MODEL   29
    1    H    LYS 811           H        LYS 811  38.199 -27.548 -19.896
    2    HA   LYS 811           HA       LYS 811  40.999 -28.434 -20.015
    3    HB2  LYS 811           HB2      LYS 811  39.604 -26.092 -21.291
    4    HB3  LYS 811           HB3      LYS 811  41.324 -26.440 -21.396
    5    HG2  LYS 811           HG2      LYS 811  40.896 -28.463 -22.619
    6    HG3  LYS 811           HG3      LYS 811  39.156 -28.270 -22.393
    7    HD2  LYS 811           HD2      LYS 811  39.875 -27.580 -24.622
    8    HD3  LYS 811           HD3      LYS 811  39.174 -26.244 -23.703
    9    HE2  LYS 811           HE2      LYS 811  41.416 -25.446 -23.160
   10    HE3  LYS 811           HE3      LYS 811  42.132 -26.777 -24.056
   11    HZ1  LYS 811           HZ1      LYS 811  41.090 -25.860 -26.073
   12    HZ3  LYS 811           HZ2      LYS 811  42.137 -24.767 -25.347
   13    HZ2  LYS 811           HZ3      LYS 811  40.468 -24.572 -25.174

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLU 812           H        GLU 812  42.540 -27.193 -19.020
    2    HA   GLU 812           HA       GLU 812  41.510 -25.457 -16.903
    3    HB2  GLU 812           HB2      GLU 812  44.225 -26.728 -17.250
    4    HB3  GLU 812           HB3      GLU 812  43.730 -25.758 -15.868
    5    HG2  GLU 812           HG2      GLU 812  42.054 -27.404 -15.276
    6    HG3  GLU 812           HG3      GLU 812  42.464 -28.372 -16.689

  No H/Q in entry =           6
  In of MODEL   29
    1    H    GLN 813           H        GLN 813  41.284 -23.536 -17.692
    2    HA   GLN 813           HA       GLN 813  43.316 -22.432 -19.502
    3    HB2  GLN 813           HB2      GLN 813  41.108 -22.494 -20.402
    4    HB3  GLN 813           HB3      GLN 813  40.419 -21.750 -18.967
    5    HG2  GLN 813           HG2      GLN 813  41.609 -19.674 -19.510
    6    HG3  GLN 813           HG3      GLN 813  42.272 -20.437 -20.950
    7   HE21  GLN 813          HE21      GLN 813  39.780 -21.862 -21.575
    8   HE22  GLN 813          HE22      GLN 813  38.713 -20.648 -22.179

  No H/Q in entry =           8
  In of MODEL   29
    1    H    THR 814           H        THR 814  44.306 -20.548 -19.032
    2    HA   THR 814           HA       THR 814  44.341 -19.657 -16.282
    3    HB   THR 814           HB       THR 814  45.733 -18.484 -18.671
    4    HG1  THR 814           HG1      THR 814  47.520 -19.909 -17.747
    5   HG21  THR 814          HG21      THR 814  45.820 -17.145 -16.632
    6   HG23  THR 814          HG22      THR 814  47.418 -17.790 -17.013
    7   HG22  THR 814          HG23      THR 814  46.449 -18.528 -15.737

  No H/Q in entry =           7
  In of MODEL   29
    1    H    MET 815           H        MET 815  43.075 -17.979 -15.640
    2    HA   MET 815           HA       MET 815  42.191 -16.038 -17.684
    3    HB2  MET 815           HB2      MET 815  40.492 -16.810 -15.312
    4    HB3  MET 815           HB3      MET 815  40.033 -15.820 -16.681
    5    HG2  MET 815           HG2      MET 815  40.340 -17.984 -18.066
    6    HG3  MET 815           HG3      MET 815  40.397 -18.723 -16.463
    7    HE3  MET 815           HE1      MET 815  36.959 -19.716 -17.872
    8    HE2  MET 815           HE2      MET 815  38.541 -20.272 -17.279
    9    HE1  MET 815           HE3      MET 815  38.433 -19.405 -18.802

  No H/Q in entry =           9
  In of MODEL   29
    1    H    SER 816           H        SER 816  41.470 -14.035 -16.570
    2    HA   SER 816           HA       SER 816  43.239 -13.458 -14.353
    3    HB2  SER 816           HB2      SER 816  41.247 -11.676 -15.772
    4    HB3  SER 816           HB3      SER 816  42.511 -11.159 -14.647
    5    HG   SER 816           HG       SER 816  43.680 -12.628 -16.485

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLU 817           H        GLU 817  42.452 -12.887 -12.334
    2    HA   GLU 817           HA       GLU 817  40.547 -14.245 -11.005
    3    HB2  GLU 817           HB2      GLU 817  42.353 -12.763 -10.202
    4    HB3  GLU 817           HB3      GLU 817  41.324 -11.413 -10.609
    5    HG2  GLU 817           HG2      GLU 817  39.652 -12.267  -9.020
    6    HG3  GLU 817           HG3      GLU 817  40.861 -13.464  -8.516

  No H/Q in entry =           6
  In of MODEL   29
    1    H    CYS 818           H        CYS 818  40.217 -10.973 -12.220
    2    HA   CYS 818           HA       CYS 818  37.553 -10.571 -11.503
    3    HB2  CYS 818           HB2      CYS 818  37.800  -8.662 -13.173
    4    HB3  CYS 818           HB3      CYS 818  38.906  -8.694 -11.801

  No H/Q in entry =           4
  In of MODEL   29
    1    H    GLU 819           H        GLU 819  38.977 -12.121 -14.209
    2    HA   GLU 819           HA       GLU 819  36.659 -11.961 -15.909
    3    HB2  GLU 819           HB2      GLU 819  38.919 -11.963 -16.818
    4    HB3  GLU 819           HB3      GLU 819  39.212 -13.511 -16.056
    5    HG2  GLU 819           HG2      GLU 819  37.742 -14.617 -17.520
    6    HG3  GLU 819           HG3      GLU 819  37.155 -13.087 -18.185

  No H/Q in entry =           6
  In of MODEL   29
    1    H    ALA 820           H        ALA 820  38.491 -14.605 -14.349
    2    HA   ALA 820           HA       ALA 820  36.709 -16.639 -14.754
    3    HB2  ALA 820           HB1      ALA 820  37.758 -17.721 -12.793
    4    HB3  ALA 820           HB2      ALA 820  38.518 -16.183 -12.387
    5    HB1  ALA 820           HB3      ALA 820  38.939 -17.004 -13.891

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLY 821           H        GLY 821  36.966 -14.260 -12.156
    2    HA3  GLY 821           HA2      GLY 821  34.871 -15.108 -10.511
    3    HA2  GLY 821           HA3      GLY 821  35.559 -13.491 -10.574

  No H/Q in entry =           3
  In of MODEL   29
    1    H    ALA 822           H        ALA 822  34.935 -12.825 -13.280
    2    HA   ALA 822           HA       ALA 822  32.289 -11.970 -13.026
    3    HB2  ALA 822           HB1      ALA 822  33.934 -10.850 -14.466
    4    HB3  ALA 822           HB2      ALA 822  32.474 -11.266 -15.365
    5    HB1  ALA 822           HB3      ALA 822  33.933 -12.241 -15.548

  No H/Q in entry =           5
  In of MODEL   29
    1    H    LEU 823           H        LEU 823  33.706 -14.607 -14.930
    2    HA   LEU 823           HA       LEU 823  31.287 -15.622 -15.979
    3    HB2  LEU 823           HB2      LEU 823  33.952 -16.914 -15.446
    4    HB3  LEU 823           HB3      LEU 823  32.607 -17.876 -15.999
    5    HG   LEU 823           HG       LEU 823  33.973 -17.411 -17.876
    6   HD11  LEU 823          HD11      LEU 823  31.625 -17.335 -18.329
    7   HD13  LEU 823          HD12      LEU 823  32.513 -16.235 -19.378
    8   HD12  LEU 823          HD13      LEU 823  31.596 -15.600 -18.016
    9   HD22  LEU 823          HD21      LEU 823  35.225 -15.477 -17.066
   10   HD21  LEU 823          HD22      LEU 823  33.784 -14.477 -17.212
   11   HD23  LEU 823          HD23      LEU 823  34.535 -15.156 -18.656

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ARG 824           H        ARG 824  32.931 -16.253 -12.978
    2    HA   ARG 824           HA       ARG 824  31.197 -18.297 -12.032
    3    HB2  ARG 824           HB2      ARG 824  33.451 -18.159 -11.188
    4    HB3  ARG 824           HB3      ARG 824  33.204 -16.508 -10.658
    5    HG2  ARG 824           HG2      ARG 824  33.247 -17.992  -8.765
    6    HG3  ARG 824           HG3      ARG 824  31.636 -17.311  -8.951
    7    HD2  ARG 824           HD2      ARG 824  31.420 -19.622  -8.407
    8    HD3  ARG 824           HD3      ARG 824  30.952 -19.437 -10.091
    9    HE   ARG 824           HE       ARG 824  32.959 -20.523 -10.679
   10   HH11  ARG 824          HH11      ARG 824  32.468 -20.424  -7.135
   11   HH12  ARG 824          HH12      ARG 824  33.343 -21.845  -6.856
   12   HH21  ARG 824          HH21      ARG 824  34.093 -22.554 -10.237
   13   HH22  ARG 824          HH22      ARG 824  34.333 -23.026  -8.617

  No H/Q in entry =          13
  In of MODEL   29
    1    H    CYS 825           H        CYS 825  30.949 -14.872 -12.022
    2    HA   CYS 825           HA       CYS 825  28.997 -14.903  -9.859
    3    HB2  CYS 825           HB2      CYS 825  30.783 -13.157  -9.971
    4    HB3  CYS 825           HB3      CYS 825  30.098 -12.638 -11.505

  No H/Q in entry =           4
  In of MODEL   29
    1    H    ARG 826           H        ARG 826  29.352 -14.758 -13.270
    2    HA   ARG 826           HA       ARG 826  26.738 -13.914 -13.856
    3    HB2  ARG 826           HB2      ARG 826  28.450 -13.481 -15.440
    4    HB3  ARG 826           HB3      ARG 826  28.979 -15.161 -15.429
    5    HG2  ARG 826           HG2      ARG 826  26.965 -15.835 -16.354
    6    HG3  ARG 826           HG3      ARG 826  26.366 -14.158 -16.345
    7    HD2  ARG 826           HD2      ARG 826  27.954 -13.503 -18.003
    8    HD3  ARG 826           HD3      ARG 826  28.846 -15.018 -17.837
    9    HE   ARG 826           HE       ARG 826  26.645 -16.019 -18.637
   10   HH11  ARG 826          HH11      ARG 826  27.893 -12.919 -19.820
   11   HH12  ARG 826          HH12      ARG 826  27.331 -13.162 -21.412
   12   HH21  ARG 826          HH21      ARG 826  25.842 -16.279 -20.881
   13   HH22  ARG 826          HH22      ARG 826  26.168 -15.051 -22.007

  No H/Q in entry =          13
  In of MODEL   29
    1    H    GLY 827           H        GLY 827  28.415 -17.074 -13.836
    2    HA3  GLY 827           HA2      GLY 827  26.843 -18.814 -12.763
    3    HA2  GLY 827           HA3      GLY 827  25.723 -18.269 -14.002

  No H/Q in entry =           3
  In of MODEL   29
    1    H    GLN 828           H        GLN 828  28.794 -18.298 -15.264
    2    HA   GLN 828           HA       GLN 828  28.306 -20.500 -16.987
    3    HB2  GLN 828           HB2      GLN 828  29.638 -18.533 -17.626
    4    HB3  GLN 828           HB3      GLN 828  30.815 -18.907 -16.382
    5    HG2  GLN 828           HG2      GLN 828  31.633 -19.513 -18.584
    6    HG3  GLN 828           HG3      GLN 828  31.422 -20.937 -17.559
    7   HE21  GLN 828          HE21      GLN 828  30.253 -19.240 -20.331
    8   HE22  GLN 828          HE22      GLN 828  29.275 -20.523 -20.936

  No H/Q in entry =           8
  In of MODEL   29
    1    H    SER 829           H        SER 829  29.769 -22.425 -17.131
    2    HA   SER 829           HA       SER 829  30.277 -23.515 -14.510
    3    HB2  SER 829           HB2      SER 829  29.188 -24.946 -16.031
    4    HB3  SER 829           HB3      SER 829  30.430 -24.766 -17.271
    5    HG   SER 829           HG       SER 829  30.445 -26.103 -14.807

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ILE 830           H        ILE 830  32.102 -23.128 -13.566
    2    HA   ILE 830           HA       ILE 830  34.537 -23.409 -15.055
    3    HB   ILE 830           HB       ILE 830  35.571 -21.363 -14.137
    4   HG12  ILE 830          HG12      ILE 830  34.114 -21.220 -12.070
    5   HG13  ILE 830          HG13      ILE 830  34.399 -19.660 -12.719
    6   HG21  ILE 830          HG21      ILE 830  34.612 -21.132 -16.316
    7   HG23  ILE 830          HG22      ILE 830  34.442 -19.609 -15.439
    8   HG22  ILE 830          HG23      ILE 830  33.055 -20.694 -15.624
    9   HD11  ILE 830          HD11      ILE 830  31.927 -21.278 -13.178
   10   HD13  ILE 830          HD12      ILE 830  32.239 -19.644 -13.788
   11   HD12  ILE 830          HD13      ILE 830  32.134 -19.942 -12.050

  No H/Q in entry =          11
  In of MODEL   29
    1    H    SER 831           H        SER 831  35.992 -24.467 -13.764
    2    HA   SER 831           HA       SER 831  35.410 -24.605 -10.904
    3    HB2  SER 831           HB2      SER 831  36.670 -26.549 -12.792
    4    HB3  SER 831           HB3      SER 831  36.545 -26.756 -11.038
    5    HG   SER 831           HG       SER 831  34.131 -26.407 -11.556

  No H/Q in entry =           5
  In of MODEL   29
    1    H    VAL 832           H        VAL 832  36.851 -23.191  -9.952
    2    HA   VAL 832           HA       VAL 832  39.363 -22.572 -11.166
    3    HB   VAL 832           HB       VAL 832  38.282 -21.905  -8.423
    4   HG13  VAL 832          HG11      VAL 832  40.029 -20.135  -8.363
    5   HG12  VAL 832          HG12      VAL 832  40.658 -20.722  -9.901
    6   HG11  VAL 832          HG13      VAL 832  40.743 -21.744  -8.466
    7   HG21  VAL 832          HG21      VAL 832  36.930 -20.948 -10.189
    8   HG23  VAL 832          HG22      VAL 832  38.364 -20.259 -10.947
    9   HG22  VAL 832          HG23      VAL 832  37.836 -19.672  -9.371

  No H/Q in entry =           9
  In of MODEL   29
    1    H    THR 833           H        THR 833  40.968 -23.964 -11.210
    2    HA   THR 833           HA       THR 833  41.109 -26.045  -9.237
    3    HB   THR 833           HB       THR 833  42.956 -26.852 -10.766
    4    HG1  THR 833           HG1      THR 833  43.444 -25.693 -12.454
    5   HG23  THR 833          HG21      THR 833  40.675 -27.740 -10.883
    6   HG22  THR 833          HG22      THR 833  41.384 -27.613 -12.496
    7   HG21  THR 833          HG23      THR 833  40.212 -26.414 -11.950

  No H/Q in entry =           7
  In of MODEL   29
    1    H    SER 834           H        SER 834  42.906 -23.202 -10.242
    2    HA   SER 834           HA       SER 834  44.539 -23.469  -7.869
    3    HB2  SER 834           HB2      SER 834  45.776 -23.288 -10.625
    4    HB3  SER 834           HB3      SER 834  46.643 -23.141  -9.102
    5    HG   SER 834           HG       SER 834  45.077 -25.394  -9.285

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ILE 835           H        ILE 835  45.300 -21.606  -7.097
    2    HA   ILE 835           HA       ILE 835  44.163 -19.081  -8.055
    3    HB   ILE 835           HB       ILE 835  45.086 -18.162  -6.005
    4   HG12  ILE 835          HG12      ILE 835  46.045 -19.812  -4.288
    5   HG13  ILE 835          HG13      ILE 835  46.382 -20.877  -5.644
    6   HG22  ILE 835          HG21      ILE 835  43.841 -19.533  -4.408
    7   HG21  ILE 835          HG22      ILE 835  43.719 -20.803  -5.631
    8   HG23  ILE 835          HG23      ILE 835  42.953 -19.232  -5.905
    9   HD11  ILE 835          HD11      ILE 835  47.482 -18.136  -5.175
   10   HD13  ILE 835          HD12      ILE 835  47.869 -19.177  -6.552
   11   HD12  ILE 835          HD13      ILE 835  48.318 -19.665  -4.907

  No H/Q in entry =          11
  In of MODEL   29
    1    H    ARG 836           H        ARG 836  46.839 -20.829  -8.803
    2    HA   ARG 836           HA       ARG 836  48.322 -18.435  -9.547
    3    HB2  ARG 836           HB2      ARG 836  50.260 -19.923  -9.848
    4    HB3  ARG 836           HB3      ARG 836  49.667 -19.854  -8.204
    5    HG2  ARG 836           HG2      ARG 836  48.631 -22.027  -8.489
    6    HG3  ARG 836           HG3      ARG 836  49.208 -22.086 -10.166
    7    HD2  ARG 836           HD2      ARG 836  51.439 -21.836  -9.441
    8    HD3  ARG 836           HD3      ARG 836  50.930 -21.691  -7.769
    9    HE   ARG 836           HE       ARG 836  50.034 -24.140  -8.907
   10   HH11  ARG 836          HH11      ARG 836  52.961 -22.619  -7.633
   11   HH12  ARG 836          HH12      ARG 836  53.623 -24.044  -6.994
   12   HH21  ARG 836          HH21      ARG 836  50.940 -26.143  -8.040
   13   HH22  ARG 836          HH22      ARG 836  52.452 -26.119  -7.254

  No H/Q in entry =          13
  In of MODEL   29
    1    HA   PRO 837           HA       PRO 837  47.154 -19.013 -13.670
    2    HB2  PRO 837           HB2      PRO 837  49.323 -18.141 -15.054
    3    HB3  PRO 837           HB3      PRO 837  48.235 -17.052 -14.185
    4    HG2  PRO 837           HG2      PRO 837  50.890 -18.147 -13.341
    5    HG3  PRO 837           HG3      PRO 837  50.252 -16.499 -13.180
    6    HD2  PRO 837           HD2      PRO 837  50.264 -18.246 -11.128
    7    HD3  PRO 837           HD3      PRO 837  48.990 -17.027 -11.331

  No H/Q in entry =           7
  In of MODEL   29
    1    H    CYS 838           H        CYS 838  47.258 -20.423 -15.348
    2    HA   CYS 838           HA       CYS 838  49.155 -22.626 -15.122
    3    HB2  CYS 838           HB2      CYS 838  46.747 -23.159 -15.318
    4    HB3  CYS 838           HB3      CYS 838  46.672 -22.251 -16.824

  No H/Q in entry =           4
  In of MODEL   29
    1    H    ALA 839           H        ALA 839  50.023 -23.375 -17.366
    2    HA   ALA 839           HA       ALA 839  51.014 -21.026 -18.731
    3    HB1  ALA 839           HB1      ALA 839  51.642 -23.936 -19.229
    4    HB2  ALA 839           HB2      ALA 839  52.566 -22.852 -18.189
    5    HB3  ALA 839           HB3      ALA 839  52.488 -22.559 -19.926

  No H/Q in entry =           5
  In of MODEL   29
    1    H    ALA 840           H        ALA 840  48.241 -22.543 -18.926
    2    HA   ALA 840           HA       ALA 840  47.674 -23.073 -21.622
    3    HB3  ALA 840           HB1      ALA 840  45.338 -22.623 -21.033
    4    HB1  ALA 840           HB2      ALA 840  45.861 -21.897 -19.516
    5    HB2  ALA 840           HB3      ALA 840  46.128 -23.613 -19.806

  No H/Q in entry =           5
  In of MODEL   29
    1    H    GLU 841           H        GLU 841  46.821 -20.238 -19.840
    2    HA   GLU 841           HA       GLU 841  46.346 -18.071 -20.426
    3    HB2  GLU 841           HB2      GLU 841  48.946 -18.399 -21.913
    4    HB3  GLU 841           HB3      GLU 841  48.205 -16.869 -21.463
    5    HG2  GLU 841           HG2      GLU 841  48.456 -17.421 -19.110
    6    HG3  GLU 841           HG3      GLU 841  49.170 -18.976 -19.539

  No H/Q in entry =           6
  In of MODEL   29
    1    H    THR 842           H        THR 842  44.492 -18.852 -21.645
    2    HA   THR 842           HA       THR 842  44.740 -18.916 -24.477
    3    HB   THR 842           HB       THR 842  42.241 -18.736 -22.817
    4    HG1  THR 842           HG1      THR 842  43.990 -20.889 -23.428
    5   HG21  THR 842          HG21      THR 842  41.949 -18.447 -25.240
    6   HG23  THR 842          HG22      THR 842  41.239 -19.969 -24.707
    7   HG22  THR 842          HG23      THR 842  42.796 -19.964 -25.534

  No H/Q in entry =           7
  In of MODEL   29
    1    H    GLN 843           H        GLN 843  45.172 -17.079 -25.367
    2    HA   GLN 843           HA       GLN 843  44.016 -14.576 -24.411
    3    HB2  GLN 843           HB2      GLN 843  46.008 -14.977 -26.665
    4    HB3  GLN 843           HB3      GLN 843  45.601 -13.470 -25.867
    5    HG2  GLN 843           HG2      GLN 843  47.059 -15.794 -24.636
    6    HG3  GLN 843           HG3      GLN 843  47.770 -14.276 -25.173
    7   HE21  GLN 843          HE21      GLN 843  47.776 -15.524 -22.594
    8   HE22  GLN 843          HE22      GLN 843  47.071 -14.393 -21.481

  No H/Q in entry =           8
  In of MODEL   30
    1    H1   GLY 689           H2       GLY 689  54.891  -7.020 -27.249
    2    H2   GLY 689           H1       GLY 689  55.000  -7.746 -28.753
    3    H3   GLY 689           H3       GLY 689  56.254  -7.954 -27.646
    4    HA2  GLY 689           HA2      GLY 689  56.827  -6.387 -29.392
    5    HA3  GLY 689           HA3      GLY 689  56.774  -5.595 -27.819

  No H/Q in entry =           5
  In of MODEL   30
    1    H    SER 690           H        SER 690  56.512  -3.699 -29.414
    2    HA   SER 690           HA       SER 690  53.901  -3.409 -30.563
    3    HB2  SER 690           HB2      SER 690  53.263  -1.501 -29.093
    4    HB3  SER 690           HB3      SER 690  53.364  -3.024 -28.206
    5    HG   SER 690           HG       SER 690  55.484  -2.392 -27.581

  No H/Q in entry =           5
  In of MODEL   30
    1    H    HIS 691           H        HIS 691  53.724  -1.196 -31.537
    2    HA   HIS 691           HA       HIS 691  56.390  -0.014 -31.940
    3    HB2  HIS 691           HB2      HIS 691  55.878   0.597 -34.197
    4    HB3  HIS 691           HB3      HIS 691  55.337  -1.059 -34.026
    5    HD1  HIS 691           HD1      HIS 691  54.250   2.183 -35.209
    6    HD2  HIS 691           HD2      HIS 691  52.368  -1.192 -33.703
    7    HE1  HIS 691           HE1      HIS 691  51.841   2.414 -35.827
    8    HE2  HIS 691           HE2      HIS 691  50.712   0.484 -34.679

  No H/Q in entry =           8
  In of MODEL   30
    1    H    MET 692           H        MET 692  53.383   0.501 -30.581
    2    HA   MET 692           HA       MET 692  53.333   3.347 -31.063
    3    HB2  MET 692           HB2      MET 692  51.550   1.657 -29.316
    4    HB3  MET 692           HB3      MET 692  51.359   3.388 -29.530
    5    HG2  MET 692           HG2      MET 692  51.097   1.264 -31.647
    6    HG3  MET 692           HG3      MET 692  49.802   2.215 -30.929
    7    HE1  MET 692           HE1      MET 692  49.505   4.857 -31.379
    8    HE3  MET 692           HE2      MET 692  50.601   5.793 -32.391
    9    HE2  MET 692           HE3      MET 692  51.165   5.143 -30.851

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ASN 693           H        ASN 693  54.910   1.396 -28.828
    2    HA   ASN 693           HA       ASN 693  54.953   3.515 -26.867
    3    HB2  ASN 693           HB2      ASN 693  56.274   0.780 -26.853
    4    HB3  ASN 693           HB3      ASN 693  56.598   1.990 -25.617
    5   HD21  ASN 693          HD21      ASN 693  54.365  -0.387 -26.762
    6   HD22  ASN 693          HD22      ASN 693  53.214  -0.206 -25.499

  No H/Q in entry =           6
  In of MODEL   30
    1    HA   PRO 694           HA       PRO 694  58.067   5.639 -29.054
    2    HB2  PRO 694           HB2      PRO 694  58.911   7.308 -27.052
    3    HB3  PRO 694           HB3      PRO 694  57.430   7.553 -27.977
    4    HG2  PRO 694           HG2      PRO 694  57.790   6.337 -25.270
    5    HG3  PRO 694           HG3      PRO 694  56.543   7.464 -25.835
    6    HD2  PRO 694           HD2      PRO 694  56.074   4.827 -25.573
    7    HD3  PRO 694           HD3      PRO 694  55.317   5.784 -26.865

  No H/Q in entry =           7
  In of MODEL   30
    1    H    LEU 695           H        LEU 695  58.849   4.163 -25.977
    2    HA   LEU 695           HA       LEU 695  61.365   3.457 -27.084
    3    HB2  LEU 695           HB2      LEU 695  62.611   4.126 -24.955
    4    HB3  LEU 695           HB3      LEU 695  62.190   5.393 -26.072
    5    HG   LEU 695           HG       LEU 695  60.208   5.878 -24.507
    6   HD12  LEU 695          HD11      LEU 695  61.877   4.274 -22.586
    7   HD11  LEU 695          HD12      LEU 695  60.275   3.848 -23.178
    8   HD13  LEU 695          HD13      LEU 695  60.488   5.280 -22.171
    9   HD22  LEU 695          HD21      LEU 695  62.106   7.345 -24.743
   10   HD21  LEU 695          HD22      LEU 695  63.031   6.373 -23.597
   11   HD23  LEU 695          HD23      LEU 695  61.609   7.262 -23.053

  No H/Q in entry =          11
  In of MODEL   30
    1    H    THR 696           H        THR 696  61.696   1.445 -26.884
    2    HA   THR 696           HA       THR 696  60.232  -0.019 -24.888
    3    HB   THR 696           HB       THR 696  61.282  -1.971 -26.213
    4    HG1  THR 696           HG1      THR 696  62.789  -1.177 -27.456
    5   HG22  THR 696          HG21      THR 696  59.597  -1.768 -28.005
    6   HG21  THR 696          HG22      THR 696  59.395  -0.059 -27.618
    7   HG23  THR 696          HG23      THR 696  58.922  -1.289 -26.447

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLN 697           H        GLN 697  61.392   0.631 -23.082
    2    HA   GLN 697           HA       GLN 697  64.153  -0.338 -22.977
    3    HB2  GLN 697           HB2      GLN 697  62.861   1.869 -21.405
    4    HB3  GLN 697           HB3      GLN 697  64.460   1.216 -21.079
    5    HG2  GLN 697           HG2      GLN 697  65.043   1.829 -23.461
    6    HG3  GLN 697           HG3      GLN 697  63.527   2.728 -23.494
    7   HE21  GLN 697          HE21      GLN 697  65.636   2.407 -20.702
    8   HE22  GLN 697          HE22      GLN 697  66.097   4.063 -20.657

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ALA 698           H        ALA 698  64.812  -1.083 -20.842
    2    HA   ALA 698           HA       ALA 698  62.830  -2.915 -19.809
    3    HB3  ALA 698           HB1      ALA 698  64.631  -3.805 -18.449
    4    HB1  ALA 698           HB2      ALA 698  65.663  -2.440 -18.874
    5    HB2  ALA 698           HB3      ALA 698  65.203  -3.610 -20.109

  No H/Q in entry =           5
  In of MODEL   30
    1    H    VAL 699           H        VAL 699  61.299  -2.055 -18.829
    2    HA   VAL 699           HA       VAL 699  61.862  -0.304 -16.634
    3    HB   VAL 699           HB       VAL 699  59.400  -0.023 -16.712
    4   HG12  VAL 699          HG11      VAL 699  59.462   1.569 -18.660
    5   HG11  VAL 699          HG12      VAL 699  60.972   0.814 -19.171
    6   HG13  VAL 699          HG13      VAL 699  60.895   1.687 -17.641
    7   HG23  VAL 699          HG21      VAL 699  59.626  -1.367 -19.407
    8   HG22  VAL 699          HG22      VAL 699  58.197  -0.515 -18.826
    9   HG21  VAL 699          HG23      VAL 699  58.748  -1.974 -18.002

  No H/Q in entry =           9
  In of MODEL   30
    1    HA   PRO 700           HA       PRO 700  61.221  -3.859 -14.117
    2    HB2  PRO 700           HB2      PRO 700  60.732  -2.629 -11.740
    3    HB3  PRO 700           HB3      PRO 700  62.338  -2.887 -12.429
    4    HG2  PRO 700           HG2      PRO 700  60.653  -0.426 -12.403
    5    HG3  PRO 700           HG3      PRO 700  62.411  -0.566 -12.242
    6    HD2  PRO 700           HD2      PRO 700  61.164   0.181 -14.563
    7    HD3  PRO 700           HD3      PRO 700  62.730  -0.642 -14.528

  No H/Q in entry =           7
  In of MODEL   30
    1    H    LYS 701           H        LYS 701  59.623  -5.030 -14.043
    2    HA   LYS 701           HA       LYS 701  56.937  -3.948 -13.655
    3    HB2  LYS 701           HB2      LYS 701  57.905  -6.366 -15.105
    4    HB3  LYS 701           HB3      LYS 701  56.215  -6.132 -14.692
    5    HG2  LYS 701           HG2      LYS 701  56.260  -3.993 -15.912
    6    HG3  LYS 701           HG3      LYS 701  57.923  -4.336 -16.379
    7    HD2  LYS 701           HD2      LYS 701  56.652  -4.935 -18.169
    8    HD3  LYS 701           HD3      LYS 701  57.070  -6.460 -17.365
    9    HE2  LYS 701           HE2      LYS 701  54.385  -5.028 -17.119
   10    HE3  LYS 701           HE3      LYS 701  54.681  -6.355 -18.221
   11    HZ2  LYS 701           HZ1      LYS 701  54.684  -6.495 -15.230
   12    HZ1  LYS 701           HZ2      LYS 701  55.126  -7.765 -16.248
   13    HZ3  LYS 701           HZ3      LYS 701  53.572  -7.167 -16.297

  No H/Q in entry =          13
  In of MODEL   30
    1    H    CYS 702           H        CYS 702  55.483  -5.908 -12.765
    2    HA   CYS 702           HA       CYS 702  56.932  -7.528 -10.849
    3    HB2  CYS 702           HB2      CYS 702  55.081  -7.004  -9.233
    4    HB3  CYS 702           HB3      CYS 702  56.243  -5.719  -9.415

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLN 703           H        GLN 703  55.868  -9.455 -10.448
    2    HA   GLN 703           HA       GLN 703  53.683 -10.114 -12.200
    3    HB2  GLN 703           HB2      GLN 703  55.018 -11.648  -9.960
    4    HB3  GLN 703           HB3      GLN 703  53.748 -12.301 -10.988
    5    HG2  GLN 703           HG2      GLN 703  56.435 -11.337 -11.917
    6    HG3  GLN 703           HG3      GLN 703  55.956 -13.021 -11.705
    7   HE21  GLN 703          HE21      GLN 703  54.596 -13.964 -13.197
    8   HE22  GLN 703          HE22      GLN 703  54.225 -13.223 -14.707

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ARG 704           H        ARG 704  51.839 -11.349 -10.930
    2    HA   ARG 704           HA       ARG 704  50.296  -9.329  -9.791
    3    HB2  ARG 704           HB2      ARG 704  49.970 -12.295  -9.471
    4    HB3  ARG 704           HB3      ARG 704  48.757 -11.110  -9.032
    5    HG2  ARG 704           HG2      ARG 704  49.832 -11.603 -11.791
    6    HG3  ARG 704           HG3      ARG 704  48.290 -12.164 -11.152
    7    HD2  ARG 704           HD2      ARG 704  47.657  -9.804 -10.790
    8    HD3  ARG 704           HD3      ARG 704  49.154  -9.320 -11.578
    9    HE   ARG 704           HE       ARG 704  47.609 -11.133 -13.179
   10   HH11  ARG 704          HH11      ARG 704  47.981  -7.694 -12.388
   11   HH12  ARG 704          HH12      ARG 704  47.294  -7.159 -13.858
   12   HH21  ARG 704          HH21      ARG 704  46.661 -10.364 -15.187
   13   HH22  ARG 704          HH22      ARG 704  46.545  -8.688 -15.448

  No H/Q in entry =          13
  In of MODEL   30
    1    H    TRP 705           H        TRP 705  52.362 -11.604  -8.213
    2    HA   TRP 705           HA       TRP 705  51.433 -10.806  -5.568
    3    HB2  TRP 705           HB2      TRP 705  52.820 -12.761  -4.817
    4    HB3  TRP 705           HB3      TRP 705  51.506 -13.164  -5.920
    5    HD1  TRP 705           HD1      TRP 705  55.293 -13.217  -5.640
    6    HE1  TRP 705           HE1      TRP 705  56.281 -14.430  -7.666
    7    HE3  TRP 705           HE3      TRP 705  51.053 -13.711  -8.454
    8    HZ2  TRP 705           HZ2      TRP 705  55.396 -15.485 -10.127
    9    HZ3  TRP 705           HZ3      TRP 705  51.217 -14.825 -10.642
   10    HH2  TRP 705           HH2      TRP 705  53.342 -15.704 -11.455

  No H/Q in entry =          10
  In of MODEL   30
    1    H    GLU 706           H        GLU 706  53.506  -9.432  -7.626
    2    HA   GLU 706           HA       GLU 706  55.443  -8.936  -5.518
    3    HB2  GLU 706           HB2      GLU 706  55.954  -8.982  -8.516
    4    HB3  GLU 706           HB3      GLU 706  57.117  -8.541  -7.276
    5    HG2  GLU 706           HG2      GLU 706  56.958 -10.806  -6.355
    6    HG3  GLU 706           HG3      GLU 706  55.857 -11.237  -7.663

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LYS 707           H        LYS 707  56.467  -6.719  -5.905
    2    HA   LYS 707           HA       LYS 707  54.778  -4.911  -7.333
    3    HB2  LYS 707           HB2      LYS 707  54.048  -3.557  -5.477
    4    HB3  LYS 707           HB3      LYS 707  53.529  -5.203  -5.226
    5    HG2  LYS 707           HG2      LYS 707  54.206  -4.661  -3.104
    6    HG3  LYS 707           HG3      LYS 707  55.701  -5.341  -3.738
    7    HD2  LYS 707           HD2      LYS 707  56.186  -3.283  -2.547
    8    HD3  LYS 707           HD3      LYS 707  56.475  -3.038  -4.269
    9    HE2  LYS 707           HE2      LYS 707  54.293  -1.925  -4.491
   10    HE3  LYS 707           HE3      LYS 707  53.968  -2.213  -2.784
   11    HZ3  LYS 707           HZ1      LYS 707  54.692   0.004  -3.179
   12    HZ2  LYS 707           HZ2      LYS 707  56.110  -0.496  -3.915
   13    HZ1  LYS 707           HZ3      LYS 707  55.844  -0.797  -2.252

  No H/Q in entry =          13
  In of MODEL   30
    1    H    LEU 708           H        LEU 708  55.589  -2.729  -7.330
    2    HA   LEU 708           HA       LEU 708  58.494  -2.771  -7.413
    3    HB2  LEU 708           HB2      LEU 708  57.264  -2.040  -9.388
    4    HB3  LEU 708           HB3      LEU 708  56.446  -0.808  -8.454
    5    HG   LEU 708           HG       LEU 708  58.667   0.300  -8.121
    6   HD11  LEU 708          HD11      LEU 708  59.568  -1.734 -10.140
    7   HD13  LEU 708          HD12      LEU 708  60.116  -1.604  -8.469
    8   HD12  LEU 708          HD13      LEU 708  60.491  -0.326  -9.625
    9   HD23  LEU 708          HD21      LEU 708  57.768  -0.111 -10.963
   10   HD22  LEU 708          HD22      LEU 708  58.768   1.223 -10.384
   11   HD21  LEU 708          HD23      LEU 708  57.101   1.061  -9.828

  No H/Q in entry =          11
  In of MODEL   30
    1    H    GLN 709           H        GLN 709  59.627  -1.959  -5.747
    2    HA   GLN 709           HA       GLN 709  58.879   0.616  -4.657
    3    HB2  GLN 709           HB2      GLN 709  59.009   0.039  -2.356
    4    HB3  GLN 709           HB3      GLN 709  57.945  -1.172  -3.046
    5    HG2  GLN 709           HG2      GLN 709  59.840  -2.757  -3.111
    6    HG3  GLN 709           HG3      GLN 709  60.855  -1.508  -2.383
    7   HE21  GLN 709          HE21      GLN 709  61.270  -2.795  -0.623
    8   HE22  GLN 709          HE22      GLN 709  60.111  -3.058   0.629

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ASN 710           H        ASN 710  60.720   1.729  -3.950
    2    HA   ASN 710           HA       ASN 710  62.986   2.292  -3.894
    3    HB2  ASN 710           HB2      ASN 710  62.818   0.261  -2.253
    4    HB3  ASN 710           HB3      ASN 710  63.547  -0.665  -3.550
    5   HD21  ASN 710          HD21      ASN 710  64.001   1.596  -1.114
    6   HD22  ASN 710          HD22      ASN 710  65.724   1.772  -1.200

  No H/Q in entry =           6
  In of MODEL   30
    1    H    SER 711           H        SER 711  61.644   1.498  -6.324
    2    HA   SER 711           HA       SER 711  61.919   1.207  -8.494
    3    HB2  SER 711           HB2      SER 711  64.015   1.998  -9.561
    4    HB3  SER 711           HB3      SER 711  63.509   3.032  -8.217
    5    HG   SER 711           HG       SER 711  65.016   1.554  -6.988

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ARG 712           H        ARG 712  62.407  -1.098  -6.623
    2    HA   ARG 712           HA       ARG 712  63.607  -2.918  -8.600
    3    HB2  ARG 712           HB2      ARG 712  64.562  -4.228  -6.814
    4    HB3  ARG 712           HB3      ARG 712  65.040  -2.565  -6.533
    5    HG2  ARG 712           HG2      ARG 712  63.298  -2.327  -4.856
    6    HG3  ARG 712           HG3      ARG 712  62.768  -3.975  -5.155
    7    HD2  ARG 712           HD2      ARG 712  64.098  -4.029  -3.189
    8    HD3  ARG 712           HD3      ARG 712  65.086  -4.715  -4.476
    9    HE   ARG 712           HE       ARG 712  65.723  -2.046  -4.415
   10   HH11  ARG 712          HH11      ARG 712  65.872  -4.730  -2.122
   11   HH12  ARG 712          HH12      ARG 712  67.149  -4.061  -1.215
   12   HH21  ARG 712          HH21      ARG 712  67.406  -1.136  -3.179
   13   HH22  ARG 712          HH22      ARG 712  68.055  -1.950  -1.824

  No H/Q in entry =          13
  In of MODEL   30
    1    H    CYS 713           H        CYS 713  62.693  -5.206  -8.250
    2    HA   CYS 713           HA       CYS 713  59.862  -4.938  -7.585
    3    HB2  CYS 713           HB2      CYS 713  60.387  -5.827  -9.857
    4    HB3  CYS 713           HB3      CYS 713  61.265  -7.156  -9.104

  No H/Q in entry =           4
  In of MODEL   30
    1    H    VAL 714           H        VAL 714  59.154  -5.783  -5.776
    2    HA   VAL 714           HA       VAL 714  60.742  -7.875  -4.487
    3    HB   VAL 714           HB       VAL 714  60.081  -6.996  -2.276
    4   HG13  VAL 714          HG11      VAL 714  61.507  -5.020  -2.188
    5   HG12  VAL 714          HG12      VAL 714  61.450  -4.912  -3.944
    6   HG11  VAL 714          HG13      VAL 714  62.227  -6.298  -3.175
    7   HG22  VAL 714          HG21      VAL 714  58.005  -5.894  -2.875
    8   HG21  VAL 714          HG22      VAL 714  58.888  -4.691  -3.814
    9   HG23  VAL 714          HG23      VAL 714  59.078  -4.753  -2.060

  No H/Q in entry =           9
  In of MODEL   30
    1    H    CYS 715           H        CYS 715  59.242  -8.880  -2.710
    2    HA   CYS 715           HA       CYS 715  56.833  -9.658  -4.099
    3    HB2  CYS 715           HB2      CYS 715  56.660 -11.274  -2.111
    4    HB3  CYS 715           HB3      CYS 715  58.082 -11.478  -3.126

  No H/Q in entry =           4
  In of MODEL   30
    1    H    LYS 716           H        LYS 716  54.788  -9.314  -3.292
    2    HA   LYS 716           HA       LYS 716  54.316  -6.748  -2.242
    3    HB2  LYS 716           HB2      LYS 716  52.939  -8.204  -3.825
    4    HB3  LYS 716           HB3      LYS 716  52.384  -9.046  -2.398
    5    HG2  LYS 716           HG2      LYS 716  51.411  -6.914  -1.580
    6    HG3  LYS 716           HG3      LYS 716  51.894  -6.157  -3.103
    7    HD2  LYS 716           HD2      LYS 716  50.584  -7.949  -4.289
    8    HD3  LYS 716           HD3      LYS 716  49.981  -8.456  -2.718
    9    HE2  LYS 716           HE2      LYS 716  48.349  -7.042  -3.748
   10    HE3  LYS 716           HE3      LYS 716  49.066  -6.173  -2.391
   11    HZ1  LYS 716           HZ1      LYS 716  49.927  -5.821  -5.210
   12    HZ3  LYS 716           HZ2      LYS 716  50.366  -4.849  -3.902
   13    HZ2  LYS 716           HZ3      LYS 716  48.784  -4.854  -4.463

  No H/Q in entry =          13
  In of MODEL   30
    1    H    MET 717           H        MET 717  52.795  -6.387  -0.310
    2    HA   MET 717           HA       MET 717  53.820  -7.788   2.007
    3    HB2  MET 717           HB2      MET 717  51.833  -5.521   1.748
    4    HB3  MET 717           HB3      MET 717  52.403  -6.162   3.270
    5    HG2  MET 717           HG2      MET 717  54.294  -4.990   1.255
    6    HG3  MET 717           HG3      MET 717  53.415  -3.974   2.384
    7    HE3  MET 717           HE1      MET 717  55.352  -7.588   3.064
    8    HE2  MET 717           HE2      MET 717  56.913  -6.845   3.410
    9    HE1  MET 717           HE3      MET 717  56.166  -6.634   1.828

  No H/Q in entry =           9
  In of MODEL   30
    1    HA   PRO 718           HA       PRO 718  50.572 -10.821   1.648
    2    HB2  PRO 718           HB2      PRO 718  50.794 -11.937   4.148
    3    HB3  PRO 718           HB3      PRO 718  51.878 -12.304   2.803
    4    HG2  PRO 718           HG2      PRO 718  52.269 -10.407   5.086
    5    HG3  PRO 718           HG3      PRO 718  53.420 -11.549   4.369
    6    HD2  PRO 718           HD2      PRO 718  53.501  -8.925   3.807
    7    HD3  PRO 718           HD3      PRO 718  53.882 -10.145   2.574

  No H/Q in entry =           7
  In of MODEL   30
    1    H    TYR 719           H        TYR 719  50.580  -8.392   4.011
    2    HA   TYR 719           HA       TYR 719  47.888  -9.007   4.933
    3    HB2  TYR 719           HB2      TYR 719  48.252  -7.121   6.520
    4    HB3  TYR 719           HB3      TYR 719  49.445  -8.404   6.672
    5    HD1  TYR 719           HD1      TYR 719  48.875  -4.915   5.759
    6    HD2  TYR 719           HD2      TYR 719  51.783  -8.014   5.978
    7    HE1  TYR 719           HE1      TYR 719  50.666  -3.245   5.543
    8    HE2  TYR 719           HE2      TYR 719  53.578  -6.342   5.764
    9    HH   TYR 719           HH       TYR 719  53.921  -4.119   4.958

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLU 720           H        GLU 720  49.245  -7.381   2.388
    2    HA   GLU 720           HA       GLU 720  47.185  -5.279   2.334
    3    HB2  GLU 720           HB2      GLU 720  49.721  -4.758   2.199
    4    HB3  GLU 720           HB3      GLU 720  49.648  -5.468   0.595
    5    HG2  GLU 720           HG2      GLU 720  49.505  -3.091   0.407
    6    HG3  GLU 720           HG3      GLU 720  47.936  -3.784  -0.015

  No H/Q in entry =           6
  In of MODEL   30
    1    H    CYS 721           H        CYS 721  47.062  -8.150   1.716
    2    HA   CYS 721           HA       CYS 721  46.608  -8.190  -1.169
    3    HB2  CYS 721           HB2      CYS 721  46.839 -10.427   0.821
    4    HB3  CYS 721           HB3      CYS 721  46.670 -10.617  -0.922

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLY 722           H        GLY 722  44.564  -7.334  -1.386
    2    HA3  GLY 722           HA2      GLY 722  42.454  -8.528   0.265
    3    HA2  GLY 722           HA3      GLY 722  42.376  -6.953  -0.493

  No H/Q in entry =           3
  In of MODEL   30
    1    HA   PRO 723           HA       PRO 723  39.858  -8.489  -3.660
    2    HB2  PRO 723           HB2      PRO 723  40.730  -7.217  -5.913
    3    HB3  PRO 723           HB3      PRO 723  39.804  -6.431  -4.630
    4    HG2  PRO 723           HG2      PRO 723  42.760  -6.436  -5.093
    5    HG3  PRO 723           HG3      PRO 723  41.698  -5.083  -4.661
    6    HD2  PRO 723           HD2      PRO 723  43.206  -6.315  -2.818
    7    HD3  PRO 723           HD3      PRO 723  41.577  -5.711  -2.450

  No H/Q in entry =           7
  In of MODEL   30
    1    H    SER 724           H        SER 724  40.110 -10.606  -3.942
    2    HA   SER 724           HA       SER 724  41.248 -11.643  -6.338
    3    HB2  SER 724           HB2      SER 724  42.516 -12.151  -3.658
    4    HB3  SER 724           HB3      SER 724  42.529 -13.390  -4.921
    5    HG   SER 724           HG       SER 724  43.352 -11.549  -6.201

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU 725           H        LEU 725  40.887 -14.043  -6.289
    2    HA   LEU 725           HA       LEU 725  38.256 -14.701  -5.363
    3    HB2  LEU 725           HB2      LEU 725  40.454 -16.065  -6.708
    4    HB3  LEU 725           HB3      LEU 725  39.354 -17.106  -5.826
    5    HG   LEU 725           HG       LEU 725  38.394 -17.200  -7.770
    6   HD11  LEU 725          HD11      LEU 725  36.679 -16.318  -6.496
    7   HD13  LEU 725          HD12      LEU 725  36.562 -15.852  -8.205
    8   HD12  LEU 725          HD13      LEU 725  37.130 -14.682  -7.035
    9   HD23  LEU 725          HD21      LEU 725  39.204 -14.476  -8.557
   10   HD22  LEU 725          HD22      LEU 725  38.398 -15.657  -9.600
   11   HD21  LEU 725          HD23      LEU 725  40.040 -15.967  -9.011

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ASP 726           H        ASP 726  37.769 -15.218  -3.284
    2    HA   ASP 726           HA       ASP 726  39.889 -15.899  -1.501
    3    HB2  ASP 726           HB2      ASP 726  36.912 -15.666  -1.034
    4    HB3  ASP 726           HB3      ASP 726  37.992 -16.308   0.196

  No H/Q in entry =           4
  In of MODEL   30
    1    H    VAL 727           H        VAL 727  40.483 -17.753  -0.742
    2    HA   VAL 727           HA       VAL 727  39.173 -20.146  -1.776
    3    HB   VAL 727           HB       VAL 727  41.407 -21.114  -2.399
    4   HG11  VAL 727          HG11      VAL 727  40.673 -18.604  -3.920
    5   HG13  VAL 727          HG12      VAL 727  39.999 -20.210  -4.182
    6   HG12  VAL 727          HG13      VAL 727  41.686 -19.895  -4.552
    7   HG23  VAL 727          HG21      VAL 727  43.326 -19.607  -2.749
    8   HG22  VAL 727          HG22      VAL 727  42.854 -19.683  -1.050
    9   HG21  VAL 727          HG23      VAL 727  42.406 -18.286  -2.029

  No H/Q in entry =           9
  In of MODEL   30
    1    H    CYS 728           H        CYS 728  39.783 -22.087  -0.589
    2    HA   CYS 728           HA       CYS 728  40.417 -21.404   2.173
    3    HB2  CYS 728           HB2      CYS 728  39.254 -23.961   1.051
    4    HB3  CYS 728           HB3      CYS 728  39.410 -23.525   2.746

  No H/Q in entry =           4
  In of MODEL   30
    1    H    ALA 729           H        ALA 729  42.342 -21.857   2.936
    2    HA   ALA 729           HA       ALA 729  43.929 -23.858   1.519
    3    HB2  ALA 729           HB1      ALA 729  45.886 -22.474   1.965
    4    HB1  ALA 729           HB2      ALA 729  44.852 -21.261   2.721
    5    HB3  ALA 729           HB3      ALA 729  44.694 -21.606   0.996

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLN 730           H        GLN 730  45.662 -24.665   2.892
    2    HA   GLN 730           HA       GLN 730  44.816 -24.728   5.690
    3    HB2  GLN 730           HB2      GLN 730  44.411 -26.903   4.618
    4    HB3  GLN 730           HB3      GLN 730  46.103 -26.982   4.155
    5    HG2  GLN 730           HG2      GLN 730  46.769 -26.961   6.482
    6    HG3  GLN 730           HG3      GLN 730  45.092 -26.865   6.989
    7   HE21  GLN 730          HE21      GLN 730  45.178 -28.774   8.124
    8   HE22  GLN 730          HE22      GLN 730  45.320 -30.308   7.376

  No H/Q in entry =           8
  In of MODEL   30
    1    H    ASP 731           H        ASP 731  46.189 -24.098   7.022
    2    HA   ASP 731           HA       ASP 731  48.778 -23.197   6.245
    3    HB2  ASP 731           HB2      ASP 731  47.612 -21.903   7.880
    4    HB3  ASP 731           HB3      ASP 731  47.323 -23.320   8.867

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLU 732           H        GLU 732  50.772 -24.070   6.846
    2    HA   GLU 732           HA       GLU 732  50.671 -26.891   7.501
    3    HB2  GLU 732           HB2      GLU 732  52.897 -25.165   6.460
    4    HB3  GLU 732           HB3      GLU 732  53.098 -26.851   6.907
    5    HG2  GLU 732           HG2      GLU 732  51.221 -25.826   4.794
    6    HG3  GLU 732           HG3      GLU 732  52.806 -26.537   4.496

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ARG 733           H        ARG 733  51.069 -24.056   9.301
    2    HA   ARG 733           HA       ARG 733  53.034 -25.125  11.099
    3    HB2  ARG 733           HB2      ARG 733  51.311 -22.650  11.140
    4    HB3  ARG 733           HB3      ARG 733  52.519 -23.042  12.346
    5    HG2  ARG 733           HG2      ARG 733  53.133 -22.702   9.432
    6    HG3  ARG 733           HG3      ARG 733  53.230 -21.380  10.602
    7    HD2  ARG 733           HD2      ARG 733  54.959 -22.539  11.809
    8    HD3  ARG 733           HD3      ARG 733  54.765 -23.970  10.799
    9    HE   ARG 733           HE       ARG 733  55.691 -22.776   8.974
   10   HH11  ARG 733          HH11      ARG 733  55.999 -20.979  12.045
   11   HH12  ARG 733          HH12      ARG 733  57.307 -20.072  11.485
   12   HH21  ARG 733          HH21      ARG 733  57.484 -21.516   8.277
   13   HH22  ARG 733          HH22      ARG 733  58.173 -20.368   9.338

  No H/Q in entry =          13
  In of MODEL   30
    1    H    SER 734           H        SER 734  49.668 -24.053  11.321
    2    HA   SER 734           HA       SER 734  49.315 -25.631  13.746
    3    HB2  SER 734           HB2      SER 734  47.435 -23.704  12.379
    4    HB3  SER 734           HB3      SER 734  47.258 -24.363  14.004
    5    HG   SER 734           HG       SER 734  48.512 -22.181  13.280

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LYS 735           H        LYS 735  48.785 -25.909  10.382
    2    HA   LYS 735           HA       LYS 735  47.685 -27.291   9.023
    3    HB2  LYS 735           HB2      LYS 735  47.234 -28.966  11.499
    4    HB3  LYS 735           HB3      LYS 735  46.993 -29.518   9.845
    5    HG2  LYS 735           HG2      LYS 735  49.614 -28.660  11.070
    6    HG3  LYS 735           HG3      LYS 735  49.111 -30.317  10.753
    7    HD2  LYS 735           HD2      LYS 735  49.469 -28.190   8.640
    8    HD3  LYS 735           HD3      LYS 735  50.685 -29.385   9.046
    9    HE2  LYS 735           HE2      LYS 735  49.019 -31.163   8.439
   10    HE3  LYS 735           HE3      LYS 735  47.925 -29.887   7.920
   11    HZ1  LYS 735           HZ1      LYS 735  49.617 -29.220   6.239
   12    HZ3  LYS 735           HZ2      LYS 735  49.109 -30.815   6.061
   13    HZ2  LYS 735           HZ3      LYS 735  50.590 -30.494   6.764

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ARG 736           H        ARG 736  46.306 -25.121  10.148
    2    HA   ARG 736           HA       ARG 736  43.582 -26.092  10.487
    3    HB2  ARG 736           HB2      ARG 736  43.023 -23.783  11.071
    4    HB3  ARG 736           HB3      ARG 736  44.293 -24.438  12.092
    5    HG2  ARG 736           HG2      ARG 736  45.960 -23.211  10.887
    6    HG3  ARG 736           HG3      ARG 736  44.756 -22.660   9.725
    7    HD2  ARG 736           HD2      ARG 736  45.326 -21.000  11.333
    8    HD3  ARG 736           HD3      ARG 736  43.614 -21.418  11.431
    9    HE   ARG 736           HE       ARG 736  44.240 -22.792  13.410
   10   HH11  ARG 736          HH11      ARG 736  46.372 -20.108  12.509
   11   HH12  ARG 736          HH12      ARG 736  46.902 -19.809  14.083
   12   HH21  ARG 736          HH21      ARG 736  44.973 -22.379  15.599
   13   HH22  ARG 736          HH22      ARG 736  46.090 -21.130  15.874

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ILE 737           H        ILE 737  41.936 -25.658   9.003
    2    HA   ILE 737           HA       ILE 737  42.718 -24.747   6.399
    3    HB   ILE 737           HB       ILE 737  39.898 -25.117   7.422
    4   HG12  ILE 737          HG12      ILE 737  41.206 -27.209   7.919
    5   HG13  ILE 737          HG13      ILE 737  39.917 -27.446   6.752
    6   HG23  ILE 737          HG21      ILE 737  39.413 -25.547   5.089
    7   HG22  ILE 737          HG22      ILE 737  41.126 -25.444   4.694
    8   HG21  ILE 737          HG23      ILE 737  40.267 -24.011   5.259
    9   HD11  ILE 737          HD11      ILE 737  41.524 -27.345   4.967
   10   HD13  ILE 737          HD12      ILE 737  41.902 -28.646   6.107
   11   HD12  ILE 737          HD13      ILE 737  42.839 -27.141   6.127

  No H/Q in entry =          11
  In of MODEL   30
    1    H    LEU 738           H        LEU 738  42.751 -22.617   5.989
    2    HA   LEU 738           HA       LEU 738  40.961 -20.943   7.525
    3    HB2  LEU 738           HB2      LEU 738  42.558 -19.237   7.926
    4    HB3  LEU 738           HB3      LEU 738  43.220 -20.731   8.554
    5    HG   LEU 738           HG       LEU 738  44.063 -19.254   6.050
    6   HD12  LEU 738          HD11      LEU 738  45.488 -19.722   8.653
    7   HD11  LEU 738          HD12      LEU 738  44.753 -18.211   8.127
    8   HD13  LEU 738          HD13      LEU 738  46.134 -18.864   7.254
    9   HD21  LEU 738          HD21      LEU 738  45.173 -21.780   7.244
   10   HD23  LEU 738          HD22      LEU 738  45.861 -20.888   5.869
   11   HD22  LEU 738          HD23      LEU 738  44.256 -21.625   5.747

  No H/Q in entry =          11
  In of MODEL   30
    1    HA   PRO 739           HA       PRO 739  39.921 -19.237   3.662
    2    HB2  PRO 739           HB2      PRO 739  38.933 -16.883   4.483
    3    HB3  PRO 739           HB3      PRO 739  38.086 -18.419   4.786
    4    HG2  PRO 739           HG2      PRO 739  39.809 -16.801   6.623
    5    HG3  PRO 739           HG3      PRO 739  38.258 -17.594   6.959
    6    HD2  PRO 739           HD2      PRO 739  40.673 -18.716   7.620
    7    HD3  PRO 739           HD3      PRO 739  39.228 -19.668   7.185

  No H/Q in entry =           7
  In of MODEL   30
    1    H    LEU 740           H        LEU 740  41.443 -18.600   2.317
    2    HA   LEU 740           HA       LEU 740  42.887 -16.138   2.945
    3    HB2  LEU 740           HB2      LEU 740  43.867 -18.535   1.406
    4    HB3  LEU 740           HB3      LEU 740  44.680 -16.991   1.439
    5    HG   LEU 740           HG       LEU 740  44.310 -18.877   3.757
    6   HD12  LEU 740          HD11      LEU 740  46.747 -19.042   3.600
    7   HD11  LEU 740          HD12      LEU 740  46.706 -17.999   2.169
    8   HD13  LEU 740          HD13      LEU 740  45.943 -19.582   2.125
    9   HD21  LEU 740          HD21      LEU 740  45.683 -16.181   3.642
   10   HD23  LEU 740          HD22      LEU 740  45.747 -17.307   4.996
   11   HD22  LEU 740          HD23      LEU 740  44.216 -16.561   4.550

  No H/Q in entry =          11
  In of MODEL   30
    1    H    THR 741           H        THR 741  43.873 -15.517   0.655
    2    HA   THR 741           HA       THR 741  41.743 -15.705  -1.317
    3    HB   THR 741           HB       THR 741  43.240 -13.114  -0.951
    4    HG1  THR 741           HG1      THR 741  40.904 -13.812   0.541
    5   HG21  THR 741          HG21      THR 741  41.550 -13.582  -2.749
    6   HG23  THR 741          HG22      THR 741  41.210 -12.164  -1.749
    7   HG22  THR 741          HG23      THR 741  40.335 -13.669  -1.478

  No H/Q in entry =           7
  In of MODEL   30
    1    H    VAL 742           H        VAL 742  42.657 -15.497  -3.470
    2    HA   VAL 742           HA       VAL 742  45.005 -16.826  -3.958
    3    HB   VAL 742           HB       VAL 742  43.783 -14.706  -5.693
    4   HG11  VAL 742          HG11      VAL 742  45.965 -15.145  -6.446
    5   HG13  VAL 742          HG12      VAL 742  44.718 -15.675  -7.560
    6   HG12  VAL 742          HG13      VAL 742  45.593 -16.878  -6.588
    7   HG23  VAL 742          HG21      VAL 742  42.778 -16.659  -6.849
    8   HG22  VAL 742          HG22      VAL 742  42.140 -16.207  -5.264
    9   HG21  VAL 742          HG23      VAL 742  43.221 -17.600  -5.401

  No H/Q in entry =           9
  In of MODEL   30
    1    H    CYS 743           H        CYS 743  44.663 -13.249  -4.072
    2    HA   CYS 743           HA       CYS 743  47.292 -12.615  -4.450
    3    HB2  CYS 743           HB2      CYS 743  45.394 -10.990  -4.462
    4    HB3  CYS 743           HB3      CYS 743  45.338 -11.080  -2.710

  No H/Q in entry =           4
  In of MODEL   30
    1    H    LYS 744           H        LYS 744  45.654 -13.176  -1.324
    2    HA   LYS 744           HA       LYS 744  47.830 -12.646   0.380
    3    HB2  LYS 744           HB2      LYS 744  45.545 -14.593   0.767
    4    HB3  LYS 744           HB3      LYS 744  46.693 -14.183   2.020
    5    HG2  LYS 744           HG2      LYS 744  45.917 -11.867   1.977
    6    HG3  LYS 744           HG3      LYS 744  44.758 -12.277   0.705
    7    HD2  LYS 744           HD2      LYS 744  43.655 -13.853   2.208
    8    HD3  LYS 744           HD3      LYS 744  44.844 -13.512   3.461
    9    HE2  LYS 744           HE2      LYS 744  42.747 -12.321   3.895
   10    HE3  LYS 744           HE3      LYS 744  44.055 -11.188   3.564
   11    HZ2  LYS 744           HZ1      LYS 744  41.891 -10.709   2.472
   12    HZ1  LYS 744           HZ2      LYS 744  42.090 -12.065   1.513
   13    HZ3  LYS 744           HZ3      LYS 744  43.198 -10.767   1.416

  No H/Q in entry =          13
  In of MODEL   30
    1    H    MET 745           H        MET 745  46.610 -15.765  -0.688
    2    HA   MET 745           HA       MET 745  48.488 -17.483   0.356
    3    HB2  MET 745           HB2      MET 745  46.740 -18.588  -0.434
    4    HB3  MET 745           HB3      MET 745  46.507 -17.550  -1.832
    5    HG2  MET 745           HG2      MET 745  47.070 -19.658  -2.723
    6    HG3  MET 745           HG3      MET 745  48.510 -18.692  -2.826
    7    HE2  MET 745           HE1      MET 745  47.937 -22.094   0.230
    8    HE1  MET 745           HE2      MET 745  46.731 -21.558  -0.951
    9    HE3  MET 745           HE3      MET 745  47.120 -20.544   0.435

  No H/Q in entry =           9
  In of MODEL   30
    1    H    HIS 746           H        HIS 746  48.632 -15.855  -2.823
    2    HA   HIS 746           HA       HIS 746  50.985 -17.218  -3.689
    3    HB2  HIS 746           HB2      HIS 746  49.428 -14.953  -4.573
    4    HB3  HIS 746           HB3      HIS 746  51.114 -14.973  -5.144
    5    HD1  HIS 746           HD1      HIS 746  51.647 -16.790  -6.920
    6    HD2  HIS 746           HD2      HIS 746  47.722 -16.813  -5.573
    7    HE1  HIS 746           HE1      HIS 746  50.357 -18.075  -8.626
    8    HE2  HIS 746           HE2      HIS 746  47.946 -17.849  -7.897

  No H/Q in entry =           8
  In of MODEL   30
    1    H    VAL 747           H        VAL 747  50.464 -14.010  -2.305
    2    HA   VAL 747           HA       VAL 747  53.153 -13.238  -2.312
    3    HB   VAL 747           HB       VAL 747  50.797 -12.356  -0.626
    4   HG12  VAL 747          HG11      VAL 747  53.529 -11.084  -0.872
    5   HG11  VAL 747          HG12      VAL 747  52.896 -11.886   0.564
    6   HG13  VAL 747          HG13      VAL 747  52.150 -10.406  -0.011
    7   HG22  VAL 747          HG21      VAL 747  50.833 -10.427  -2.117
    8   HG21  VAL 747          HG22      VAL 747  50.627 -11.943  -3.003
    9   HG23  VAL 747          HG23      VAL 747  52.200 -11.143  -2.981

  No H/Q in entry =           9
  In of MODEL   30
    1    H    LEU 748           H        LEU 748  51.106 -14.664   0.074
    2    HA   LEU 748           HA       LEU 748  52.821 -15.000   2.183
    3    HB2  LEU 748           HB2      LEU 748  50.517 -15.293   2.392
    4    HB3  LEU 748           HB3      LEU 748  50.444 -16.410   1.067
    5    HG   LEU 748           HG       LEU 748  51.700 -17.196   3.682
    6   HD11  LEU 748          HD11      LEU 748  49.440 -16.242   4.055
    7   HD13  LEU 748          HD12      LEU 748  49.465 -17.993   4.283
    8   HD12  LEU 748          HD13      LEU 748  48.808 -17.308   2.796
    9   HD22  LEU 748          HD21      LEU 748  51.009 -19.394   2.909
   10   HD21  LEU 748          HD22      LEU 748  52.000 -18.617   1.673
   11   HD23  LEU 748          HD23      LEU 748  50.245 -18.681   1.488

  No H/Q in entry =          11
  In of MODEL   30
    1    H    HIS 749           H        HIS 749  52.316 -17.125  -0.633
    2    HA   HIS 749           HA       HIS 749  54.217 -19.051   0.160
    3    HB2  HIS 749           HB2      HIS 749  52.550 -18.594  -2.191
    4    HB3  HIS 749           HB3      HIS 749  54.128 -19.267  -2.597
    5    HD1  HIS 749           HD1      HIS 749  53.790 -21.703  -2.965
    6    HD2  HIS 749           HD2      HIS 749  51.562 -20.324   0.267
    7    HE1  HIS 749           HE1      HIS 749  52.649 -23.702  -2.051
    8    HE2  HIS 749           HE2      HIS 749  51.174 -22.868  -0.246

  No H/Q in entry =           8
  In of MODEL   30
    1    H    CYS 750           H        CYS 750  54.540 -16.060  -1.763
    2    HA   CYS 750           HA       CYS 750  57.259 -16.781  -2.394
    3    HB2  CYS 750           HB2      CYS 750  57.435 -14.573  -3.524
    4    HB3  CYS 750           HB3      CYS 750  56.056 -15.497  -4.096

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLN 751           H        GLN 751  55.655 -15.263   0.168
    2    HA   GLN 751           HA       GLN 751  57.895 -13.932   1.253
    3    HB2  GLN 751           HB2      GLN 751  55.342 -14.969   2.481
    4    HB3  GLN 751           HB3      GLN 751  56.561 -14.122   3.414
    5    HG2  GLN 751           HG2      GLN 751  55.152 -13.016   1.017
    6    HG3  GLN 751           HG3      GLN 751  54.659 -12.699   2.669
    7   HE21  GLN 751          HE21      GLN 751  55.463 -10.751   0.716
    8   HE22  GLN 751          HE22      GLN 751  56.894 -10.011   1.284

  No H/Q in entry =           8
  In of MODEL   30
    1    H    GLY 752           H        GLY 752  56.984 -17.191   0.942
    2    HA3  GLY 752           HA2      GLY 752  58.610 -18.903   1.350
    3    HA2  GLY 752           HA3      GLY 752  59.175 -17.977   2.731

  No H/Q in entry =           3
  In of MODEL   30
    1    H    ARG 753           H        ARG 753  55.804 -18.028   2.598
    2    HA   ARG 753           HA       ARG 753  55.743 -19.808   4.878
    3    HB2  ARG 753           HB2      ARG 753  53.565 -18.249   3.505
    4    HB3  ARG 753           HB3      ARG 753  53.336 -19.203   4.960
    5    HG2  ARG 753           HG2      ARG 753  55.099 -16.778   4.682
    6    HG3  ARG 753           HG3      ARG 753  53.515 -16.816   5.448
    7    HD2  ARG 753           HD2      ARG 753  54.444 -18.559   7.029
    8    HD3  ARG 753           HD3      ARG 753  56.033 -18.197   6.358
    9    HE   ARG 753           HE       ARG 753  54.841 -15.811   7.146
   10   HH11  ARG 753          HH11      ARG 753  56.342 -18.666   8.594
   11   HH12  ARG 753          HH12      ARG 753  56.566 -17.983  10.131
   12   HH21  ARG 753          HH21      ARG 753  55.203 -14.817   9.270
   13   HH22  ARG 753          HH22      ARG 753  55.911 -15.733  10.509

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ASN 754           H        ASN 754  54.942 -21.860   4.896
    2    HA   ASN 754           HA       ASN 754  54.332 -23.019   2.287
    3    HB2  ASN 754           HB2      ASN 754  54.718 -24.476   4.930
    4    HB3  ASN 754           HB3      ASN 754  54.603 -25.199   3.347
    5   HD21  ASN 754          HD21      ASN 754  56.650 -23.566   5.594
    6   HD22  ASN 754          HD22      ASN 754  58.119 -23.790   4.733

  No H/Q in entry =           6
  In of MODEL   30
    1    H    TYR 755           H        TYR 755  52.269 -23.153   1.734
    2    HA   TYR 755           HA       TYR 755  50.295 -23.923   3.760
    3    HB2  TYR 755           HB2      TYR 755  49.996 -21.586   1.880
    4    HB3  TYR 755           HB3      TYR 755  48.625 -22.481   2.501
    5    HD1  TYR 755           HD1      TYR 755  51.727 -21.207   4.210
    6    HD2  TYR 755           HD2      TYR 755  47.502 -21.109   3.949
    7    HE1  TYR 755           HE1      TYR 755  51.654 -19.645   6.101
    8    HE2  TYR 755           HE2      TYR 755  47.414 -19.550   5.822
    9    HH   TYR 755           HH       TYR 755  50.096 -17.888   6.900

  No H/Q in entry =           9
  In of MODEL   30
    1    H    THR 756           H        THR 756  48.692 -25.190   3.026
    2    HA   THR 756           HA       THR 756  49.079 -26.396   0.399
    3    HB   THR 756           HB       THR 756  47.619 -27.280   2.909
    4    HG1  THR 756           HG1      THR 756  49.560 -27.752   3.552
    5   HG23  THR 756          HG21      THR 756  46.690 -28.316   0.911
    6   HG22  THR 756          HG22      THR 756  47.559 -29.511   1.880
    7   HG21  THR 756          HG23      THR 756  48.297 -28.848   0.410

  No H/Q in entry =           7
  In of MODEL   30
    1    H    LEU 757           H        LEU 757  47.019 -26.761  -0.846
    2    HA   LEU 757           HA       LEU 757  44.956 -24.954   0.081
    3    HB2  LEU 757           HB2      LEU 757  45.476 -25.924  -2.714
    4    HB3  LEU 757           HB3      LEU 757  44.008 -25.091  -2.244
    5    HG   LEU 757           HG       LEU 757  45.740 -23.330  -1.345
    6   HD13  LEU 757          HD11      LEU 757  47.625 -23.032  -2.844
    7   HD12  LEU 757          HD12      LEU 757  47.236 -24.561  -3.629
    8   HD11  LEU 757          HD13      LEU 757  47.729 -24.539  -1.932
    9   HD21  LEU 757          HD21      LEU 757  43.946 -22.924  -2.852
   10   HD23  LEU 757          HD22      LEU 757  44.889 -23.548  -4.216
   11   HD22  LEU 757          HD23      LEU 757  45.397 -22.073  -3.365

  No H/Q in entry =          11
  In of MODEL   30
    1    H    THR 758           H        THR 758  42.776 -25.545  -0.151
    2    HA   THR 758           HA       THR 758  42.384 -28.418  -0.002
    3    HB   THR 758           HB       THR 758  40.915 -28.002   2.048
    4    HG1  THR 758           HG1      THR 758  41.716 -25.457   1.531
    5   HG22  THR 758          HG21      THR 758  43.882 -27.440   2.335
    6   HG21  THR 758          HG22      THR 758  43.148 -29.034   2.220
    7   HG23  THR 758          HG23      THR 758  42.820 -28.019   3.617

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLY 759           H        GLY 759  39.683 -28.416   0.643
    2    HA3  GLY 759           HA2      GLY 759  38.583 -27.634  -1.877
    3    HA2  GLY 759           HA3      GLY 759  37.716 -28.374  -0.533

  No H/Q in entry =           3
  In of MODEL   30
    1    H    ARG 760           H        ARG 760  36.782 -26.233  -2.127
    2    HA   ARG 760           HA       ARG 760  37.210 -23.727  -0.850
    3    HB2  ARG 760           HB2      ARG 760  35.430 -22.861  -2.292
    4    HB3  ARG 760           HB3      ARG 760  36.492 -23.908  -3.213
    5    HG2  ARG 760           HG2      ARG 760  34.377 -24.511  -3.983
    6    HG3  ARG 760           HG3      ARG 760  34.727 -25.730  -2.754
    7    HD2  ARG 760           HD2      ARG 760  33.459 -24.293  -1.122
    8    HD3  ARG 760           HD3      ARG 760  32.944 -23.313  -2.487
    9    HE   ARG 760           HE       ARG 760  32.414 -26.159  -2.609
   10   HH11  ARG 760          HH11      ARG 760  31.131 -22.887  -2.118
   11   HH12  ARG 760          HH12      ARG 760  29.511 -23.384  -2.022
   12   HH21  ARG 760          HH21      ARG 760  30.134 -26.826  -2.513
   13   HH22  ARG 760          HH22      ARG 760  28.936 -25.639  -2.284

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ASP 761           H        ASP 761  35.435 -26.397   0.052
    2    HA   ASP 761           HA       ASP 761  33.686 -24.769   1.756
    3    HB2  ASP 761           HB2      ASP 761  32.589 -26.334   0.126
    4    HB3  ASP 761           HB3      ASP 761  33.315 -27.677   0.997

  No H/Q in entry =           4
  In of MODEL   30
    1    H    SER 762           H        SER 762  36.593 -26.028   2.029
    2    HA   SER 762           HA       SER 762  36.342 -27.719   4.316
    3    HB2  SER 762           HB2      SER 762  38.786 -26.303   3.233
    4    HB3  SER 762           HB3      SER 762  38.827 -27.490   4.523
    5    HG   SER 762           HG       SER 762  37.438 -28.507   2.467

  No H/Q in entry =           5
  In of MODEL   30
    1    H    CYS 763           H        CYS 763  36.448 -24.274   3.985
    2    HA   CYS 763           HA       CYS 763  36.134 -24.113   6.862
    3    HB2  CYS 763           HB2      CYS 763  37.722 -22.248   7.081
    4    HB3  CYS 763           HB3      CYS 763  38.519 -23.705   6.509

  No H/Q in entry =           4
  In of MODEL   30
    1    H    THR 764           H        THR 764  35.655 -21.661   7.428
    2    HA   THR 764           HA       THR 764  33.416 -20.908   5.777
    3    HB   THR 764           HB       THR 764  34.489 -19.606   8.303
    4    HG1  THR 764           HG1      THR 764  33.750 -21.954   8.205
    5   HG23  THR 764          HG21      THR 764  32.188 -18.752   8.521
    6   HG22  THR 764          HG22      THR 764  31.747 -19.548   7.010
    7   HG21  THR 764          HG23      THR 764  32.911 -18.221   7.001

  No H/Q in entry =           7
  In of MODEL   30
    1    H    LEU 765           H        LEU 765  33.704 -19.648   4.128
    2    HA   LEU 765           HA       LEU 765  36.146 -18.129   3.835
    3    HB2  LEU 765           HB2      LEU 765  34.938 -19.759   2.171
    4    HB3  LEU 765           HB3      LEU 765  33.924 -18.371   1.852
    5    HG   LEU 765           HG       LEU 765  35.912 -17.111   1.129
    6   HD12  LEU 765          HD11      LEU 765  38.009 -18.408   0.741
    7   HD11  LEU 765          HD12      LEU 765  37.260 -19.761   1.615
    8   HD13  LEU 765          HD13      LEU 765  37.588 -18.257   2.449
    9   HD23  LEU 765          HD21      LEU 765  36.251 -18.350  -0.966
   10   HD22  LEU 765          HD22      LEU 765  34.550 -18.285  -0.517
   11   HD21  LEU 765          HD23      LEU 765  35.476 -19.763  -0.249

  No H/Q in entry =          11
  In of MODEL   30
    1    HA   PRO 766           HA       PRO 766  33.882 -14.383   4.769
    2    HB2  PRO 766           HB2      PRO 766  35.492 -12.511   3.645
    3    HB3  PRO 766           HB3      PRO 766  35.886 -13.345   5.147
    4    HG2  PRO 766           HG2      PRO 766  36.900 -13.836   2.386
    5    HG3  PRO 766           HG3      PRO 766  37.766 -13.912   3.929
    6    HD2  PRO 766           HD2      PRO 766  36.863 -16.122   2.583
    7    HD3  PRO 766           HD3      PRO 766  37.096 -16.060   4.337

  No H/Q in entry =           7
  In of MODEL   30
    1    H    ALA 767           H        ALA 767  34.996 -14.617   1.357
    2    HA   ALA 767           HA       ALA 767  32.662 -12.970   0.615
    3    HB1  ALA 767           HB1      ALA 767  34.907 -12.090  -0.011
    4    HB3  ALA 767           HB2      ALA 767  33.812 -12.345  -1.380
    5    HB2  ALA 767           HB3      ALA 767  35.087 -13.519  -1.032

  No H/Q in entry =           5
  In of MODEL   30
    1    H    SER 768           H        SER 768  32.723 -15.778   1.097
    2    HA   SER 768           HA       SER 768  31.933 -16.946  -1.349
    3    HB2  SER 768           HB2      SER 768  30.776 -18.336   0.470
    4    HB3  SER 768           HB3      SER 768  32.550 -18.490   0.221
    5    HG   SER 768           HG       SER 768  31.263 -17.853   2.434

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA 769           H        ALA 769  30.378 -15.459   1.435
    2    HA   ALA 769           HA       ALA 769  27.720 -15.891   0.532
    3    HB3  ALA 769           HB1      ALA 769  28.262 -15.775   2.914
    4    HB2  ALA 769           HB2      ALA 769  27.044 -14.590   2.430
    5    HB1  ALA 769           HB3      ALA 769  28.707 -14.071   2.723

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLU 770           H        GLU 770  26.256 -13.831   0.678
    2    HA   GLU 770           HA       GLU 770  27.383 -11.720  -0.936
    3    HB2  GLU 770           HB2      GLU 770  25.557 -12.041  -2.582
    4    HB3  GLU 770           HB3      GLU 770  26.787 -13.290  -2.561
    5    HG2  GLU 770           HG2      GLU 770  25.388 -14.757  -1.337
    6    HG3  GLU 770           HG3      GLU 770  24.149 -13.526  -1.195

  No H/Q in entry =           6
  In of MODEL   30
    1    H    LYS 771           H        LYS 771  26.319  -9.807  -0.741
    2    HA   LYS 771           HA       LYS 771  23.807  -9.713   0.790
    3    HB2  LYS 771           HB2      LYS 771  26.124  -7.768   1.068
    4    HB3  LYS 771           HB3      LYS 771  24.609  -7.711   1.960
    5    HG2  LYS 771           HG2      LYS 771  26.654  -9.913   2.130
    6    HG3  LYS 771           HG3      LYS 771  26.466  -8.605   3.296
    7    HD2  LYS 771           HD2      LYS 771  24.362  -9.402   4.000
    8    HD3  LYS 771           HD3      LYS 771  24.213 -10.479   2.606
    9    HE2  LYS 771           HE2      LYS 771  25.985 -11.807   3.352
   10    HE3  LYS 771           HE3      LYS 771  26.320 -10.737   4.732
   11    HZ2  LYS 771           HZ1      LYS 771  23.901 -12.437   4.293
   12    HZ1  LYS 771           HZ2      LYS 771  24.062 -11.344   5.555
   13    HZ3  LYS 771           HZ3      LYS 771  25.080 -12.663   5.468

  No H/Q in entry =          13
  In of MODEL   30
    1    H    ALA 772           H        ALA 772  22.266  -8.487  -0.291
    2    HA   ALA 772           HA       ALA 772  22.861  -7.470  -2.864
    3    HB2  ALA 772           HB1      ALA 772  20.534  -6.799  -2.975
    4    HB1  ALA 772           HB2      ALA 772  20.339  -7.086  -1.241
    5    HB3  ALA 772           HB3      ALA 772  20.693  -8.425  -2.342

  No H/Q in entry =           5
  In of MODEL   30
    1    H    CYS 773           H        CYS 773  23.751  -5.694  -3.390
    2    HA   CYS 773           HA       CYS 773  23.069  -3.191  -2.307
    3    HB2  CYS 773           HB2      CYS 773  25.371  -2.644  -1.547
    4    HB3  CYS 773           HB3      CYS 773  24.565  -3.805  -0.495

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLY 774           H        GLY 774  25.765  -4.858  -3.876
    2    HA3  GLY 774           HA2      GLY 774  25.560  -4.757  -6.414
    3    HA2  GLY 774           HA3      GLY 774  25.524  -3.020  -6.152

  No H/Q in entry =           3
  In of MODEL   30
    1    H    ALA 775           H        ALA 775  27.549  -3.288  -3.913
    2    HA   ALA 775           HA       ALA 775  29.824  -3.688  -5.667
    3    HB3  ALA 775           HB1      ALA 775  29.449  -1.400  -4.761
    4    HB2  ALA 775           HB2      ALA 775  30.992  -2.080  -4.294
    5    HB1  ALA 775           HB3      ALA 775  29.663  -2.042  -3.130

  No H/Q in entry =           5
  In of MODEL   30
    1    H    CYS 776           H        CYS 776  31.617  -3.629  -3.571
    2    HA   CYS 776           HA       CYS 776  32.727  -4.702  -2.102
    3    HB2  CYS 776           HB2      CYS 776  30.390  -6.599  -1.724
    4    HB3  CYS 776           HB3      CYS 776  31.911  -6.781  -0.836

  No H/Q in entry =           4
  In of MODEL   30
    1    HA   PRO 777           HA       PRO 777  34.385  -8.256  -4.472
    2    HB2  PRO 777           HB2      PRO 777  32.448  -9.707  -6.069
    3    HB3  PRO 777           HB3      PRO 777  33.416 -10.312  -4.719
    4    HG2  PRO 777           HG2      PRO 777  30.696 -10.002  -4.608
    5    HG3  PRO 777           HG3      PRO 777  31.752  -9.918  -3.185
    6    HD2  PRO 777           HD2      PRO 777  30.577  -7.700  -4.820
    7    HD3  PRO 777           HD3      PRO 777  30.701  -7.872  -3.053

  No H/Q in entry =           7
  In of MODEL   30
    1    H    LEU 778           H        LEU 778  35.463  -7.674  -6.227
    2    HA   LEU 778           HA       LEU 778  34.480  -5.591  -7.772
    3    HB2  LEU 778           HB2      LEU 778  36.668  -5.590  -8.988
    4    HB3  LEU 778           HB3      LEU 778  36.732  -5.438  -7.254
    5    HG   LEU 778           HG       LEU 778  38.609  -6.707  -8.052
    6   HD12  LEU 778          HD11      LEU 778  36.792  -8.635  -6.670
    7   HD11  LEU 778          HD12      LEU 778  37.782  -7.398  -5.902
    8   HD13  LEU 778          HD13      LEU 778  38.548  -8.720  -6.780
    9   HD21  LEU 778          HD21      LEU 778  36.627  -8.532  -9.324
   10   HD23  LEU 778          HD22      LEU 778  38.331  -8.927  -9.115
   11   HD22  LEU 778          HD23      LEU 778  37.856  -7.556 -10.137

  No H/Q in entry =          11
  In of MODEL   30
    1    H    TRP 779           H        TRP 779  34.147  -8.868  -8.503
    2    HA   TRP 779           HA       TRP 779  33.545  -8.206 -11.291
    3    HB2  TRP 779           HB2      TRP 779  33.314 -10.718 -11.560
    4    HB3  TRP 779           HB3      TRP 779  34.928 -10.175 -11.110
    5    HD1  TRP 779           HD1      TRP 779  31.844 -11.910  -9.589
    6    HE1  TRP 779           HE1      TRP 779  32.599 -13.217  -7.495
    7    HE3  TRP 779           HE3      TRP 779  36.687 -10.444  -9.463
    8    HZ2  TRP 779           HZ2      TRP 779  34.994 -13.561  -5.996
    9    HZ3  TRP 779           HZ3      TRP 779  38.159 -11.277  -7.687
   10    HH2  TRP 779           HH2      TRP 779  37.325 -12.823  -5.996

  No H/Q in entry =          10
  In of MODEL   30
    1    H    GLY 780           H        GLY 780  32.096  -8.241  -8.388
    2    HA3  GLY 780           HA2      GLY 780  29.825  -7.892  -8.000
    3    HA2  GLY 780           HA3      GLY 780  29.432  -8.772  -9.486

  No H/Q in entry =           3
  In of MODEL   30
    1    H    LYS 781           H        LYS 781  27.913 -10.141  -8.130
    2    HA   LYS 781           HA       LYS 781  29.267 -12.454  -7.332
    3    HB2  LYS 781           HB2      LYS 781  29.703 -11.561  -5.279
    4    HB3  LYS 781           HB3      LYS 781  28.238 -10.598  -5.212
    5    HG2  LYS 781           HG2      LYS 781  28.073 -12.256  -3.582
    6    HG3  LYS 781           HG3      LYS 781  27.000 -12.765  -4.881
    7    HD2  LYS 781           HD2      LYS 781  28.144 -14.700  -4.073
    8    HD3  LYS 781           HD3      LYS 781  28.847 -14.302  -5.638
    9    HE2  LYS 781           HE2      LYS 781  30.787 -13.366  -4.613
   10    HE3  LYS 781           HE3      LYS 781  30.037 -13.410  -3.016
   11    HZ2  LYS 781           HZ1      LYS 781  31.655 -15.221  -3.396
   12    HZ1  LYS 781           HZ2      LYS 781  30.631 -15.842  -4.615
   13    HZ3  LYS 781           HZ3      LYS 781  30.103 -15.762  -3.035

  No H/Q in entry =          13
  In of MODEL   30
    1    H    CYS 782           H        CYS 782  28.084 -13.837  -8.240
    2    HA   CYS 782           HA       CYS 782  25.326 -14.073  -7.533
    3    HB2  CYS 782           HB2      CYS 782  26.360 -14.181 -10.375
    4    HB3  CYS 782           HB3      CYS 782  24.772 -14.698  -9.846

  No H/Q in entry =           4
  In of MODEL   30
    1    H    ASP 783           H        ASP 783  26.282 -15.777  -6.178
    2    HA   ASP 783           HA       ASP 783  26.393 -18.151  -7.766
    3    HB2  ASP 783           HB2      ASP 783  28.366 -19.237  -6.715
    4    HB3  ASP 783           HB3      ASP 783  28.788 -17.821  -7.651

  No H/Q in entry =           4
  In of MODEL   30
    1    H    ALA 784           H        ALA 784  25.863 -16.769  -4.625
    2    HA   ALA 784           HA       ALA 784  24.620 -19.284  -3.902
    3    HB1  ALA 784           HB1      ALA 784  24.674 -16.618  -2.446
    4    HB3  ALA 784           HB2      ALA 784  25.713 -18.000  -2.091
    5    HB2  ALA 784           HB3      ALA 784  23.975 -18.108  -1.808

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLU 785           H        GLU 785  23.970 -16.036  -4.941
    2    HA   GLU 785           HA       GLU 785  22.401 -15.129  -6.269
    3    HB2  GLU 785           HB2      GLU 785  21.607 -17.978  -6.809
    4    HB3  GLU 785           HB3      GLU 785  21.120 -16.587  -7.765
    5    HG2  GLU 785           HG2      GLU 785  23.462 -16.203  -8.386
    6    HG3  GLU 785           HG3      GLU 785  23.940 -17.595  -7.419

  No H/Q in entry =           6
  In of MODEL   30
    1    H    SER 786           H        SER 786  21.774 -15.734  -3.488
    2    HA   SER 786           HA       SER 786  18.864 -15.842  -3.734
    3    HB2  SER 786           HB2      SER 786  18.997 -17.046  -1.432
    4    HB3  SER 786           HB3      SER 786  19.240 -17.957  -2.925
    5    HG   SER 786           HG       SER 786  21.380 -17.932  -2.617

  No H/Q in entry =           5
  In of MODEL   30
    1    H    SER 787           H        SER 787  21.470 -14.064  -2.654
    2    HA   SER 787           HA       SER 787  19.613 -12.487  -1.069
    3    HB2  SER 787           HB2      SER 787  20.930 -13.797   0.504
    4    HB3  SER 787           HB3      SER 787  22.422 -13.213  -0.229
    5    HG   SER 787           HG       SER 787  21.119 -11.060   0.341

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LYS 788           H        LYS 788  22.135 -12.641  -3.422
    2    HA   LYS 788           HA       LYS 788  22.036  -9.710  -3.653
    3    HB2  LYS 788           HB2      LYS 788  24.104 -10.565  -2.411
    4    HB3  LYS 788           HB3      LYS 788  24.485 -11.365  -3.940
    5    HG2  LYS 788           HG2      LYS 788  24.277  -8.976  -4.934
    6    HG3  LYS 788           HG3      LYS 788  24.560  -8.472  -3.262
    7    HD2  LYS 788           HD2      LYS 788  26.562  -9.959  -3.266
    8    HD3  LYS 788           HD3      LYS 788  26.292 -10.180  -4.996
    9    HE2  LYS 788           HE2      LYS 788  27.854  -8.457  -4.935
   10    HE3  LYS 788           HE3      LYS 788  26.315  -7.644  -5.137
   11    HZ1  LYS 788           HZ1      LYS 788  26.280  -7.177  -2.712
   12    HZ3  LYS 788           HZ2      LYS 788  27.740  -6.584  -3.385
   13    HZ2  LYS 788           HZ3      LYS 788  27.715  -8.020  -2.559

  No H/Q in entry =          13
  In of MODEL   30
    1    H    CYS 789           H        CYS 789  22.667  -9.061  -5.808
    2    HA   CYS 789           HA       CYS 789  23.776 -10.956  -7.542
    3    HB2  CYS 789           HB2      CYS 789  22.253 -10.660  -9.310
    4    HB3  CYS 789           HB3      CYS 789  21.598 -11.587  -7.938

  No H/Q in entry =           4
  In of MODEL   30
    1    H    VAL 790           H        VAL 790  25.271  -9.979  -8.508
    2    HA   VAL 790           HA       VAL 790  24.671  -7.812 -10.128
    3    HB   VAL 790           HB       VAL 790  25.110  -6.548  -8.080
    4   HG11  VAL 790          HG11      VAL 790  26.675  -8.074  -7.016
    5   HG13  VAL 790          HG12      VAL 790  27.341  -6.437  -7.091
    6   HG12  VAL 790          HG13      VAL 790  27.884  -7.674  -8.230
    7   HG22  VAL 790          HG21      VAL 790  25.589  -5.474 -10.168
    8   HG21  VAL 790          HG22      VAL 790  27.206  -6.180 -10.201
    9   HG23  VAL 790          HG23      VAL 790  26.794  -4.974  -8.976

  No H/Q in entry =           9
  In of MODEL   30
    1    H    CYS 791           H        CYS 791  26.134  -7.839 -11.816
    2    HA   CYS 791           HA       CYS 791  28.626  -9.149 -11.408
    3    HB2  CYS 791           HB2      CYS 791  28.324 -10.742 -13.301
    4    HB3  CYS 791           HB3      CYS 791  27.391 -11.110 -11.865

  No H/Q in entry =           4
  In of MODEL   30
    1    H    ARG 792           H        ARG 792  30.115  -8.266 -12.439
    2    HA   ARG 792           HA       ARG 792  29.436  -6.377 -14.558
    3    HB2  ARG 792           HB2      ARG 792  31.891  -6.627 -12.791
    4    HB3  ARG 792           HB3      ARG 792  31.642  -5.390 -14.016
    5    HG2  ARG 792           HG2      ARG 792  29.804  -4.453 -12.773
    6    HG3  ARG 792           HG3      ARG 792  29.879  -5.767 -11.601
    7    HD2  ARG 792           HD2      ARG 792  30.915  -3.733 -10.725
    8    HD3  ARG 792           HD3      ARG 792  32.093  -5.029 -10.900
    9    HE   ARG 792           HE       ARG 792  32.295  -3.623 -13.226
   10   HH11  ARG 792          HH11      ARG 792  32.503  -2.705  -9.833
   11   HH12  ARG 792          HH12      ARG 792  33.638  -1.472 -10.080
   12   HH21  ARG 792          HH21      ARG 792  33.850  -1.975 -13.605
   13   HH22  ARG 792          HH22      ARG 792  34.477  -1.055 -12.320

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLU 793           H        GLU 793  29.996  -7.019 -16.546
    2    HA   GLU 793           HA       GLU 793  30.946  -9.544 -17.142
    3    HB2  GLU 793           HB2      GLU 793  31.018  -7.046 -18.827
    4    HB3  GLU 793           HB3      GLU 793  31.309  -8.661 -19.452
    5    HG2  GLU 793           HG2      GLU 793  28.758  -7.689 -18.175
    6    HG3  GLU 793           HG3      GLU 793  29.027  -7.931 -19.898

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ALA 794           H        ALA 794  32.975  -9.971 -18.568
    2    HA   ALA 794           HA       ALA 794  35.103  -9.848 -16.764
    3    HB3  ALA 794           HB1      ALA 794  36.358 -11.024 -18.450
    4    HB1  ALA 794           HB2      ALA 794  35.111 -10.678 -19.647
    5    HB2  ALA 794           HB3      ALA 794  34.746 -11.718 -18.266

  No H/Q in entry =           5
  In of MODEL   30
    1    H    SER 795           H        SER 795  34.234  -7.715 -19.314
    2    HA   SER 795           HA       SER 795  36.880  -6.592 -19.126
    3    HB2  SER 795           HB2      SER 795  34.685  -5.899 -21.072
    4    HB3  SER 795           HB3      SER 795  36.361  -5.344 -21.156
    5    HG   SER 795           HG       SER 795  36.215  -8.001 -20.844

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLU 796           H        GLU 796  34.005  -6.278 -17.627
    2    HA   GLU 796           HA       GLU 796  34.016  -3.349 -17.388
    3    HB2  GLU 796           HB2      GLU 796  31.796  -5.347 -17.096
    4    HB3  GLU 796           HB3      GLU 796  31.656  -3.646 -16.680
    5    HG2  GLU 796           HG2      GLU 796  32.299  -4.728 -19.410
    6    HG3  GLU 796           HG3      GLU 796  30.717  -4.157 -18.879

  No H/Q in entry =           6
  In of MODEL   30
    1    H    CYS 797           H        CYS 797  34.744  -6.174 -15.704
    2    HA   CYS 797           HA       CYS 797  33.875  -5.308 -13.143
    3    HB2  CYS 797           HB2      CYS 797  35.543  -7.222 -12.454
    4    HB3  CYS 797           HB3      CYS 797  34.020  -7.604 -13.257

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLU 798           H        GLU 798  36.879  -5.104 -14.931
    2    HA   GLU 798           HA       GLU 798  38.588  -3.668 -14.843
    3    HB2  GLU 798           HB2      GLU 798  36.565  -1.946 -13.448
    4    HB3  GLU 798           HB3      GLU 798  38.055  -1.386 -14.195
    5    HG2  GLU 798           HG2      GLU 798  37.269  -2.013 -16.370
    6    HG3  GLU 798           HG3      GLU 798  35.857  -2.805 -15.674

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU 799           H        GLU 799  39.815  -5.044 -13.352
    2    HA   GLU 799           HA       GLU 799  40.953  -3.498 -11.290
    3    HB2  GLU 799           HB2      GLU 799  38.975  -4.186  -9.979
    4    HB3  GLU 799           HB3      GLU 799  39.313  -5.873 -10.319
    5    HG2  GLU 799           HG2      GLU 799  39.952  -5.217  -8.023
    6    HG3  GLU 799           HG3      GLU 799  41.332  -5.773  -8.966

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLU 800           H        GLU 800  42.811  -4.409 -10.427
    2    HA   GLU 800           HA       GLU 800  43.981  -6.427 -12.145
    3    HB2  GLU 800           HB2      GLU 800  45.240  -4.386 -10.324
    4    HB3  GLU 800           HB3      GLU 800  46.131  -5.665 -11.119
    5    HG2  GLU 800           HG2      GLU 800  45.503  -4.719 -13.288
    6    HG3  GLU 800           HG3      GLU 800  44.659  -3.412 -12.446

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLY 801           H        GLY 801  42.707  -7.934 -10.888
    2    HA3  GLY 801           HA2      GLY 801  43.757  -8.589  -8.290
    3    HA2  GLY 801           HA3      GLY 801  42.631  -9.565  -9.249

  No H/Q in entry =           3
  In of MODEL   30
    1    H    PHE 802           H        PHE 802  43.704 -11.414  -9.158
    2    HA   PHE 802           HA       PHE 802  46.408 -11.472 -10.198
    3    HB2  PHE 802           HB2      PHE 802  44.774 -13.319  -8.574
    4    HB3  PHE 802           HB3      PHE 802  46.052 -13.997  -9.578
    5    HD1  PHE 802           HD1      PHE 802  47.560 -14.669  -7.989
    6    HD2  PHE 802           HD2      PHE 802  46.066 -10.714  -7.898
    7    HE1  PHE 802           HE1      PHE 802  49.236 -14.098  -6.372
    8    HE2  PHE 802           HE2      PHE 802  47.747 -10.088  -6.279
    9    HZ   PHE 802           HZ       PHE 802  49.377 -11.784  -5.474

  No H/Q in entry =           9
  In of MODEL   30
    1    H    SER 803           H        SER 803  46.815 -13.622 -11.343
    2    HA   SER 803           HA       SER 803  44.885 -14.000 -13.488
    3    HB2  SER 803           HB2      SER 803  47.896 -14.439 -13.529
    4    HB3  SER 803           HB3      SER 803  46.775 -14.498 -14.897
    5    HG   SER 803           HG       SER 803  47.084 -12.515 -15.139

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ILE 804           H        ILE 804  44.017 -16.010 -13.295
    2    HA   ILE 804           HA       ILE 804  45.555 -18.008 -11.798
    3    HB   ILE 804           HB       ILE 804  43.609 -18.877 -10.671
    4   HG12  ILE 804          HG12      ILE 804  41.914 -18.385 -12.484
    5   HG13  ILE 804          HG13      ILE 804  41.352 -18.054 -10.855
    6   HG23  ILE 804          HG21      ILE 804  42.970 -17.001  -9.218
    7   HG22  ILE 804          HG22      ILE 804  43.697 -15.891 -10.382
    8   HG21  ILE 804          HG23      ILE 804  44.707 -17.065  -9.536
    9   HD11  ILE 804          HD11      ILE 804  41.752 -15.665 -11.238
   10   HD13  ILE 804          HD12      ILE 804  40.602 -16.363 -12.377
   11   HD12  ILE 804          HD13      ILE 804  42.251 -16.024 -12.896

  No H/Q in entry =          11
  In of MODEL   30
    1    H    CYS 805           H        CYS 805  44.707 -20.264 -12.187
    2    HA   CYS 805           HA       CYS 805  44.285 -20.534 -15.069
    3    HB2  CYS 805           HB2      CYS 805  46.329 -21.551 -14.058
    4    HB3  CYS 805           HB3      CYS 805  45.288 -22.538 -13.040

  No H/Q in entry =           4
  In of MODEL   30
    1    H    VAL 806           H        VAL 806  42.357 -21.118 -15.719
    2    HA   VAL 806           HA       VAL 806  40.630 -22.577 -13.827
    3    HB   VAL 806           HB       VAL 806  39.651 -20.610 -15.850
    4   HG12  VAL 806          HG11      VAL 806  37.607 -20.597 -14.468
    5   HG11  VAL 806          HG12      VAL 806  38.301 -21.929 -13.513
    6   HG13  VAL 806          HG13      VAL 806  37.971 -22.152 -15.217
    7   HG23  VAL 806          HG21      VAL 806  39.258 -18.995 -14.010
    8   HG22  VAL 806          HG22      VAL 806  40.952 -19.285 -14.366
    9   HG21  VAL 806          HG23      VAL 806  40.209 -20.039 -12.944

  No H/Q in entry =           9
  In of MODEL   30
    1    H    GLU 807           H        GLU 807  39.676 -24.318 -14.644
    2    HA   GLU 807           HA       GLU 807  40.154 -24.996 -17.413
    3    HB2  GLU 807           HB2      GLU 807  40.624 -26.674 -15.638
    4    HB3  GLU 807           HB3      GLU 807  38.923 -26.642 -15.200
    5    HG2  GLU 807           HG2      GLU 807  38.346 -27.404 -17.453
    6    HG3  GLU 807           HG3      GLU 807  40.062 -27.485 -17.838

  No H/Q in entry =           6
  In of MODEL   30
    1    H    VAL 808           H        VAL 808  38.722 -24.190 -18.785
    2    HA   VAL 808           HA       VAL 808  35.941 -24.536 -18.252
    3    HB   VAL 808           HB       VAL 808  35.498 -22.637 -19.437
    4   HG12  VAL 808          HG11      VAL 808  37.630 -21.864 -17.484
    5   HG11  VAL 808          HG12      VAL 808  35.987 -22.333 -17.088
    6   HG13  VAL 808          HG13      VAL 808  36.277 -20.842 -17.999
    7   HG21  VAL 808          HG21      VAL 808  37.160 -22.636 -21.096
    8   HG23  VAL 808          HG22      VAL 808  38.429 -22.169 -19.949
    9   HG22  VAL 808          HG23      VAL 808  37.139 -21.024 -20.372

  No H/Q in entry =           9
  In of MODEL   30
    1    H    ASN 809           H        ASN 809  34.918 -25.232 -20.182
    2    HA   ASN 809           HA       ASN 809  34.689 -26.153 -22.181
    3    HB2  ASN 809           HB2      ASN 809  37.001 -24.370 -22.748
    4    HB3  ASN 809           HB3      ASN 809  36.541 -25.534 -23.973
    5   HD21  ASN 809          HD21      ASN 809  35.730 -22.596 -22.329
    6   HD22  ASN 809          HD22      ASN 809  34.378 -22.167 -23.308

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLY 810           H        GLY 810  36.700 -27.245 -20.097
    2    HA3  GLY 810           HA2      GLY 810  37.573 -29.455 -20.041
    3    HA2  GLY 810           HA3      GLY 810  37.680 -29.371 -21.806

  No H/Q in entry =           3
  In of MODEL   30
    1    H    LYS 811           H        LYS 811  38.916 -26.532 -20.987
    2    HA   LYS 811           HA       LYS 811  41.646 -27.636 -20.801
    3    HB2  LYS 811           HB2      LYS 811  42.318 -25.768 -22.281
    4    HB3  LYS 811           HB3      LYS 811  41.298 -26.978 -23.052
    5    HG2  LYS 811           HG2      LYS 811  39.355 -25.527 -22.748
    6    HG3  LYS 811           HG3      LYS 811  40.379 -24.315 -21.990
    7    HD2  LYS 811           HD2      LYS 811  40.694 -25.376 -24.762
    8    HD3  LYS 811           HD3      LYS 811  39.862 -23.872 -24.364
    9    HE2  LYS 811           HE2      LYS 811  42.010 -23.095 -23.285
   10    HE3  LYS 811           HE3      LYS 811  42.787 -24.533 -23.945
   11    HZ2  LYS 811           HZ1      LYS 811  41.536 -22.325 -25.457
   12    HZ1  LYS 811           HZ2      LYS 811  42.105 -23.718 -26.187
   13    HZ3  LYS 811           HZ3      LYS 811  43.169 -22.687 -25.375

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLU 812           H        GLU 812  43.233 -26.268 -19.866
    2    HA   GLU 812           HA       GLU 812  42.099 -24.445 -17.923
    3    HB2  GLU 812           HB2      GLU 812  44.762 -25.828 -18.090
    4    HB3  GLU 812           HB3      GLU 812  44.373 -24.608 -16.884
    5    HG2  GLU 812           HG2      GLU 812  42.577 -25.972 -16.036
    6    HG3  GLU 812           HG3      GLU 812  42.890 -27.190 -17.272

  No H/Q in entry =           6
  In of MODEL   30
    1    H    GLN 813           H        GLN 813  42.026 -22.489 -18.407
    2    HA   GLN 813           HA       GLN 813  44.114 -21.213 -20.062
    3    HB2  GLN 813           HB2      GLN 813  42.006 -21.291 -21.267
    4    HB3  GLN 813           HB3      GLN 813  41.129 -20.669 -19.877
    5    HG2  GLN 813           HG2      GLN 813  42.337 -18.561 -20.082
    6    HG3  GLN 813           HG3      GLN 813  43.166 -19.161 -21.523
    7   HE21  GLN 813          HE21      GLN 813  40.685 -20.507 -22.486
    8   HE22  GLN 813          HE22      GLN 813  39.671 -19.232 -23.025

  No H/Q in entry =           8
  In of MODEL   30
    1    H    THR 814           H        THR 814  44.814 -19.229 -19.330
    2    HA   THR 814           HA       THR 814  44.451 -18.710 -16.517
    3    HB   THR 814           HB       THR 814  46.061 -17.199 -18.556
    4    HG1  THR 814           HG1      THR 814  46.875 -19.119 -18.660
    5   HG22  THR 814          HG21      THR 814  46.346 -17.469 -15.551
    6   HG21  THR 814          HG22      THR 814  45.740 -16.051 -16.400
    7   HG23  THR 814          HG23      THR 814  47.423 -16.549 -16.604

  No H/Q in entry =           7
  In of MODEL   30
    1    H    MET 815           H        MET 815  43.118 -17.225 -15.780
    2    HA   MET 815           HA       MET 815  42.106 -15.221 -17.676
    3    HB2  MET 815           HB2      MET 815  40.541 -16.328 -15.352
    4    HB3  MET 815           HB3      MET 815  39.952 -15.277 -16.633
    5    HG2  MET 815           HG2      MET 815  40.575 -17.266 -18.193
    6    HG3  MET 815           HG3      MET 815  40.628 -18.134 -16.665
    7    HE3  MET 815           HE1      MET 815  37.465 -19.285 -18.562
    8    HE2  MET 815           HE2      MET 815  38.973 -19.799 -17.796
    9    HE1  MET 815           HE3      MET 815  39.029 -18.752 -19.203

  No H/Q in entry =           9
  In of MODEL   30
    1    H    SER 816           H        SER 816  41.698 -13.214 -16.747
    2    HA   SER 816           HA       SER 816  43.277 -12.626 -14.457
    3    HB2  SER 816           HB2      SER 816  41.192 -10.930 -15.888
    4    HB3  SER 816           HB3      SER 816  42.423 -10.353 -14.762
    5    HG   SER 816           HG       SER 816  42.988 -10.063 -16.987

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLU 817           H        GLU 817  42.427 -12.035 -12.472
    2    HA   GLU 817           HA       GLU 817  40.595 -13.824 -11.415
    3    HB2  GLU 817           HB2      GLU 817  42.505 -12.316 -10.458
    4    HB3  GLU 817           HB3      GLU 817  41.142 -11.237 -10.159
    5    HG2  GLU 817           HG2      GLU 817  40.120 -12.666  -8.709
    6    HG3  GLU 817           HG3      GLU 817  41.013 -14.031  -9.378

  No H/Q in entry =           6
  In of MODEL   30
    1    H    CYS 818           H        CYS 818  40.149 -10.503 -12.378
    2    HA   CYS 818           HA       CYS 818  37.495 -10.288 -11.455
    3    HB2  CYS 818           HB2      CYS 818  37.386  -8.334 -13.003
    4    HB3  CYS 818           HB3      CYS 818  38.769  -8.307 -11.912

  No H/Q in entry =           4
  In of MODEL   30
    1    H    GLU 819           H        GLU 819  38.894 -11.469 -14.422
    2    HA   GLU 819           HA       GLU 819  36.526 -11.639 -15.967
    3    HB2  GLU 819           HB2      GLU 819  38.724 -11.558 -17.004
    4    HB3  GLU 819           HB3      GLU 819  39.188 -13.044 -16.204
    5    HG2  GLU 819           HG2      GLU 819  37.668 -14.312 -17.534
    6    HG3  GLU 819           HG3      GLU 819  36.972 -12.863 -18.243

  No H/Q in entry =           6
  In of MODEL   30
    1    H    ALA 820           H        ALA 820  38.505 -14.182 -14.453
    2    HA   ALA 820           HA       ALA 820  36.863 -16.337 -14.864
    3    HB1  ALA 820           HB1      ALA 820  39.107 -16.525 -13.962
    4    HB2  ALA 820           HB2      ALA 820  37.954 -17.394 -12.947
    5    HB3  ALA 820           HB3      ALA 820  38.565 -15.820 -12.438

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLY 821           H        GLY 821  36.801 -14.032 -12.153
    2    HA3  GLY 821           HA2      GLY 821  34.780 -15.248 -10.620
    3    HA2  GLY 821           HA3      GLY 821  35.226 -13.547 -10.571

  No H/Q in entry =           3
  In of MODEL   30
    1    H    ALA 822           H        ALA 822  34.621 -12.868 -13.239
    2    HA   ALA 822           HA       ALA 822  31.853 -12.459 -12.984
    3    HB3  ALA 822           HB1      ALA 822  31.953 -11.329 -15.073
    4    HB2  ALA 822           HB2      ALA 822  33.554 -12.019 -15.428
    5    HB1  ALA 822           HB3      ALA 822  33.349 -10.874 -14.094

  No H/Q in entry =           5
  In of MODEL   30
    1    H    LEU 823           H        LEU 823  33.764 -14.724 -14.937
    2    HA   LEU 823           HA       LEU 823  31.603 -15.850 -16.345
    3    HB2  LEU 823           HB2      LEU 823  34.207 -17.102 -15.472
    4    HB3  LEU 823           HB3      LEU 823  32.965 -18.074 -16.221
    5    HG   LEU 823           HG       LEU 823  34.548 -17.577 -17.889
    6   HD11  LEU 823          HD11      LEU 823  32.213 -17.412 -18.598
    7   HD13  LEU 823          HD12      LEU 823  33.321 -16.449 -19.569
    8   HD12  LEU 823          HD13      LEU 823  32.311 -15.661 -18.366
    9   HD23  LEU 823          HD21      LEU 823  34.297 -14.663 -17.191
   10   HD22  LEU 823          HD22      LEU 823  35.234 -15.323 -18.532
   11   HD21  LEU 823          HD23      LEU 823  35.687 -15.696 -16.870

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ARG 824           H        ARG 824  32.843 -16.511 -13.157
    2    HA   ARG 824           HA       ARG 824  31.183 -18.665 -12.442
    3    HB2  ARG 824           HB2      ARG 824  33.161 -17.956 -11.140
    4    HB3  ARG 824           HB3      ARG 824  32.338 -16.477 -10.702
    5    HG2  ARG 824           HG2      ARG 824  32.313 -17.993  -8.828
    6    HG3  ARG 824           HG3      ARG 824  30.675 -17.809  -9.442
    7    HD2  ARG 824           HD2      ARG 824  32.465 -20.076 -10.250
    8    HD3  ARG 824           HD3      ARG 824  31.477 -20.204  -8.845
    9    HE   ARG 824           HE       ARG 824  29.790 -19.447 -10.919
   10   HH11  ARG 824          HH11      ARG 824  31.821 -22.231 -10.070
   11   HH12  ARG 824          HH12      ARG 824  30.956 -23.335 -11.026
   12   HH21  ARG 824          HH21      ARG 824  28.575 -21.012 -12.229
   13   HH22  ARG 824          HH22      ARG 824  29.070 -22.631 -12.260

  No H/Q in entry =          13
  In of MODEL   30
    1    H    CYS 825           H        CYS 825  30.777 -15.234 -12.052
    2    HA   CYS 825           HA       CYS 825  28.290 -15.319 -10.774
    3    HB2  CYS 825           HB2      CYS 825  29.846 -13.235 -12.186
    4    HB3  CYS 825           HB3      CYS 825  28.272 -12.842 -11.537

  No H/Q in entry =           4
  In of MODEL   30
    1    H    ARG 826           H        ARG 826  29.099 -15.149 -14.203
    2    HA   ARG 826           HA       ARG 826  26.391 -14.524 -14.876
    3    HB2  ARG 826           HB2      ARG 826  27.066 -14.909 -17.222
    4    HB3  ARG 826           HB3      ARG 826  28.000 -13.663 -16.386
    5    HG2  ARG 826           HG2      ARG 826  29.799 -15.185 -16.169
    6    HG3  ARG 826           HG3      ARG 826  28.855 -16.489 -16.910
    7    HD2  ARG 826           HD2      ARG 826  29.586 -13.872 -18.236
    8    HD3  ARG 826           HD3      ARG 826  30.391 -15.414 -18.520
    9    HE   ARG 826           HE       ARG 826  28.011 -16.154 -19.154
   10   HH11  ARG 826          HH11      ARG 826  29.267 -12.888 -19.791
   11   HH12  ARG 826          HH12      ARG 826  28.530 -12.752 -21.300
   12   HH21  ARG 826          HH21      ARG 826  26.957 -15.917 -21.240
   13   HH22  ARG 826          HH22      ARG 826  27.162 -14.508 -22.158

  No H/Q in entry =          13
  In of MODEL   30
    1    H    GLY 827           H        GLY 827  27.910 -17.416 -14.138
    2    HA3  GLY 827           HA2      GLY 827  26.357 -19.282 -13.801
    3    HA2  GLY 827           HA3      GLY 827  25.574 -18.770 -15.291

  No H/Q in entry =           3
  In of MODEL   30
    1    H    GLN 828           H        GLN 828  28.683 -18.420 -15.951
    2    HA   GLN 828           HA       GLN 828  28.818 -20.698 -17.640
    3    HB2  GLN 828           HB2      GLN 828  30.026 -18.650 -18.204
    4    HB3  GLN 828           HB3      GLN 828  30.978 -18.777 -16.742
    5    HG2  GLN 828           HG2      GLN 828  32.317 -19.462 -18.659
    6    HG3  GLN 828           HG3      GLN 828  32.007 -20.823 -17.589
    7   HE21  GLN 828          HE21      GLN 828  29.591 -19.612 -19.847
    8   HE22  GLN 828          HE22      GLN 828  29.666 -20.994 -20.871

  No H/Q in entry =           8
  In of MODEL   30
    1    H    SER 829           H        SER 829  29.982 -22.582 -17.447
    2    HA   SER 829           HA       SER 829  30.430 -23.508 -14.757
    3    HB2  SER 829           HB2      SER 829  30.850 -24.917 -17.399
    4    HB3  SER 829           HB3      SER 829  30.764 -25.675 -15.811
    5    HG   SER 829           HG       SER 829  28.807 -25.918 -16.386

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ILE 830           H        ILE 830  32.347 -23.071 -13.835
    2    HA   ILE 830           HA       ILE 830  34.751 -23.329 -15.463
    3    HB   ILE 830           HB       ILE 830  35.838 -21.417 -14.473
    4   HG12  ILE 830          HG12      ILE 830  34.456 -21.477 -12.309
    5   HG13  ILE 830          HG13      ILE 830  34.833 -19.864 -12.822
    6   HG23  ILE 830          HG21      ILE 830  34.622 -19.562 -15.529
    7   HG22  ILE 830          HG22      ILE 830  33.190 -20.588 -15.626
    8   HG21  ILE 830          HG23      ILE 830  34.626 -21.009 -16.549
    9   HD12  ILE 830          HD11      ILE 830  32.257 -21.314 -13.201
   10   HD11  ILE 830          HD12      ILE 830  32.656 -19.725 -13.872
   11   HD13  ILE 830          HD13      ILE 830  32.626 -19.957 -12.128

  No H/Q in entry =          11
  In of MODEL   30
    1    H    SER 831           H        SER 831  36.392 -24.258 -14.490
    2    HA   SER 831           HA       SER 831  36.090 -24.845 -11.654
    3    HB2  SER 831           HB2      SER 831  37.304 -26.429 -13.883
    4    HB3  SER 831           HB3      SER 831  37.481 -26.818 -12.172
    5    HG   SER 831           HG       SER 831  34.990 -26.457 -13.467

  No H/Q in entry =           5
  In of MODEL   30
    1    H    VAL 832           H        VAL 832  37.347 -23.240 -10.790
    2    HA   VAL 832           HA       VAL 832  39.843 -22.472 -11.932
    3    HB   VAL 832           HB       VAL 832  38.890 -22.104  -9.071
    4   HG12  VAL 832          HG11      VAL 832  41.039 -20.644 -10.614
    5   HG11  VAL 832          HG12      VAL 832  41.306 -21.815  -9.326
    6   HG13  VAL 832          HG13      VAL 832  40.530 -20.270  -8.965
    7   HG22  VAL 832          HG21      VAL 832  38.217 -19.835  -9.752
    8   HG21  VAL 832          HG22      VAL 832  37.324 -21.071 -10.635
    9   HG23  VAL 832          HG23      VAL 832  38.649 -20.213 -11.418

  No H/Q in entry =           9
  In of MODEL   30
    1    H    THR 833           H        THR 833  41.252 -24.055 -12.188
    2    HA   THR 833           HA       THR 833  41.350 -26.288 -10.441
    3    HB   THR 833           HB       THR 833  43.359 -26.834 -11.920
    4    HG1  THR 833           HG1      THR 833  43.597 -25.576 -13.755
    5   HG22  THR 833          HG21      THR 833  41.901 -27.476 -13.806
    6   HG21  THR 833          HG22      THR 833  40.642 -26.408 -13.186
    7   HG23  THR 833          HG23      THR 833  41.135 -27.822 -12.256

  No H/Q in entry =           7
  In of MODEL   30
    1    H    SER 834           H        SER 834  43.378 -23.533 -11.095
    2    HA   SER 834           HA       SER 834  44.829 -24.035  -8.614
    3    HB2  SER 834           HB2      SER 834  46.034 -23.430 -11.320
    4    HB3  SER 834           HB3      SER 834  46.929 -23.401  -9.808
    5    HG   SER 834           HG       SER 834  45.819 -25.600 -11.194

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ILE 835           H        ILE 835  45.354 -22.108  -7.527
    2    HA   ILE 835           HA       ILE 835  44.091 -19.798  -8.674
    3    HB   ILE 835           HB       ILE 835  44.083 -18.744  -6.676
    4   HG12  ILE 835          HG12      ILE 835  46.550 -18.582  -6.337
    5   HG13  ILE 835          HG13      ILE 835  45.673 -18.833  -4.834
    6   HG22  ILE 835          HG21      ILE 835  43.730 -20.314  -4.804
    7   HG21  ILE 835          HG22      ILE 835  44.338 -21.601  -5.836
    8   HG23  ILE 835          HG23      ILE 835  42.873 -20.727  -6.292
    9   HD11  ILE 835          HD11      ILE 835  46.331 -21.150  -4.922
   10   HD13  ILE 835          HD12      ILE 835  47.665 -19.970  -4.888
   11   HD12  ILE 835          HD13      ILE 835  47.246 -20.793  -6.415

  No H/Q in entry =          11
  In of MODEL   30
    1    H    ARG 836           H        ARG 836  46.856 -21.293  -9.043
    2    HA   ARG 836           HA       ARG 836  48.642 -19.082  -9.429
    3    HB2  ARG 836           HB2      ARG 836  48.865 -22.026  -9.949
    4    HB3  ARG 836           HB3      ARG 836  50.122 -20.869 -10.375
    5    HG2  ARG 836           HG2      ARG 836  50.307 -20.196  -8.053
    6    HG3  ARG 836           HG3      ARG 836  49.036 -21.341  -7.623
    7    HD2  ARG 836           HD2      ARG 836  51.249 -22.148  -7.183
    8    HD3  ARG 836           HD3      ARG 836  50.362 -23.158  -8.350
    9    HE   ARG 836           HE       ARG 836  51.981 -21.220  -9.643
   10   HH11  ARG 836          HH11      ARG 836  52.222 -24.312  -7.965
   11   HH12  ARG 836          HH12      ARG 836  53.610 -24.846  -8.758
   12   HH21  ARG 836          HH21      ARG 836  53.888 -21.938 -10.839
   13   HH22  ARG 836          HH22      ARG 836  54.600 -23.429 -10.476

  No H/Q in entry =          13
  In of MODEL   30
    1    HA   PRO 837           HA       PRO 837  47.283 -18.593 -13.670
    2    HB2  PRO 837           HB2      PRO 837  49.406 -17.341 -14.737
    3    HB3  PRO 837           HB3      PRO 837  48.323 -16.534 -13.600
    4    HG2  PRO 837           HG2      PRO 837  51.003 -17.770 -13.103
    5    HG3  PRO 837           HG3      PRO 837  50.355 -16.234 -12.499
    6    HD2  PRO 837           HD2      PRO 837  50.408 -18.518 -11.019
    7    HD3  PRO 837           HD3      PRO 837  49.172 -17.258 -10.814

  No H/Q in entry =           7
  In of MODEL   30
    1    H    CYS 838           H        CYS 838  47.661 -19.467 -15.785
    2    HA   CYS 838           HA       CYS 838  49.644 -21.592 -15.785
    3    HB2  CYS 838           HB2      CYS 838  47.259 -22.219 -16.190
    4    HB3  CYS 838           HB3      CYS 838  47.239 -21.130 -17.571

  No H/Q in entry =           4
  In of MODEL   30
    1    H    ALA 839           H        ALA 839  50.496 -21.909 -18.168
    2    HA   ALA 839           HA       ALA 839  51.567 -19.416 -19.120
    3    HB1  ALA 839           HB1      ALA 839  52.900 -21.476 -19.122
    4    HB3  ALA 839           HB2      ALA 839  52.739 -20.799 -20.744
    5    HB2  ALA 839           HB3      ALA 839  51.770 -22.196 -20.271

  No H/Q in entry =           5
  In of MODEL   30
    1    H    ALA 840           H        ALA 840  48.895 -21.386 -19.728
    2    HA   ALA 840           HA       ALA 840  48.323 -20.545 -22.399
    3    HB3  ALA 840           HB1      ALA 840  46.501 -21.784 -20.342
    4    HB2  ALA 840           HB2      ALA 840  47.484 -22.676 -21.498
    5    HB1  ALA 840           HB3      ALA 840  46.177 -21.632 -22.068

  No H/Q in entry =           5
  In of MODEL   30
    1    H    GLU 841           H        GLU 841  48.677 -18.293 -21.980
    2    HA   GLU 841           HA       GLU 841  46.102 -17.109 -21.228
    3    HB2  GLU 841           HB2      GLU 841  47.197 -15.108 -20.352
    4    HB3  GLU 841           HB3      GLU 841  47.717 -16.539 -19.482
    5    HG2  GLU 841           HG2      GLU 841  49.814 -16.548 -20.614
    6    HG3  GLU 841           HG3      GLU 841  49.294 -15.243 -21.680

  No H/Q in entry =           6
  In of MODEL   30
    1    H    THR 842           H        THR 842  48.664 -17.219 -23.420
    2    HA   THR 842           HA       THR 842  47.368 -15.140 -25.057
    3    HB   THR 842           HB       THR 842  50.147 -16.198 -25.606
    4    HG1  THR 842           HG1      THR 842  49.361 -14.288 -23.609
    5   HG23  THR 842          HG21      THR 842  50.479 -13.915 -26.461
    6   HG22  THR 842          HG22      THR 842  48.850 -13.479 -25.945
    7   HG21  THR 842          HG23      THR 842  49.079 -14.670 -27.226

  No H/Q in entry =           7
  In of MODEL   30
    1    H    GLN 843           H        GLN 843  46.952 -18.193 -24.661
    2    HA   GLN 843           HA       GLN 843  47.055 -18.978 -27.496
    3    HB2  GLN 843           HB2      GLN 843  47.446 -20.697 -25.035
    4    HB3  GLN 843           HB3      GLN 843  47.249 -21.334 -26.654
    5    HG2  GLN 843           HG2      GLN 843  49.498 -19.536 -25.784
    6    HG3  GLN 843           HG3      GLN 843  49.581 -21.294 -25.848
    7   HE21  GLN 843          HE21      GLN 843  49.605 -22.302 -27.844
    8   HE22  GLN 843          HE22      GLN 843  49.983 -21.461 -29.306

  No H/Q in entry =           8
  In of MODEL   31
    1    H1   GLY 689           H2       GLY 689  52.987   7.447 -28.452
    2    H2   GLY 689           H1       GLY 689  54.080   6.602 -29.414
    3    H3   GLY 689           H3       GLY 689  52.416   6.372 -29.626
    4    HA2  GLY 689           HA2      GLY 689  53.378   4.536 -28.440
    5    HA3  GLY 689           HA3      GLY 689  52.240   5.432 -27.440

  No H/Q in entry =           5
  In of MODEL   31
    1    H    SER 690           H        SER 690  54.121   3.836 -26.219
    2    HA   SER 690           HA       SER 690  55.526   5.858 -24.723
    3    HB2  SER 690           HB2      SER 690  55.315   2.892 -24.169
    4    HB3  SER 690           HB3      SER 690  55.863   4.132 -23.043
    5    HG   SER 690           HG       SER 690  53.387   3.307 -23.547

  No H/Q in entry =           5
  In of MODEL   31
    1    H    HIS 691           H        HIS 691  56.205   3.931 -27.189
    2    HA   HIS 691           HA       HIS 691  59.096   3.763 -26.652
    3    HB2  HIS 691           HB2      HIS 691  58.007   1.709 -27.553
    4    HB3  HIS 691           HB3      HIS 691  57.485   2.614 -28.961
    5    HD1  HIS 691           HD1      HIS 691  59.072   2.663 -30.928
    6    HD2  HIS 691           HD2      HIS 691  60.882   1.271 -27.456
    7    HE1  HIS 691           HE1      HIS 691  61.292   1.784 -31.641
    8    HE2  HIS 691           HE2      HIS 691  62.089   0.561 -29.627

  No H/Q in entry =           8
  In of MODEL   31
    1    H    MET 692           H        MET 692  59.754   5.799 -26.903
    2    HA   MET 692           HA       MET 692  58.733   7.421 -29.055
    3    HB2  MET 692           HB2      MET 692  60.700   7.995 -26.862
    4    HB3  MET 692           HB3      MET 692  60.275   9.170 -28.093
    5    HG2  MET 692           HG2      MET 692  58.175   7.902 -26.378
    6    HG3  MET 692           HG3      MET 692  59.123   9.256 -25.785
    7    HE1  MET 692           HE1      MET 692  56.463   8.012 -28.398
    8    HE3  MET 692           HE2      MET 692  57.532   8.777 -29.607
    9    HE2  MET 692           HE3      MET 692  55.995   9.499 -29.203

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ASN 693           H        ASN 693  61.953   6.466 -28.000
    2    HA   ASN 693           HA       ASN 693  62.796   6.755 -30.796
    3    HB2  ASN 693           HB2      ASN 693  64.459   7.083 -28.263
    4    HB3  ASN 693           HB3      ASN 693  65.118   7.095 -29.888
    5   HD21  ASN 693          HD21      ASN 693  65.959   9.154 -29.707
    6   HD22  ASN 693          HD22      ASN 693  64.976  10.562 -29.637

  No H/Q in entry =           6
  In of MODEL   31
    1    HA   PRO 694           HA       PRO 694  63.737   2.445 -30.756
    2    HB2  PRO 694           HB2      PRO 694  66.232   2.422 -31.971
    3    HB3  PRO 694           HB3      PRO 694  64.687   2.441 -32.830
    4    HG2  PRO 694           HG2      PRO 694  66.559   4.677 -32.235
    5    HG3  PRO 694           HG3      PRO 694  65.554   4.409 -33.667
    6    HD2  PRO 694           HD2      PRO 694  64.900   6.196 -31.754
    7    HD3  PRO 694           HD3      PRO 694  63.676   5.303 -32.675

  No H/Q in entry =           7
  In of MODEL   31
    1    H    LEU 695           H        LEU 695  64.030   1.948 -28.703
    2    HA   LEU 695           HA       LEU 695  66.721   1.903 -27.631
    3    HB2  LEU 695           HB2      LEU 695  64.293   3.025 -26.212
    4    HB3  LEU 695           HB3      LEU 695  65.804   2.641 -25.420
    5    HG   LEU 695           HG       LEU 695  65.511   4.738 -27.582
    6   HD13  LEU 695          HD11      LEU 695  64.231   5.373 -25.620
    7   HD12  LEU 695          HD12      LEU 695  65.689   6.357 -25.738
    8   HD11  LEU 695          HD13      LEU 695  65.612   5.021 -24.587
    9   HD23  LEU 695          HD21      LEU 695  67.706   5.487 -26.771
   10   HD22  LEU 695          HD22      LEU 695  67.771   3.837 -27.384
   11   HD21  LEU 695          HD23      LEU 695  67.750   4.131 -25.645

  No H/Q in entry =          11
  In of MODEL   31
    1    H    THR 696           H        THR 696  67.028   0.111 -26.430
    2    HA   THR 696           HA       THR 696  64.728  -1.496 -25.771
    3    HB   THR 696           HB       THR 696  65.561  -2.498 -27.814
    4    HG1  THR 696           HG1      THR 696  65.239  -4.304 -26.974
    5   HG21  THR 696          HG21      THR 696  67.807  -1.570 -27.875
    6   HG23  THR 696          HG22      THR 696  67.876  -3.323 -28.074
    7   HG22  THR 696          HG23      THR 696  68.287  -2.590 -26.520

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLN 697           H        GLN 697  64.737  -1.500 -23.673
    2    HA   GLN 697           HA       GLN 697  67.251  -1.926 -22.263
    3    HB2  GLN 697           HB2      GLN 697  66.777   0.520 -22.305
    4    HB3  GLN 697           HB3      GLN 697  65.216   0.206 -21.565
    5    HG2  GLN 697           HG2      GLN 697  66.827   0.991 -19.923
    6    HG3  GLN 697           HG3      GLN 697  66.334  -0.669 -19.576
    7   HE21  GLN 697          HE21      GLN 697  68.879   1.381 -20.664
    8   HE22  GLN 697          HE22      GLN 697  70.151   0.227 -20.533

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ALA 698           H        ALA 698  66.994  -3.140 -20.447
    2    HA   ALA 698           HA       ALA 698  64.403  -4.390 -20.081
    3    HB2  ALA 698           HB1      ALA 698  65.548  -5.833 -18.491
    4    HB3  ALA 698           HB2      ALA 698  67.005  -4.846 -18.607
    5    HB1  ALA 698           HB3      ALA 698  66.462  -5.787 -20.000

  No H/Q in entry =           5
  In of MODEL   31
    1    H    VAL 699           H        VAL 699  63.183  -2.866 -19.493
    2    HA   VAL 699           HA       VAL 699  63.698  -1.264 -17.254
    3    HB   VAL 699           HB       VAL 699  61.362  -0.627 -17.564
    4   HG13  VAL 699          HG11      VAL 699  63.108   0.609 -18.732
    5   HG12  VAL 699          HG12      VAL 699  61.684   0.505 -19.768
    6   HG11  VAL 699          HG13      VAL 699  63.066  -0.549 -20.062
    7   HG22  VAL 699          HG21      VAL 699  60.108  -1.354 -19.573
    8   HG21  VAL 699          HG22      VAL 699  60.411  -2.685 -18.460
    9   HG23  VAL 699          HG23      VAL 699  61.379  -2.522 -19.924

  No H/Q in entry =           9
  In of MODEL   31
    1    HA   PRO 700           HA       PRO 700  62.274  -4.255 -14.386
    2    HB2  PRO 700           HB2      PRO 700  61.816  -2.691 -12.242
    3    HB3  PRO 700           HB3      PRO 700  63.416  -3.212 -12.787
    4    HG2  PRO 700           HG2      PRO 700  62.048  -0.587 -13.091
    5    HG3  PRO 700           HG3      PRO 700  63.775  -0.914 -12.875
    6    HD2  PRO 700           HD2      PRO 700  62.554  -0.319 -15.312
    7    HD3  PRO 700           HD3      PRO 700  64.117  -1.140 -15.125

  No H/Q in entry =           7
  In of MODEL   31
    1    H    LYS 701           H        LYS 701  60.477  -5.162 -14.317
    2    HA   LYS 701           HA       LYS 701  58.107  -3.699 -13.652
    3    HB2  LYS 701           HB2      LYS 701  56.779  -5.153 -15.342
    4    HB3  LYS 701           HB3      LYS 701  57.645  -3.757 -15.939
    5    HG2  LYS 701           HG2      LYS 701  57.891  -5.538 -17.482
    6    HG3  LYS 701           HG3      LYS 701  59.451  -5.275 -16.719
    7    HD2  LYS 701           HD2      LYS 701  59.017  -7.204 -15.237
    8    HD3  LYS 701           HD3      LYS 701  57.479  -7.467 -16.061
    9    HE2  LYS 701           HE2      LYS 701  58.619  -7.882 -18.142
   10    HE3  LYS 701           HE3      LYS 701  60.175  -7.499 -17.415
   11    HZ3  LYS 701           HZ1      LYS 701  59.878  -9.854 -17.559
   12    HZ2  LYS 701           HZ2      LYS 701  58.430  -9.794 -16.702
   13    HZ1  LYS 701           HZ3      LYS 701  59.873  -9.409 -15.938

  No H/Q in entry =          13
  In of MODEL   31
    1    H    CYS 702           H        CYS 702  56.617  -4.807 -12.498
    2    HA   CYS 702           HA       CYS 702  57.779  -7.202 -11.229
    3    HB2  CYS 702           HB2      CYS 702  55.884  -5.191 -10.006
    4    HB3  CYS 702           HB3      CYS 702  56.794  -6.461  -9.198

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLN 703           H        GLN 703  56.254  -8.781 -10.386
    2    HA   GLN 703           HA       GLN 703  53.961  -9.146 -12.102
    3    HB2  GLN 703           HB2      GLN 703  54.938 -10.672  -9.681
    4    HB3  GLN 703           HB3      GLN 703  53.603 -11.165 -10.703
    5    HG2  GLN 703           HG2      GLN 703  56.480 -10.915 -11.566
    6    HG3  GLN 703           HG3      GLN 703  55.661 -12.420 -11.167
    7   HE21  GLN 703          HE21      GLN 703  56.160  -9.998 -13.551
    8   HE22  GLN 703          HE22      GLN 703  55.294 -10.733 -14.829

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ARG 704           H        ARG 704  51.975  -9.983 -10.597
    2    HA   ARG 704           HA       ARG 704  51.049  -7.359  -9.814
    3    HB2  ARG 704           HB2      ARG 704  49.533  -9.957  -9.915
    4    HB3  ARG 704           HB3      ARG 704  48.811  -8.381  -9.634
    5    HG2  ARG 704           HG2      ARG 704  49.421  -7.637 -11.827
    6    HG3  ARG 704           HG3      ARG 704  50.360  -9.107 -12.102
    7    HD2  ARG 704           HD2      ARG 704  48.350 -10.415 -11.866
    8    HD3  ARG 704           HD3      ARG 704  47.376  -8.941 -11.708
    9    HE   ARG 704           HE       ARG 704  49.012  -9.072 -14.073
   10   HH11  ARG 704          HH11      ARG 704  45.738  -9.646 -12.802
   11   HH12  ARG 704          HH12      ARG 704  45.053  -9.980 -14.320
   12   HH21  ARG 704          HH21      ARG 704  48.024  -9.505 -16.172
   13   HH22  ARG 704          HH22      ARG 704  46.366  -9.904 -16.257

  No H/Q in entry =          13
  In of MODEL   31
    1    H    TRP 705           H        TRP 705  52.373  -9.877  -8.041
    2    HA   TRP 705           HA       TRP 705  51.079  -9.010  -5.538
    3    HB2  TRP 705           HB2      TRP 705  52.239 -11.015  -4.534
    4    HB3  TRP 705           HB3      TRP 705  51.089 -11.428  -5.793
    5    HD1  TRP 705           HD1      TRP 705  54.835 -11.654  -4.933
    6    HE1  TRP 705           HE1      TRP 705  56.012 -13.008  -6.748
    7    HE3  TRP 705           HE3      TRP 705  50.979 -12.184  -8.323
    8    HZ2  TRP 705           HZ2      TRP 705  55.427 -14.157  -9.217
    9    HZ3  TRP 705           HZ3      TRP 705  51.410 -13.459 -10.345
   10    HH2  TRP 705           HH2      TRP 705  53.606 -14.433 -10.773

  No H/Q in entry =          10
  In of MODEL   31
    1    H    GLU 706           H        GLU 706  53.340  -7.826  -7.353
    2    HA   GLU 706           HA       GLU 706  55.314  -7.508  -5.219
    3    HB2  GLU 706           HB2      GLU 706  55.735  -7.695  -8.170
    4    HB3  GLU 706           HB3      GLU 706  57.009  -7.344  -6.999
    5    HG2  GLU 706           HG2      GLU 706  56.589  -9.553  -6.000
    6    HG3  GLU 706           HG3      GLU 706  55.374  -9.856  -7.240

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LYS 707           H        LYS 707  56.660  -5.667  -5.468
    2    HA   LYS 707           HA       LYS 707  55.621  -3.350  -6.869
    3    HB2  LYS 707           HB2      LYS 707  56.070  -1.928  -4.878
    4    HB3  LYS 707           HB3      LYS 707  54.788  -3.086  -4.566
    5    HG2  LYS 707           HG2      LYS 707  56.209  -4.424  -3.210
    6    HG3  LYS 707           HG3      LYS 707  57.646  -3.554  -3.743
    7    HD2  LYS 707           HD2      LYS 707  56.996  -2.890  -1.475
    8    HD3  LYS 707           HD3      LYS 707  56.861  -1.542  -2.599
    9    HE2  LYS 707           HE2      LYS 707  54.440  -1.941  -2.748
   10    HE3  LYS 707           HE3      LYS 707  54.603  -3.259  -1.584
   11    HZ3  LYS 707           HZ1      LYS 707  53.885  -1.211  -0.508
   12    HZ2  LYS 707           HZ2      LYS 707  55.265  -0.415  -1.062
   13    HZ1  LYS 707           HZ3      LYS 707  55.417  -1.652   0.042

  No H/Q in entry =          13
  In of MODEL   31
    1    H    LEU 708           H        LEU 708  57.397  -1.739  -7.053
    2    HA   LEU 708           HA       LEU 708  59.918  -3.171  -7.387
    3    HB2  LEU 708           HB2      LEU 708  58.978  -2.157  -9.393
    4    HB3  LEU 708           HB3      LEU 708  58.920  -0.595  -8.605
    5    HG   LEU 708           HG       LEU 708  61.407  -0.640  -8.485
    6   HD13  LEU 708          HD11      LEU 708  61.783  -3.018  -8.589
    7   HD12  LEU 708          HD12      LEU 708  62.600  -2.218  -9.933
    8   HD11  LEU 708          HD13      LEU 708  61.083  -3.082 -10.204
    9   HD21  LEU 708          HD21      LEU 708  60.235   0.573 -10.245
   10   HD23  LEU 708          HD22      LEU 708  60.190  -0.888 -11.230
   11   HD22  LEU 708          HD23      LEU 708  61.736  -0.128 -10.847

  No H/Q in entry =          11
  In of MODEL   31
    1    H    GLN 709           H        GLN 709  61.513  -2.811  -5.970
    2    HA   GLN 709           HA       GLN 709  62.127  -0.085  -5.344
    3    HB2  GLN 709           HB2      GLN 709  62.466  -0.391  -2.955
    4    HB3  GLN 709           HB3      GLN 709  60.799  -0.720  -3.367
    5    HG2  GLN 709           HG2      GLN 709  61.334  -2.362  -1.764
    6    HG3  GLN 709           HG3      GLN 709  61.536  -3.171  -3.355
    7   HE21  GLN 709          HE21      GLN 709  63.178  -4.194  -3.690
    8   HE22  GLN 709          HE22      GLN 709  64.576  -4.267  -2.669

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ASN 710           H        ASN 710  64.262   0.160  -4.813
    2    HA   ASN 710           HA       ASN 710  66.536  -0.342  -4.936
    3    HB2  ASN 710           HB2      ASN 710  65.558  -1.703  -2.973
    4    HB3  ASN 710           HB3      ASN 710  65.531  -3.041  -4.020
    5   HD21  ASN 710          HD21      ASN 710  67.541  -0.938  -2.288
    6   HD22  ASN 710          HD22      ASN 710  69.010  -1.852  -2.323

  No H/Q in entry =           6
  In of MODEL   31
    1    H    SER 711           H        SER 711  64.813  -0.800  -7.299
    2    HA   SER 711           HA       SER 711  64.912  -1.513  -9.407
    3    HB2  SER 711           HB2      SER 711  67.716  -2.303  -8.653
    4    HB3  SER 711           HB3      SER 711  67.112  -2.191 -10.321
    5    HG   SER 711           HG       SER 711  67.031  -0.074  -8.447

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ARG 712           H        ARG 712  64.168  -3.409  -7.162
    2    HA   ARG 712           HA       ARG 712  64.207  -5.823  -8.794
    3    HB2  ARG 712           HB2      ARG 712  64.584  -7.200  -6.804
    4    HB3  ARG 712           HB3      ARG 712  65.948  -6.147  -7.144
    5    HG2  ARG 712           HG2      ARG 712  65.067  -4.583  -5.335
    6    HG3  ARG 712           HG3      ARG 712  63.838  -5.750  -5.068
    7    HD2  ARG 712           HD2      ARG 712  65.282  -7.421  -4.313
    8    HD3  ARG 712           HD3      ARG 712  66.704  -6.641  -4.995
    9    HE   ARG 712           HE       ARG 712  66.509  -4.958  -3.262
   10   HH11  ARG 712          HH11      ARG 712  64.977  -8.133  -2.627
   11   HH12  ARG 712          HH12      ARG 712  64.961  -7.920  -0.944
   12   HH21  ARG 712          HH21      ARG 712  66.476  -4.755  -0.848
   13   HH22  ARG 712          HH22      ARG 712  65.794  -6.025   0.043

  No H/Q in entry =          13
  In of MODEL   31
    1    H    CYS 713           H        CYS 713  62.544  -7.375  -8.047
    2    HA   CYS 713           HA       CYS 713  60.170  -5.822  -7.404
    3    HB2  CYS 713           HB2      CYS 713  60.375  -8.618  -8.517
    4    HB3  CYS 713           HB3      CYS 713  58.956  -7.578  -8.483

  No H/Q in entry =           4
  In of MODEL   31
    1    H    VAL 714           H        VAL 714  59.441  -5.974  -5.416
    2    HA   VAL 714           HA       VAL 714  59.952  -8.437  -3.900
    3    HB   VAL 714           HB       VAL 714  60.046  -7.113  -1.829
    4   HG11  VAL 714          HG11      VAL 714  61.978  -6.158  -3.926
    5   HG13  VAL 714          HG12      VAL 714  62.124  -7.616  -2.942
    6   HG12  VAL 714          HG13      VAL 714  62.223  -6.024  -2.185
    7   HG21  VAL 714          HG21      VAL 714  59.886  -4.682  -3.628
    8   HG23  VAL 714          HG22      VAL 714  60.212  -4.647  -1.900
    9   HG22  VAL 714          HG23      VAL 714  58.650  -5.219  -2.490

  No H/Q in entry =           9
  In of MODEL   31
    1    H    CYS 715           H        CYS 715  58.246  -8.661  -2.120
    2    HA   CYS 715           HA       CYS 715  55.742  -8.262  -3.515
    3    HB2  CYS 715           HB2      CYS 715  56.327  -9.837  -1.016
    4    HB3  CYS 715           HB3      CYS 715  54.813  -9.828  -1.915

  No H/Q in entry =           4
  In of MODEL   31
    1    H    LYS 716           H        LYS 716  53.850  -7.543  -2.458
    2    HA   LYS 716           HA       LYS 716  54.275  -5.276  -0.724
    3    HB2  LYS 716           HB2      LYS 716  51.667  -6.555  -1.625
    4    HB3  LYS 716           HB3      LYS 716  51.821  -4.990  -0.844
    5    HG2  LYS 716           HG2      LYS 716  53.191  -4.256  -2.839
    6    HG3  LYS 716           HG3      LYS 716  52.710  -5.763  -3.615
    7    HD2  LYS 716           HD2      LYS 716  50.809  -3.639  -2.593
    8    HD3  LYS 716           HD3      LYS 716  51.293  -3.838  -4.271
    9    HE2  LYS 716           HE2      LYS 716  50.231  -6.051  -4.317
   10    HE3  LYS 716           HE3      LYS 716  49.790  -5.884  -2.617
   11    HZ1  LYS 716           HZ1      LYS 716  48.873  -4.057  -4.769
   12    HZ3  LYS 716           HZ2      LYS 716  48.357  -4.033  -3.176
   13    HZ2  LYS 716           HZ3      LYS 716  47.928  -5.302  -4.184

  No H/Q in entry =          13
  In of MODEL   31
    1    H    MET 717           H        MET 717  52.281  -5.361   1.144
    2    HA   MET 717           HA       MET 717  53.119  -7.691   2.654
    3    HB2  MET 717           HB2      MET 717  51.868  -5.102   3.533
    4    HB3  MET 717           HB3      MET 717  52.168  -6.454   4.613
    5    HG2  MET 717           HG2      MET 717  54.263  -4.949   3.058
    6    HG3  MET 717           HG3      MET 717  53.923  -4.773   4.777
    7    HE1  MET 717           HE1      MET 717  53.454  -7.744   5.774
    8    HE3  MET 717           HE2      MET 717  54.513  -6.611   6.616
    9    HE2  MET 717           HE3      MET 717  55.088  -8.231   6.215

  No H/Q in entry =           9
  In of MODEL   31
    1    HA   PRO 718           HA       PRO 718  49.519  -9.915   1.722
    2    HB2  PRO 718           HB2      PRO 718  49.224 -11.355   4.077
    3    HB3  PRO 718           HB3      PRO 718  50.290 -11.784   2.740
    4    HG2  PRO 718           HG2      PRO 718  50.933 -10.370   5.294
    5    HG3  PRO 718           HG3      PRO 718  51.877 -11.585   4.416
    6    HD2  PRO 718           HD2      PRO 718  52.504  -8.992   4.325
    7    HD3  PRO 718           HD3      PRO 718  52.688 -10.028   2.897

  No H/Q in entry =           7
  In of MODEL   31
    1    H    TYR 719           H        TYR 719  49.465  -8.054   4.645
    2    HA   TYR 719           HA       TYR 719  46.659  -8.438   5.099
    3    HB2  TYR 719           HB2      TYR 719  46.892  -6.680   6.811
    4    HB3  TYR 719           HB3      TYR 719  48.042  -7.984   7.020
    5    HD1  TYR 719           HD1      TYR 719  50.459  -7.577   6.528
    6    HD2  TYR 719           HD2      TYR 719  47.575  -4.453   6.372
    7    HE1  TYR 719           HE1      TYR 719  52.251  -5.907   6.703
    8    HE2  TYR 719           HE2      TYR 719  49.359  -2.790   6.504
    9    HH   TYR 719           HH       TYR 719  51.649  -2.662   7.344

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLU 720           H        GLU 720  48.503  -6.427   3.092
    2    HA   GLU 720           HA       GLU 720  46.469  -4.337   2.921
    3    HB2  GLU 720           HB2      GLU 720  48.957  -3.885   3.107
    4    HB3  GLU 720           HB3      GLU 720  49.138  -4.589   1.516
    5    HG2  GLU 720           HG2      GLU 720  49.128  -2.140   1.424
    6    HG3  GLU 720           HG3      GLU 720  47.767  -2.836   0.549

  No H/Q in entry =           6
  In of MODEL   31
    1    H    CYS 721           H        CYS 721  46.534  -7.221   1.966
    2    HA   CYS 721           HA       CYS 721  45.859  -6.831  -0.849
    3    HB2  CYS 721           HB2      CYS 721  46.580  -9.328   0.685
    4    HB3  CYS 721           HB3      CYS 721  46.297  -9.223  -1.050

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLY 722           H        GLY 722  43.735  -7.317  -1.439
    2    HA3  GLY 722           HA2      GLY 722  42.096  -8.761   0.491
    3    HA2  GLY 722           HA3      GLY 722  41.627  -7.116   0.103

  No H/Q in entry =           3
  In of MODEL   31
    1    HA   PRO 723           HA       PRO 723  39.103  -8.157  -3.277
    2    HB2  PRO 723           HB2      PRO 723  40.341  -6.738  -5.351
    3    HB3  PRO 723           HB3      PRO 723  39.085  -6.119  -4.270
    4    HG2  PRO 723           HG2      PRO 723  42.049  -5.824  -4.119
    5    HG3  PRO 723           HG3      PRO 723  40.780  -4.648  -3.721
    6    HD2  PRO 723           HD2      PRO 723  42.080  -5.919  -1.790
    7    HD3  PRO 723           HD3      PRO 723  40.323  -5.672  -1.667

  No H/Q in entry =           7
  In of MODEL   31
    1    H    SER 724           H        SER 724  39.346 -10.245  -3.715
    2    HA   SER 724           HA       SER 724  40.547 -11.154  -6.127
    3    HB2  SER 724           HB2      SER 724  41.833 -11.762  -3.498
    4    HB3  SER 724           HB3      SER 724  41.880 -12.936  -4.812
    5    HG   SER 724           HG       SER 724  42.638 -10.844  -5.940

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU 725           H        LEU 725  40.344 -13.572  -6.154
    2    HA   LEU 725           HA       LEU 725  37.765 -14.361  -5.210
    3    HB2  LEU 725           HB2      LEU 725  39.976 -15.603  -6.725
    4    HB3  LEU 725           HB3      LEU 725  38.818 -16.715  -6.024
    5    HG   LEU 725           HG       LEU 725  37.049 -15.449  -7.397
    6   HD12  LEU 725          HD11      LEU 725  39.476 -14.398  -8.758
    7   HD11  LEU 725          HD12      LEU 725  38.384 -13.452  -7.743
    8   HD13  LEU 725          HD13      LEU 725  37.802 -14.162  -9.253
    9   HD21  LEU 725          HD21      LEU 725  37.895 -17.610  -8.143
   10   HD23  LEU 725          HD22      LEU 725  39.252 -16.760  -8.930
   11   HD22  LEU 725          HD23      LEU 725  37.606 -16.476  -9.477

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ASP 726           H        ASP 726  37.386 -14.978  -3.204
    2    HA   ASP 726           HA       ASP 726  39.508 -15.666  -1.440
    3    HB2  ASP 726           HB2      ASP 726  36.518 -15.624  -1.058
    4    HB3  ASP 726           HB3      ASP 726  37.577 -16.306   0.172

  No H/Q in entry =           4
  In of MODEL   31
    1    H    VAL 727           H        VAL 727  40.302 -17.477  -0.893
    2    HA   VAL 727           HA       VAL 727  39.142 -19.944  -1.960
    3    HB   VAL 727           HB       VAL 727  41.445 -20.692  -2.625
    4   HG11  VAL 727          HG11      VAL 727  40.465 -18.218  -4.053
    5   HG13  VAL 727          HG12      VAL 727  39.932 -19.869  -4.351
    6   HG12  VAL 727          HG13      VAL 727  41.588 -19.393  -4.729
    7   HG23  VAL 727          HG21      VAL 727  42.193 -17.791  -2.195
    8   HG22  VAL 727          HG22      VAL 727  43.231 -19.021  -2.914
    9   HG21  VAL 727          HG23      VAL 727  42.749 -19.154  -1.225

  No H/Q in entry =           9
  In of MODEL   31
    1    H    CYS 728           H        CYS 728  40.017 -21.867  -0.867
    2    HA   CYS 728           HA       CYS 728  40.632 -21.229   1.912
    3    HB2  CYS 728           HB2      CYS 728  39.733 -23.850   0.695
    4    HB3  CYS 728           HB3      CYS 728  39.880 -23.479   2.406

  No H/Q in entry =           4
  In of MODEL   31
    1    H    ALA 729           H        ALA 729  42.592 -21.634   2.716
    2    HA   ALA 729           HA       ALA 729  44.361 -23.325   1.119
    3    HB1  ALA 729           HB1      ALA 729  45.068 -20.761   2.513
    4    HB3  ALA 729           HB2      ALA 729  44.907 -20.980   0.768
    5    HB2  ALA 729           HB3      ALA 729  46.184 -21.812   1.645

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLN 730           H        GLN 730  45.851 -24.456   2.265
    2    HA   GLN 730           HA       GLN 730  45.221 -24.796   5.088
    3    HB2  GLN 730           HB2      GLN 730  44.974 -26.787   3.649
    4    HB3  GLN 730           HB3      GLN 730  46.652 -26.626   3.169
    5    HG2  GLN 730           HG2      GLN 730  47.415 -27.083   5.362
    6    HG3  GLN 730           HG3      GLN 730  45.786 -27.051   6.016
    7   HE21  GLN 730          HE21      GLN 730  45.829 -29.151   6.775
    8   HE22  GLN 730          HE22      GLN 730  45.920 -30.526   5.745

  No H/Q in entry =           8
  In of MODEL   31
    1    H    ASP 731           H        ASP 731  46.608 -24.159   6.484
    2    HA   ASP 731           HA       ASP 731  49.114 -22.979   5.769
    3    HB2  ASP 731           HB2      ASP 731  47.895 -22.115   7.725
    4    HB3  ASP 731           HB3      ASP 731  47.937 -23.703   8.447

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLU 732           H        GLU 732  51.097 -23.942   5.755
    2    HA   GLU 732           HA       GLU 732  51.126 -26.758   5.915
    3    HB2  GLU 732           HB2      GLU 732  53.230 -24.728   5.360
    4    HB3  GLU 732           HB3      GLU 732  53.654 -26.418   5.609
    5    HG2  GLU 732           HG2      GLU 732  51.692 -25.425   3.565
    6    HG3  GLU 732           HG3      GLU 732  53.378 -25.839   3.240

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ARG 733           H        ARG 733  51.750 -24.365   8.292
    2    HA   ARG 733           HA       ARG 733  53.477 -26.100   9.796
    3    HB2  ARG 733           HB2      ARG 733  53.743 -23.627   9.825
    4    HB3  ARG 733           HB3      ARG 733  52.204 -23.498  10.650
    5    HG2  ARG 733           HG2      ARG 733  54.056 -23.299  12.214
    6    HG3  ARG 733           HG3      ARG 733  53.098 -24.745  12.552
    7    HD2  ARG 733           HD2      ARG 733  54.744 -26.119  11.387
    8    HD3  ARG 733           HD3      ARG 733  55.679 -24.678  10.988
    9    HE   ARG 733           HE       ARG 733  55.362 -24.756  13.735
   10   HH11  ARG 733          HH11      ARG 733  56.987 -26.645  11.217
   11   HH12  ARG 733          HH12      ARG 733  58.225 -27.213  12.231
   12   HH21  ARG 733          HH21      ARG 733  57.056 -25.503  15.135
   13   HH22  ARG 733          HH22      ARG 733  58.289 -26.513  14.550

  No H/Q in entry =          13
  In of MODEL   31
    1    H    SER 734           H        SER 734  50.288 -24.697  10.334
    2    HA   SER 734           HA       SER 734  49.806 -26.484  12.571
    3    HB2  SER 734           HB2      SER 734  47.680 -25.180  12.735
    4    HB3  SER 734           HB3      SER 734  49.145 -24.195  12.835
    5    HG   SER 734           HG       SER 734  48.839 -23.620  10.654

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LYS 735           H        LYS 735  49.139 -26.377   9.207
    2    HA   LYS 735           HA       LYS 735  47.987 -27.537   7.790
    3    HB2  LYS 735           HB2      LYS 735  47.975 -29.571  10.004
    4    HB3  LYS 735           HB3      LYS 735  47.214 -29.879   8.450
    5    HG2  LYS 735           HG2      LYS 735  50.133 -29.341   8.978
    6    HG3  LYS 735           HG3      LYS 735  49.398 -30.843   8.402
    7    HD2  LYS 735           HD2      LYS 735  48.550 -29.426   6.420
    8    HD3  LYS 735           HD3      LYS 735  49.707 -28.231   6.964
    9    HE2  LYS 735           HE2      LYS 735  50.386 -31.049   6.142
   10    HE3  LYS 735           HE3      LYS 735  50.646 -29.593   5.189
   11    HZ1  LYS 735           HZ1      LYS 735  52.152 -28.819   7.020
   12    HZ3  LYS 735           HZ2      LYS 735  52.668 -30.174   6.191
   13    HZ2  LYS 735           HZ3      LYS 735  52.001 -30.355   7.717

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ARG 736           H        ARG 736  46.624 -25.652   9.516
    2    HA   ARG 736           HA       ARG 736  43.929 -26.734   9.603
    3    HB2  ARG 736           HB2      ARG 736  43.291 -24.628  10.597
    4    HB3  ARG 736           HB3      ARG 736  44.685 -25.286  11.437
    5    HG2  ARG 736           HG2      ARG 736  46.140 -23.775  10.252
    6    HG3  ARG 736           HG3      ARG 736  44.760 -23.133   9.358
    7    HD2  ARG 736           HD2      ARG 736  45.123 -23.036  12.342
    8    HD3  ARG 736           HD3      ARG 736  45.436 -21.743  11.179
    9    HE   ARG 736           HE       ARG 736  42.769 -22.765  11.022
   10   HH11  ARG 736          HH11      ARG 736  44.814 -20.468  12.765
   11   HH12  ARG 736          HH12      ARG 736  43.529 -19.469  13.249
   12   HH21  ARG 736          HH21      ARG 736  41.013 -21.384  11.647
   13   HH22  ARG 736          HH22      ARG 736  41.316 -19.986  12.575

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ILE 737           H        ILE 737  42.213 -25.755   8.409
    2    HA   ILE 737           HA       ILE 737  43.133 -24.714   5.845
    3    HB   ILE 737           HB       ILE 737  40.306 -25.429   6.661
    4   HG12  ILE 737          HG12      ILE 737  41.796 -27.421   6.921
    5   HG13  ILE 737          HG13      ILE 737  40.584 -27.634   5.673
    6   HG23  ILE 737          HG21      ILE 737  39.926 -25.579   4.263
    7   HG22  ILE 737          HG22      ILE 737  41.627 -25.222   3.956
    8   HG21  ILE 737          HG23      ILE 737  40.586 -24.000   4.683
    9   HD11  ILE 737          HD11      ILE 737  42.282 -27.159   3.980
   10   HD13  ILE 737          HD12      ILE 737  42.717 -28.543   4.987
   11   HD12  ILE 737          HD13      ILE 737  43.489 -26.975   5.254

  No H/Q in entry =          11
  In of MODEL   31
    1    H    LEU 738           H        LEU 738  43.059 -22.550   5.584
    2    HA   LEU 738           HA       LEU 738  41.066 -21.122   7.125
    3    HB2  LEU 738           HB2      LEU 738  42.551 -19.257   7.621
    4    HB3  LEU 738           HB3      LEU 738  43.170 -20.736   8.316
    5    HG   LEU 738           HG       LEU 738  44.239 -19.505   5.767
    6   HD12  LEU 738          HD11      LEU 738  45.236 -19.266   8.604
    7   HD11  LEU 738          HD12      LEU 738  44.479 -17.975   7.674
    8   HD13  LEU 738          HD13      LEU 738  46.034 -18.632   7.167
    9   HD23  LEU 738          HD21      LEU 738  45.345 -21.492   7.709
   10   HD22  LEU 738          HD22      LEU 738  46.143 -20.924   6.219
   11   HD21  LEU 738          HD23      LEU 738  44.632 -21.862   6.144

  No H/Q in entry =          11
  In of MODEL   31
    1    HA   PRO 739           HA       PRO 739  39.995 -19.235   3.367
    2    HB2  PRO 739           HB2      PRO 739  38.726 -17.052   4.312
    3    HB3  PRO 739           HB3      PRO 739  38.053 -18.682   4.528
    4    HG2  PRO 739           HG2      PRO 739  39.611 -17.011   6.462
    5    HG3  PRO 739           HG3      PRO 739  38.133 -17.953   6.739
    6    HD2  PRO 739           HD2      PRO 739  40.635 -18.933   7.373
    7    HD3  PRO 739           HD3      PRO 739  39.276 -19.955   6.845

  No H/Q in entry =           7
  In of MODEL   31
    1    H    LEU 740           H        LEU 740  41.429 -18.356   2.093
    2    HA   LEU 740           HA       LEU 740  42.719 -15.825   2.843
    3    HB2  LEU 740           HB2      LEU 740  43.793 -18.110   1.212
    4    HB3  LEU 740           HB3      LEU 740  44.486 -16.507   1.186
    5    HG   LEU 740           HG       LEU 740  44.375 -18.382   3.543
    6   HD12  LEU 740          HD11      LEU 740  46.787 -18.330   3.309
    7   HD11  LEU 740          HD12      LEU 740  46.629 -17.291   1.890
    8   HD13  LEU 740          HD13      LEU 740  45.997 -18.944   1.860
    9   HD21  LEU 740          HD21      LEU 740  45.448 -15.559   3.351
   10   HD23  LEU 740          HD22      LEU 740  45.724 -16.662   4.692
   11   HD22  LEU 740          HD23      LEU 740  44.094 -16.097   4.351

  No H/Q in entry =          11
  In of MODEL   31
    1    H    THR 741           H        THR 741  43.552 -14.999   0.508
    2    HA   THR 741           HA       THR 741  41.387 -15.314  -1.403
    3    HB   THR 741           HB       THR 741  42.493 -12.551  -0.853
    4    HG1  THR 741           HG1      THR 741  40.250 -13.599   0.574
    5   HG23  THR 741          HG21      THR 741  40.349 -11.855  -1.604
    6   HG22  THR 741          HG22      THR 741  39.692 -13.460  -1.353
    7   HG21  THR 741          HG23      THR 741  40.812 -13.190  -2.677

  No H/Q in entry =           7
  In of MODEL   31
    1    H    VAL 742           H        VAL 742  42.203 -14.813  -3.578
    2    HA   VAL 742           HA       VAL 742  44.653 -15.847  -4.215
    3    HB   VAL 742           HB       VAL 742  43.305 -13.662  -5.829
    4   HG12  VAL 742          HG11      VAL 742  44.386 -14.614  -7.747
    5   HG11  VAL 742          HG12      VAL 742  45.271 -15.739  -6.711
    6   HG13  VAL 742          HG13      VAL 742  45.544 -13.992  -6.577
    7   HG21  VAL 742          HG21      VAL 742  41.786 -15.493  -5.425
    8   HG23  VAL 742          HG22      VAL 742  43.017 -16.629  -6.016
    9   HG22  VAL 742          HG23      VAL 742  42.322 -15.428  -7.110

  No H/Q in entry =           9
  In of MODEL   31
    1    H    CYS 743           H        CYS 743  44.111 -12.272  -4.148
    2    HA   CYS 743           HA       CYS 743  46.710 -11.487  -4.470
    3    HB2  CYS 743           HB2      CYS 743  44.667  -9.988  -4.448
    4    HB3  CYS 743           HB3      CYS 743  44.686 -10.101  -2.701

  No H/Q in entry =           4
  In of MODEL   31
    1    H    LYS 744           H        LYS 744  45.084 -12.204  -1.425
    2    HA   LYS 744           HA       LYS 744  47.200 -11.555   0.290
    3    HB2  LYS 744           HB2      LYS 744  45.035 -13.639   0.654
    4    HB3  LYS 744           HB3      LYS 744  46.084 -13.047   1.933
    5    HG2  LYS 744           HG2      LYS 744  45.135 -10.829   1.726
    6    HG3  LYS 744           HG3      LYS 744  44.154 -11.351   0.355
    7    HD2  LYS 744           HD2      LYS 744  43.017 -12.969   1.832
    8    HD3  LYS 744           HD3      LYS 744  43.964 -12.357   3.192
    9    HE2  LYS 744           HE2      LYS 744  42.958 -10.182   2.973
   10    HE3  LYS 744           HE3      LYS 744  42.153 -10.665   1.482
   11    HZ3  LYS 744           HZ1      LYS 744  40.791 -12.197   2.719
   12    HZ2  LYS 744           HZ2      LYS 744  40.681 -10.659   3.419
   13    HZ1  LYS 744           HZ3      LYS 744  41.613 -11.838   4.150

  No H/Q in entry =          13
  In of MODEL   31
    1    H    MET 745           H        MET 745  46.167 -14.782  -0.762
    2    HA   MET 745           HA       MET 745  48.240 -16.337   0.235
    3    HB2  MET 745           HB2      MET 745  46.707 -17.626  -0.396
    4    HB3  MET 745           HB3      MET 745  46.100 -16.647  -1.748
    5    HG2  MET 745           HG2      MET 745  46.885 -18.552  -2.857
    6    HG3  MET 745           HG3      MET 745  48.254 -17.497  -2.912
    7    HE2  MET 745           HE1      MET 745  47.959 -21.149  -0.148
    8    HE1  MET 745           HE2      MET 745  46.745 -20.654  -1.329
    9    HE3  MET 745           HE3      MET 745  46.980 -19.711   0.144

  No H/Q in entry =           9
  In of MODEL   31
    1    H    HIS 746           H        HIS 746  48.112 -14.642  -2.928
    2    HA   HIS 746           HA       HIS 746  50.450 -15.832  -3.996
    3    HB2  HIS 746           HB2      HIS 746  48.755 -13.585  -4.628
    4    HB3  HIS 746           HB3      HIS 746  50.428 -13.317  -5.165
    5    HD1  HIS 746           HD1      HIS 746  51.234 -15.069  -7.066
    6    HD2  HIS 746           HD2      HIS 746  47.211 -15.201  -6.072
    7    HE1  HIS 746           HE1      HIS 746  50.111 -16.187  -8.990
    8    HE2  HIS 746           HE2      HIS 746  47.738 -16.481  -8.265

  No H/Q in entry =           8
  In of MODEL   31
    1    H    VAL 747           H        VAL 747  49.997 -12.730  -2.346
    2    HA   VAL 747           HA       VAL 747  52.715 -12.015  -2.251
    3    HB   VAL 747           HB       VAL 747  50.269 -11.202  -0.669
    4   HG12  VAL 747          HG11      VAL 747  53.041 -10.001  -0.403
    5   HG11  VAL 747          HG12      VAL 747  52.208 -10.946   0.829
    6   HG13  VAL 747          HG13      VAL 747  51.569  -9.391   0.356
    7   HG22  VAL 747          HG21      VAL 747  50.544  -9.111  -1.911
    8   HG21  VAL 747          HG22      VAL 747  50.397 -10.502  -2.990
    9   HG23  VAL 747          HG23      VAL 747  51.976  -9.781  -2.692

  No H/Q in entry =           9
  In of MODEL   31
    1    H    LEU 748           H        LEU 748  50.585 -13.463   0.056
    2    HA   LEU 748           HA       LEU 748  52.000 -14.134   2.286
    3    HB2  LEU 748           HB2      LEU 748  49.648 -14.396   1.924
    4    HB3  LEU 748           HB3      LEU 748  49.924 -15.418   0.565
    5    HG   LEU 748           HG       LEU 748  48.812 -16.554   2.227
    6   HD13  LEU 748          HD11      LEU 748  50.069 -17.959   1.071
    7   HD12  LEU 748          HD12      LEU 748  50.193 -18.465   2.756
    8   HD11  LEU 748          HD13      LEU 748  51.541 -17.608   1.977
    9   HD23  LEU 748          HD21      LEU 748  49.690 -17.018   4.442
   10   HD22  LEU 748          HD22      LEU 748  49.168 -15.380   4.113
   11   HD21  LEU 748          HD23      LEU 748  50.918 -15.746   4.193

  No H/Q in entry =          11
  In of MODEL   31
    1    H    HIS 749           H        HIS 749  51.784 -16.061  -0.705
    2    HA   HIS 749           HA       HIS 749  53.509 -18.141   0.150
    3    HB2  HIS 749           HB2      HIS 749  51.778 -17.737  -1.974
    4    HB3  HIS 749           HB3      HIS 749  53.361 -17.805  -2.738
    5    HD1  HIS 749           HD1      HIS 749  54.519 -20.124  -2.835
    6    HD2  HIS 749           HD2      HIS 749  50.971 -20.050  -0.697
    7    HE1  HIS 749           HE1      HIS 749  53.980 -22.522  -2.367
    8    HE2  HIS 749           HE2      HIS 749  51.806 -22.486  -1.119

  No H/Q in entry =           8
  In of MODEL   31
    1    H    CYS 750           H        CYS 750  53.999 -15.220  -1.740
    2    HA   CYS 750           HA       CYS 750  56.656 -15.994  -2.441
    3    HB2  CYS 750           HB2      CYS 750  55.101 -13.499  -2.971
    4    HB3  CYS 750           HB3      CYS 750  56.754 -13.766  -3.532

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLN 751           H        GLN 751  55.226 -14.212   0.156
    2    HA   GLN 751           HA       GLN 751  57.602 -12.988   1.029
    3    HB2  GLN 751           HB2      GLN 751  55.055 -13.790   2.409
    4    HB3  GLN 751           HB3      GLN 751  56.323 -12.914   3.240
    5    HG2  GLN 751           HG2      GLN 751  54.983 -11.978   0.730
    6    HG3  GLN 751           HG3      GLN 751  54.472 -11.499   2.339
    7   HE21  GLN 751          HE21      GLN 751  54.904  -9.380   1.774
    8   HE22  GLN 751          HE22      GLN 751  56.502  -8.731   1.747

  No H/Q in entry =           8
  In of MODEL   31
    1    H    GLY 752           H        GLY 752  56.460 -16.196   1.073
    2    HA3  GLY 752           HA2      GLY 752  58.351 -17.776   1.437
    3    HA2  GLY 752           HA3      GLY 752  58.620 -16.898   2.934

  No H/Q in entry =           3
  In of MODEL   31
    1    H    ARG 753           H        ARG 753  55.362 -16.996   2.568
    2    HA   ARG 753           HA       ARG 753  55.245 -19.063   4.562
    3    HB2  ARG 753           HB2      ARG 753  52.998 -17.409   3.402
    4    HB3  ARG 753           HB3      ARG 753  52.902 -18.453   4.807
    5    HG2  ARG 753           HG2      ARG 753  54.577 -15.975   4.550
    6    HG3  ARG 753           HG3      ARG 753  53.069 -16.120   5.454
    7    HD2  ARG 753           HD2      ARG 753  54.149 -17.852   6.883
    8    HD3  ARG 753           HD3      ARG 753  55.658 -17.574   6.023
    9    HE   ARG 753           HE       ARG 753  54.672 -15.154   7.001
   10   HH11  ARG 753          HH11      ARG 753  56.318 -18.119   8.135
   11   HH12  ARG 753          HH12      ARG 753  56.895 -17.402   9.569
   12   HH21  ARG 753          HH21      ARG 753  55.545 -14.199   8.983
   13   HH22  ARG 753          HH22      ARG 753  56.447 -15.175  10.067

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ASN 754           H        ASN 754  54.921 -21.050   4.170
    2    HA   ASN 754           HA       ASN 754  54.197 -21.952   1.527
    3    HB2  ASN 754           HB2      ASN 754  54.925 -23.588   3.976
    4    HB3  ASN 754           HB3      ASN 754  54.782 -24.194   2.336
    5   HD21  ASN 754          HD21      ASN 754  56.720 -22.532   4.595
    6   HD22  ASN 754          HD22      ASN 754  58.164 -22.442   3.672

  No H/Q in entry =           6
  In of MODEL   31
    1    H    TYR 755           H        TYR 755  52.215 -22.200   1.054
    2    HA   TYR 755           HA       TYR 755  50.308 -23.244   2.997
    3    HB2  TYR 755           HB2      TYR 755  50.049 -20.757   1.356
    4    HB3  TYR 755           HB3      TYR 755  48.623 -21.689   1.749
    5    HD1  TYR 755           HD1      TYR 755  47.416 -20.499   3.278
    6    HD2  TYR 755           HD2      TYR 755  51.616 -20.665   3.804
    7    HE1  TYR 755           HE1      TYR 755  47.196 -19.199   5.311
    8    HE2  TYR 755           HE2      TYR 755  51.417 -19.376   5.879
    9    HH   TYR 755           HH       TYR 755  49.812 -17.739   6.860

  No H/Q in entry =           9
  In of MODEL   31
    1    H    THR 756           H        THR 756  48.829 -24.512   2.127
    2    HA   THR 756           HA       THR 756  49.299 -25.361  -0.628
    3    HB   THR 756           HB       THR 756  48.144 -26.770   1.786
    4    HG1  THR 756           HG1      THR 756  50.183 -27.305   2.134
    5   HG23  THR 756          HG21      THR 756  48.173 -28.796   0.410
    6   HG22  THR 756          HG22      THR 756  48.721 -27.831  -0.980
    7   HG21  THR 756          HG23      THR 756  47.125 -27.553  -0.279

  No H/Q in entry =           7
  In of MODEL   31
    1    H    LEU 757           H        LEU 757  47.513 -25.434  -2.072
    2    HA   LEU 757           HA       LEU 757  45.173 -23.955  -1.243
    3    HB2  LEU 757           HB2      LEU 757  45.997 -25.131  -3.904
    4    HB3  LEU 757           HB3      LEU 757  44.401 -24.486  -3.637
    5    HG   LEU 757           HG       LEU 757  45.716 -22.878  -4.808
    6   HD12  LEU 757          HD11      LEU 757  45.528 -20.948  -3.328
    7   HD11  LEU 757          HD12      LEU 757  45.267 -22.033  -1.963
    8   HD13  LEU 757          HD13      LEU 757  44.107 -21.987  -3.292
    9   HD22  LEU 757          HD21      LEU 757  47.970 -23.556  -4.151
   10   HD21  LEU 757          HD22      LEU 757  47.677 -22.986  -2.509
   11   HD23  LEU 757          HD23      LEU 757  47.731 -21.836  -3.843

  No H/Q in entry =          11
  In of MODEL   31
    1    H    THR 758           H        THR 758  43.159 -24.736  -0.933
    2    HA   THR 758           HA       THR 758  42.812 -27.610  -1.227
    3    HB   THR 758           HB       THR 758  41.499 -27.529   0.981
    4    HG1  THR 758           HG1      THR 758  42.388 -24.976   0.850
    5   HG22  THR 758          HG21      THR 758  44.499 -27.135   1.094
    6   HG21  THR 758          HG22      THR 758  43.680 -28.660   0.772
    7   HG23  THR 758          HG23      THR 758  43.513 -27.889   2.346

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLY 759           H        GLY 759  40.342 -28.072  -0.675
    2    HA3  GLY 759           HA2      GLY 759  38.864 -26.674  -2.655
    3    HA2  GLY 759           HA3      GLY 759  38.269 -27.948  -1.593

  No H/Q in entry =           3
  In of MODEL   31
    1    H    ARG 760           H        ARG 760  36.874 -25.635  -2.279
    2    HA   ARG 760           HA       ARG 760  37.139 -23.692  -0.199
    3    HB2  ARG 760           HB2      ARG 760  35.142 -22.627  -1.206
    4    HB3  ARG 760           HB3      ARG 760  36.455 -22.943  -2.331
    5    HG2  ARG 760           HG2      ARG 760  34.469 -23.478  -3.509
    6    HG3  ARG 760           HG3      ARG 760  35.221 -24.998  -2.997
    7    HD2  ARG 760           HD2      ARG 760  32.758 -24.964  -2.707
    8    HD3  ARG 760           HD3      ARG 760  33.691 -25.283  -1.239
    9    HE   ARG 760           HE       ARG 760  33.143 -23.189  -0.410
   10   HH11  ARG 760          HH11      ARG 760  31.474 -23.877  -3.454
   11   HH12  ARG 760          HH12      ARG 760  30.445 -22.539  -3.363
   12   HH21  ARG 760          HH21      ARG 760  31.728 -21.394  -0.222
   13   HH22  ARG 760          HH22      ARG 760  30.604 -21.059  -1.475

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ASP 761           H        ASP 761  35.675 -26.619  -0.292
    2    HA   ASP 761           HA       ASP 761  33.591 -25.985   1.638
    3    HB2  ASP 761           HB2      ASP 761  32.939 -28.312   1.522
    4    HB3  ASP 761           HB3      ASP 761  33.216 -27.714  -0.111

  No H/Q in entry =           4
  In of MODEL   31
    1    H    SER 762           H        SER 762  36.823 -26.541   1.729
    2    HA   SER 762           HA       SER 762  36.954 -28.195   4.024
    3    HB2  SER 762           HB2      SER 762  39.070 -26.531   2.676
    4    HB3  SER 762           HB3      SER 762  39.389 -27.695   3.969
    5    HG   SER 762           HG       SER 762  38.413 -29.262   2.659

  No H/Q in entry =           5
  In of MODEL   31
    1    H    CYS 763           H        CYS 763  36.807 -24.682   3.688
    2    HA   CYS 763           HA       CYS 763  36.530 -24.624   6.566
    3    HB2  CYS 763           HB2      CYS 763  37.963 -22.668   6.858
    4    HB3  CYS 763           HB3      CYS 763  38.887 -23.986   6.147

  No H/Q in entry =           4
  In of MODEL   31
    1    H    THR 764           H        THR 764  35.895 -22.181   7.140
    2    HA   THR 764           HA       THR 764  33.525 -21.745   5.571
    3    HB   THR 764           HB       THR 764  34.465 -20.217   8.004
    4    HG1  THR 764           HG1      THR 764  33.552 -22.803   7.674
    5   HG23  THR 764          HG21      THR 764  32.056 -19.894   8.347
    6   HG22  THR 764          HG22      THR 764  31.712 -20.873   6.921
    7   HG21  THR 764          HG23      THR 764  32.528 -19.320   6.746

  No H/Q in entry =           7
  In of MODEL   31
    1    H    LEU 765           H        LEU 765  33.751 -20.688   3.835
    2    HA   LEU 765           HA       LEU 765  35.772 -18.656   3.498
    3    HB2  LEU 765           HB2      LEU 765  35.027 -20.629   1.931
    4    HB3  LEU 765           HB3      LEU 765  33.727 -19.541   1.511
    5    HG   LEU 765           HG       LEU 765  35.365 -17.901   0.694
    6   HD12  LEU 765          HD11      LEU 765  37.727 -18.642   0.468
    7   HD11  LEU 765          HD12      LEU 765  37.309 -20.075   1.431
    8   HD13  LEU 765          HD13      LEU 765  37.214 -18.481   2.152
    9   HD21  LEU 765          HD21      LEU 765  35.692 -20.678  -0.439
   10   HD23  LEU 765          HD22      LEU 765  36.063 -19.171  -1.273
   11   HD22  LEU 765          HD23      LEU 765  34.396 -19.548  -0.835

  No H/Q in entry =          11
  In of MODEL   31
    1    HA   PRO 766           HA       PRO 766  32.585 -15.501   3.973
    2    HB2  PRO 766           HB2      PRO 766  33.768 -13.370   2.893
    3    HB3  PRO 766           HB3      PRO 766  34.381 -14.087   4.390
    4    HG2  PRO 766           HG2      PRO 766  35.287 -14.477   1.594
    5    HG3  PRO 766           HG3      PRO 766  36.289 -14.107   3.022
    6    HD2  PRO 766           HD2      PRO 766  36.020 -16.633   2.061
    7    HD3  PRO 766           HD3      PRO 766  36.189 -16.315   3.796

  No H/Q in entry =           7
  In of MODEL   31
    1    H    ALA 767           H        ALA 767  31.646 -13.696   2.534
    2    HA   ALA 767           HA       ALA 767  30.029 -13.293   0.967
    3    HB2  ALA 767           HB1      ALA 767  32.118 -12.831  -0.345
    4    HB3  ALA 767           HB2      ALA 767  30.712 -13.293  -1.326
    5    HB1  ALA 767           HB3      ALA 767  31.983 -14.479  -0.968

  No H/Q in entry =           5
  In of MODEL   31
    1    H    SER 768           H        SER 768  29.969 -15.510   2.304
    2    HA   SER 768           HA       SER 768  28.638 -17.376   0.561
    3    HB2  SER 768           HB2      SER 768  29.297 -17.456   3.471
    4    HB3  SER 768           HB3      SER 768  28.553 -18.703   2.450
    5    HG   SER 768           HG       SER 768  31.146 -18.293   2.786

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA 769           H        ALA 769  27.783 -14.666   2.270
    2    HA   ALA 769           HA       ALA 769  25.245 -15.568   3.315
    3    HB3  ALA 769           HB1      ALA 769  24.875 -13.212   3.789
    4    HB1  ALA 769           HB2      ALA 769  26.337 -12.794   2.885
    5    HB2  ALA 769           HB3      ALA 769  26.459 -13.737   4.379

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLU 770           H        GLU 770  23.467 -13.631   2.528
    2    HA   GLU 770           HA       GLU 770  23.203 -14.090  -0.354
    3    HB2  GLU 770           HB2      GLU 770  21.221 -13.037   1.669
    4    HB3  GLU 770           HB3      GLU 770  20.871 -13.489  -0.001
    5    HG2  GLU 770           HG2      GLU 770  21.423 -15.737   0.416
    6    HG3  GLU 770           HG3      GLU 770  21.991 -15.339   2.032

  No H/Q in entry =           6
  In of MODEL   31
    1    H    LYS 771           H        LYS 771  23.808 -12.540  -1.644
    2    HA   LYS 771           HA       LYS 771  24.632 -10.158  -0.370
    3    HB2  LYS 771           HB2      LYS 771  25.259 -11.212  -3.117
    4    HB3  LYS 771           HB3      LYS 771  25.610  -9.573  -2.608
    5    HG2  LYS 771           HG2      LYS 771  27.552 -11.001  -2.356
    6    HG3  LYS 771           HG3      LYS 771  26.967 -10.370  -0.809
    7    HD2  LYS 771           HD2      LYS 771  27.664 -12.684  -0.595
    8    HD3  LYS 771           HD3      LYS 771  25.944 -12.458  -0.315
    9    HE2  LYS 771           HE2      LYS 771  25.293 -13.452  -2.241
   10    HE3  LYS 771           HE3      LYS 771  26.844 -13.245  -3.078
   11    HZ3  LYS 771           HZ1      LYS 771  27.681 -15.048  -1.563
   12    HZ2  LYS 771           HZ2      LYS 771  26.343 -15.504  -2.513
   13    HZ1  LYS 771           HZ3      LYS 771  26.119 -15.112  -0.904

  No H/Q in entry =          13
  In of MODEL   31
    1    H    ALA 772           H        ALA 772  23.452  -8.574  -0.235
    2    HA   ALA 772           HA       ALA 772  21.662  -7.736  -2.442
    3    HB3  ALA 772           HB1      ALA 772  20.351  -6.620  -0.840
    4    HB1  ALA 772           HB2      ALA 772  21.548  -6.898   0.422
    5    HB2  ALA 772           HB3      ALA 772  20.598  -8.260  -0.178

  No H/Q in entry =           5
  In of MODEL   31
    1    H    CYS 773           H        CYS 773  22.912  -6.356  -3.480
    2    HA   CYS 773           HA       CYS 773  23.847  -3.988  -2.226
    3    HB2  CYS 773           HB2      CYS 773  26.259  -4.424  -2.720
    4    HB3  CYS 773           HB3      CYS 773  25.617  -5.247  -1.287

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLY 774           H        GLY 774  25.232  -5.954  -4.796
    2    HA3  GLY 774           HA2      GLY 774  24.742  -5.479  -7.121
    3    HA2  GLY 774           HA3      GLY 774  24.657  -3.772  -6.683

  No H/Q in entry =           3
  In of MODEL   31
    1    H    ALA 775           H        ALA 775  26.917  -4.190  -4.788
    2    HA   ALA 775           HA       ALA 775  29.173  -4.871  -6.431
    3    HB2  ALA 775           HB1      ALA 775  28.816  -2.038  -5.445
    4    HB3  ALA 775           HB2      ALA 775  28.751  -2.562  -7.129
    5    HB1  ALA 775           HB3      ALA 775  30.258  -2.692  -6.223

  No H/Q in entry =           5
  In of MODEL   31
    1    H    CYS 776           H        CYS 776  29.943  -6.275  -4.969
    2    HA   CYS 776           HA       CYS 776  30.989  -5.057  -2.604
    3    HB2  CYS 776           HB2      CYS 776  29.388  -7.644  -2.563
    4    HB3  CYS 776           HB3      CYS 776  30.642  -7.372  -1.343

  No H/Q in entry =           4
  In of MODEL   31
    1    HA   PRO 777           HA       PRO 777  34.314  -7.907  -4.160
    2    HB2  PRO 777           HB2      PRO 777  33.283  -9.877  -6.054
    3    HB3  PRO 777           HB3      PRO 777  34.173 -10.157  -4.555
    4    HG2  PRO 777           HG2      PRO 777  31.573 -10.824  -4.827
    5    HG3  PRO 777           HG3      PRO 777  32.251 -10.282  -3.282
    6    HD2  PRO 777           HD2      PRO 777  30.715  -8.694  -5.322
    7    HD3  PRO 777           HD3      PRO 777  30.505  -8.777  -3.556

  No H/Q in entry =           7
  In of MODEL   31
    1    H    LEU 778           H        LEU 778  35.449  -8.259  -6.308
    2    HA   LEU 778           HA       LEU 778  35.464  -5.954  -7.868
    3    HB2  LEU 778           HB2      LEU 778  36.435  -8.695  -8.650
    4    HB3  LEU 778           HB3      LEU 778  36.858  -7.221  -9.479
    5    HG   LEU 778           HG       LEU 778  38.188  -6.510  -7.495
    6   HD12  LEU 778          HD11      LEU 778  38.660  -8.154  -5.725
    7   HD11  LEU 778          HD12      LEU 778  37.410  -9.214  -6.385
    8   HD13  LEU 778          HD13      LEU 778  36.978  -7.639  -5.717
    9   HD21  LEU 778          HD21      LEU 778  39.235  -7.771  -9.302
   10   HD23  LEU 778          HD22      LEU 778  38.785  -9.271  -8.479
   11   HD22  LEU 778          HD23      LEU 778  39.945  -8.179  -7.730

  No H/Q in entry =          11
  In of MODEL   31
    1    H    TRP 779           H        TRP 779  34.400  -9.109  -8.830
    2    HA   TRP 779           HA       TRP 779  33.245  -8.256 -11.327
    3    HB2  TRP 779           HB2      TRP 779  32.786 -10.754 -11.450
    4    HB3  TRP 779           HB3      TRP 779  34.490 -10.315 -11.281
    5    HD1  TRP 779           HD1      TRP 779  31.619 -11.899  -9.329
    6    HE1  TRP 779           HE1      TRP 779  32.511 -12.963  -7.200
    7    HE3  TRP 779           HE3      TRP 779  36.474 -10.409  -9.670
    8    HZ2  TRP 779           HZ2      TRP 779  34.998 -13.134  -5.814
    9    HZ3  TRP 779           HZ3      TRP 779  38.019 -11.054  -7.898
   10    HH2  TRP 779           HH2      TRP 779  37.291 -12.396  -6.025

  No H/Q in entry =          10
  In of MODEL   31
    1    H    GLY 780           H        GLY 780  32.177  -7.824  -8.356
    2    HA3  GLY 780           HA2      GLY 780  30.079  -7.503  -7.476
    3    HA2  GLY 780           HA3      GLY 780  29.391  -8.107  -8.987

  No H/Q in entry =           3
  In of MODEL   31
    1    H    LYS 781           H        LYS 781  27.954  -9.408  -7.786
    2    HA   LYS 781           HA       LYS 781  28.959 -12.041  -7.370
    3    HB2  LYS 781           HB2      LYS 781  29.333 -10.750  -5.134
    4    HB3  LYS 781           HB3      LYS 781  27.581 -10.822  -5.008
    5    HG2  LYS 781           HG2      LYS 781  28.636 -12.649  -3.763
    6    HG3  LYS 781           HG3      LYS 781  27.649 -13.275  -5.097
    7    HD2  LYS 781           HD2      LYS 781  29.684 -13.567  -6.447
    8    HD3  LYS 781           HD3      LYS 781  30.656 -12.900  -5.140
    9    HE2  LYS 781           HE2      LYS 781  30.847 -15.254  -5.180
   10    HE3  LYS 781           HE3      LYS 781  29.946 -14.794  -3.728
   11    HZ1  LYS 781           HZ1      LYS 781  27.874 -15.424  -4.986
   12    HZ3  LYS 781           HZ2      LYS 781  28.899 -16.694  -4.709
   13    HZ2  LYS 781           HZ3      LYS 781  28.840 -16.007  -6.234

  No H/Q in entry =          13
  In of MODEL   31
    1    H    CYS 782           H        CYS 782  27.255 -13.408  -7.885
    2    HA   CYS 782           HA       CYS 782  24.613 -12.238  -7.736
    3    HB2  CYS 782           HB2      CYS 782  25.501 -11.688  -9.957
    4    HB3  CYS 782           HB3      CYS 782  25.753 -13.401 -10.289

  No H/Q in entry =           4
  In of MODEL   31
    1    H    ASP 783           H        ASP 783  23.928 -13.600  -6.235
    2    HA   ASP 783           HA       ASP 783  23.004 -16.100  -6.993
    3    HB2  ASP 783           HB2      ASP 783  24.171 -17.495  -5.310
    4    HB3  ASP 783           HB3      ASP 783  25.319 -16.856  -6.472

  No H/Q in entry =           4
  In of MODEL   31
    1    H    ALA 784           H        ALA 784  21.530 -16.846  -5.454
    2    HA   ALA 784           HA       ALA 784  19.804 -16.593  -4.085
    3    HB3  ALA 784           HB1      ALA 784  21.475 -16.450  -2.261
    4    HB2  ALA 784           HB2      ALA 784  20.064 -15.448  -1.921
    5    HB1  ALA 784           HB3      ALA 784  21.561 -14.702  -2.484

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLU 785           H        GLU 785  19.225 -15.526  -6.190
    2    HA   GLU 785           HA       GLU 785  18.929 -12.730  -6.019
    3    HB2  GLU 785           HB2      GLU 785  17.644 -13.021  -8.277
    4    HB3  GLU 785           HB3      GLU 785  19.383 -13.151  -8.207
    5    HG2  GLU 785           HG2      GLU 785  18.598 -14.869  -9.637
    6    HG3  GLU 785           HG3      GLU 785  19.101 -15.646  -8.151

  No H/Q in entry =           6
  In of MODEL   31
    1    H    SER 786           H        SER 786  17.864 -12.346  -4.408
    2    HA   SER 786           HA       SER 786  14.999 -12.142  -4.785
    3    HB2  SER 786           HB2      SER 786  16.260 -13.097  -2.185
    4    HB3  SER 786           HB3      SER 786  14.539 -12.829  -2.461
    5    HG   SER 786           HG       SER 786  15.766 -14.490  -4.265

  No H/Q in entry =           5
  In of MODEL   31
    1    H    SER 787           H        SER 787  17.813 -11.509  -2.736
    2    HA   SER 787           HA       SER 787  17.107  -8.722  -2.540
    3    HB2  SER 787           HB2      SER 787  19.556 -10.248  -1.587
    4    HB3  SER 787           HB3      SER 787  19.059  -8.600  -1.157
    5    HG   SER 787           HG       SER 787  17.454  -9.323   0.019

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LYS 788           H        LYS 788  19.161  -7.184  -3.280
    2    HA   LYS 788           HA       LYS 788  19.474  -8.247  -5.917
    3    HB2  LYS 788           HB2      LYS 788  18.365  -6.071  -5.770
    4    HB3  LYS 788           HB3      LYS 788  19.844  -5.371  -5.122
    5    HG2  LYS 788           HG2      LYS 788  19.615  -4.845  -7.483
    6    HG3  LYS 788           HG3      LYS 788  21.005  -5.899  -7.218
    7    HD2  LYS 788           HD2      LYS 788  19.650  -7.843  -7.891
    8    HD3  LYS 788           HD3      LYS 788  18.275  -6.780  -8.184
    9    HE2  LYS 788           HE2      LYS 788  20.931  -6.601  -9.601
   10    HE3  LYS 788           HE3      LYS 788  19.516  -7.432 -10.238
   11    HZ3  LYS 788           HZ1      LYS 788  18.336  -5.350 -10.264
   12    HZ2  LYS 788           HZ2      LYS 788  19.779  -5.185 -11.122
   13    HZ1  LYS 788           HZ3      LYS 788  19.637  -4.547  -9.572

  No H/Q in entry =          13
  In of MODEL   31
    1    H    CYS 789           H        CYS 789  21.018  -9.318  -6.232
    2    HA   CYS 789           HA       CYS 789  23.759  -8.485  -5.657
    3    HB2  CYS 789           HB2      CYS 789  24.277 -10.852  -6.249
    4    HB3  CYS 789           HB3      CYS 789  23.160 -10.727  -4.900

  No H/Q in entry =           4
  In of MODEL   31
    1    H    VAL 790           H        VAL 790  25.284  -8.563  -7.507
    2    HA   VAL 790           HA       VAL 790  24.058  -8.360 -10.143
    3    HB   VAL 790           HB       VAL 790  25.601  -6.101  -8.838
    4   HG11  VAL 790          HG11      VAL 790  26.446  -6.442 -11.069
    5   HG13  VAL 790          HG12      VAL 790  25.571  -4.912 -10.950
    6   HG12  VAL 790          HG13      VAL 790  24.817  -6.303 -11.743
    7   HG21  VAL 790          HG21      VAL 790  23.203  -6.136  -8.398
    8   HG23  VAL 790          HG22      VAL 790  22.891  -6.128 -10.141
    9   HG22  VAL 790          HG23      VAL 790  23.664  -4.736  -9.368

  No H/Q in entry =           9
  In of MODEL   31
    1    H    CYS 791           H        CYS 791  25.449  -8.942 -11.723
    2    HA   CYS 791           HA       CYS 791  28.205  -9.574 -10.950
    3    HB2  CYS 791           HB2      CYS 791  28.118 -11.326 -12.742
    4    HB3  CYS 791           HB3      CYS 791  27.051 -11.608 -11.385

  No H/Q in entry =           4
  In of MODEL   31
    1    H    ARG 792           H        ARG 792  29.718  -8.513 -11.918
    2    HA   ARG 792           HA       ARG 792  29.089  -6.771 -14.199
    3    HB2  ARG 792           HB2      ARG 792  31.577  -6.890 -12.455
    4    HB3  ARG 792           HB3      ARG 792  31.151  -5.614 -13.584
    5    HG2  ARG 792           HG2      ARG 792  29.333  -4.900 -12.194
    6    HG3  ARG 792           HG3      ARG 792  29.550  -6.283 -11.123
    7    HD2  ARG 792           HD2      ARG 792  30.515  -4.383 -10.049
    8    HD3  ARG 792           HD3      ARG 792  31.832  -5.413 -10.594
    9    HE   ARG 792           HE       ARG 792  31.056  -3.254 -12.354
   10   HH11  ARG 792          HH11      ARG 792  33.408  -4.499 -10.020
   11   HH12  ARG 792          HH12      ARG 792  34.484  -3.213 -10.132
   12   HH21  ARG 792          HH21      ARG 792  32.550  -1.412 -12.548
   13   HH22  ARG 792          HH22      ARG 792  33.971  -1.384 -11.613

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLU 793           H        GLU 793  30.330  -7.062 -16.156
    2    HA   GLU 793           HA       GLU 793  31.308  -9.741 -16.466
    3    HB2  GLU 793           HB2      GLU 793  31.220  -7.410 -18.374
    4    HB3  GLU 793           HB3      GLU 793  31.774  -9.017 -18.813
    5    HG2  GLU 793           HG2      GLU 793  29.007  -8.365 -17.815
    6    HG3  GLU 793           HG3      GLU 793  29.448  -8.529 -19.511

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ALA 794           H        ALA 794  33.427  -9.994 -17.754
    2    HA   ALA 794           HA       ALA 794  35.490  -9.421 -15.917
    3    HB2  ALA 794           HB1      ALA 794  35.339 -11.437 -17.329
    4    HB3  ALA 794           HB2      ALA 794  36.902 -10.619 -17.416
    5    HB1  ALA 794           HB3      ALA 794  35.743 -10.439 -18.728

  No H/Q in entry =           5
  In of MODEL   31
    1    H    SER 795           H        SER 795  34.430  -7.826 -18.825
    2    HA   SER 795           HA       SER 795  36.878  -6.406 -19.020
    3    HB2  SER 795           HB2      SER 795  35.309  -5.287 -20.903
    4    HB3  SER 795           HB3      SER 795  36.210  -6.790 -21.146
    5    HG   SER 795           HG       SER 795  34.438  -7.833 -21.226

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLU 796           H        GLU 796  34.438  -6.077 -16.944
    2    HA   GLU 796           HA       GLU 796  34.302  -3.148 -17.082
    3    HB2  GLU 796           HB2      GLU 796  32.652  -5.153 -15.564
    4    HB3  GLU 796           HB3      GLU 796  32.468  -3.411 -15.428
    5    HG2  GLU 796           HG2      GLU 796  31.824  -3.280 -17.754
    6    HG3  GLU 796           HG3      GLU 796  32.105  -5.011 -17.942

  No H/Q in entry =           6
  In of MODEL   31
    1    H    CYS 797           H        CYS 797  36.032  -5.603 -15.513
    2    HA   CYS 797           HA       CYS 797  36.741  -3.793 -13.389
    3    HB2  CYS 797           HB2      CYS 797  36.346  -5.575 -11.708
    4    HB3  CYS 797           HB3      CYS 797  34.864  -4.951 -12.453

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLU 798           H        GLU 798  38.694  -4.382 -12.399
    2    HA   GLU 798           HA       GLU 798  39.958  -6.879 -12.958
    3    HB2  GLU 798           HB2      GLU 798  42.045  -5.995 -13.879
    4    HB3  GLU 798           HB3      GLU 798  40.705  -5.616 -14.947
    5    HG2  GLU 798           HG2      GLU 798  40.688  -3.328 -14.065
    6    HG3  GLU 798           HG3      GLU 798  42.034  -3.736 -13.016

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU 799           H        GLU 799  40.096  -3.668 -11.535
    2    HA   GLU 799           HA       GLU 799  40.812  -2.838  -9.620
    3    HB2  GLU 799           HB2      GLU 799  39.212  -4.444  -8.667
    4    HB3  GLU 799           HB3      GLU 799  40.442  -5.688  -8.638
    5    HG2  GLU 799           HG2      GLU 799  40.036  -4.797  -6.425
    6    HG3  GLU 799           HG3      GLU 799  41.674  -4.450  -6.972

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLU 800           H        GLU 800  42.411  -5.808  -8.678
    2    HA   GLU 800           HA       GLU 800  44.924  -5.023  -9.863
    3    HB2  GLU 800           HB2      GLU 800  46.156  -5.194  -7.780
    4    HB3  GLU 800           HB3      GLU 800  44.998  -3.871  -7.680
    5    HG2  GLU 800           HG2      GLU 800  43.561  -5.229  -6.265
    6    HG3  GLU 800           HG3      GLU 800  44.633  -6.615  -6.466

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLY 801           H        GLY 801  42.750  -7.117  -9.846
    2    HA3  GLY 801           HA2      GLY 801  43.569  -9.361  -8.500
    3    HA2  GLY 801           HA3      GLY 801  42.438  -9.320  -9.842

  No H/Q in entry =           3
  In of MODEL   31
    1    H    PHE 802           H        PHE 802  44.138 -11.383  -9.373
    2    HA   PHE 802           HA       PHE 802  46.519 -11.109 -11.004
    3    HB2  PHE 802           HB2      PHE 802  45.477 -13.241  -9.176
    4    HB3  PHE 802           HB3      PHE 802  46.997 -13.397 -10.033
    5    HD1  PHE 802           HD1      PHE 802  48.920 -12.180  -9.322
    6    HD2  PHE 802           HD2      PHE 802  45.154 -11.507  -7.514
    7    HE1  PHE 802           HE1      PHE 802  49.965 -10.856  -7.598
    8    HE2  PHE 802           HE2      PHE 802  46.181 -10.207  -5.807
    9    HZ   PHE 802           HZ       PHE 802  48.626  -9.864  -5.800

  No H/Q in entry =           9
  In of MODEL   31
    1    H    SER 803           H        SER 803  46.930 -13.533 -11.875
    2    HA   SER 803           HA       SER 803  44.719 -14.173 -13.665
    3    HB2  SER 803           HB2      SER 803  47.673 -14.767 -14.065
    4    HB3  SER 803           HB3      SER 803  46.353 -14.914 -15.235
    5    HG   SER 803           HG       SER 803  46.092 -12.584 -14.949

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ILE 804           H        ILE 804  43.962 -16.265 -13.434
    2    HA   ILE 804           HA       ILE 804  45.533 -18.078 -11.763
    3    HB   ILE 804           HB       ILE 804  43.635 -18.828 -10.475
    4   HG12  ILE 804          HG12      ILE 804  41.857 -18.497 -12.232
    5   HG13  ILE 804          HG13      ILE 804  41.377 -17.971 -10.628
    6   HG23  ILE 804          HG21      ILE 804  43.074 -16.815  -9.170
    7   HG22  ILE 804          HG22      ILE 804  43.753 -15.828 -10.467
    8   HG21  ILE 804          HG23      ILE 804  44.795 -16.921  -9.556
    9   HD13  ILE 804          HD11      ILE 804  40.591 -16.423 -12.292
   10   HD12  ILE 804          HD12      ILE 804  42.222 -16.217 -12.924
   11   HD11  ILE 804          HD13      ILE 804  41.831 -15.652 -11.301

  No H/Q in entry =          11
  In of MODEL   31
    1    H    CYS 805           H        CYS 805  44.511 -20.372 -11.855
    2    HA   CYS 805           HA       CYS 805  44.065 -20.931 -14.701
    3    HB2  CYS 805           HB2      CYS 805  46.091 -21.907 -13.716
    4    HB3  CYS 805           HB3      CYS 805  45.124 -22.649 -12.451

  No H/Q in entry =           4
  In of MODEL   31
    1    H    VAL 806           H        VAL 806  42.130 -21.620 -15.268
    2    HA   VAL 806           HA       VAL 806  40.431 -22.831 -13.221
    3    HB   VAL 806           HB       VAL 806  39.561 -20.923 -15.356
    4   HG11  VAL 806          HG11      VAL 806  38.024 -22.171 -13.086
    5   HG13  VAL 806          HG12      VAL 806  37.789 -22.429 -14.812
    6   HG12  VAL 806          HG13      VAL 806  37.444 -20.846 -14.094
    7   HG21  VAL 806          HG21      VAL 806  39.882 -20.374 -12.411
    8   HG23  VAL 806          HG22      VAL 806  39.109 -19.290 -13.579
    9   HG22  VAL 806          HG23      VAL 806  40.818 -19.680 -13.740

  No H/Q in entry =           9
  In of MODEL   31
    1    H    GLU 807           H        GLU 807  39.484 -24.635 -13.848
    2    HA   GLU 807           HA       GLU 807  39.933 -25.661 -16.494
    3    HB2  GLU 807           HB2      GLU 807  40.120 -27.100 -14.487
    4    HB3  GLU 807           HB3      GLU 807  38.430 -26.808 -14.133
    5    HG2  GLU 807           HG2      GLU 807  37.818 -27.906 -16.244
    6    HG3  GLU 807           HG3      GLU 807  39.527 -28.234 -16.539

  No H/Q in entry =           6
  In of MODEL   31
    1    H    VAL 808           H        VAL 808  38.678 -25.218 -18.024
    2    HA   VAL 808           HA       VAL 808  35.811 -24.923 -17.687
    3    HB   VAL 808           HB       VAL 808  36.659 -22.665 -17.679
    4   HG12  VAL 808          HG11      VAL 808  37.975 -21.706 -19.532
    5   HG11  VAL 808          HG12      VAL 808  38.144 -23.330 -20.204
    6   HG13  VAL 808          HG13      VAL 808  38.841 -22.954 -18.632
    7   HG23  VAL 808          HG21      VAL 808  35.611 -21.718 -19.702
    8   HG22  VAL 808          HG22      VAL 808  34.612 -22.915 -18.878
    9   HG21  VAL 808          HG23      VAL 808  35.488 -23.354 -20.355

  No H/Q in entry =           9
  In of MODEL   31
    1    H    ASN 809           H        ASN 809  34.816 -26.153 -19.178
    2    HA   ASN 809           HA       ASN 809  34.436 -27.460 -21.013
    3    HB2  ASN 809           HB2      ASN 809  36.513 -25.602 -21.978
    4    HB3  ASN 809           HB3      ASN 809  36.102 -26.953 -23.056
    5   HD21  ASN 809          HD21      ASN 809  33.986 -25.030 -20.935
    6   HD22  ASN 809          HD22      ASN 809  33.072 -24.318 -22.206

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLY 810           H        GLY 810  36.506 -28.032 -18.911
    2    HA3  GLY 810           HA2      GLY 810  37.569 -30.080 -18.429
    3    HA2  GLY 810           HA3      GLY 810  37.536 -30.438 -20.156

  No H/Q in entry =           3
  In of MODEL   31
    1    H    LYS 811           H        LYS 811  38.635 -27.440 -20.139
    2    HA   LYS 811           HA       LYS 811  41.432 -28.342 -20.087
    3    HB2  LYS 811           HB2      LYS 811  40.112 -26.120 -21.620
    4    HB3  LYS 811           HB3      LYS 811  41.830 -26.493 -21.643
    5    HG2  LYS 811           HG2      LYS 811  41.388 -28.636 -22.663
    6    HG3  LYS 811           HG3      LYS 811  39.653 -28.366 -22.531
    7    HD2  LYS 811           HD2      LYS 811  40.505 -27.940 -24.795
    8    HD3  LYS 811           HD3      LYS 811  39.782 -26.508 -24.064
    9    HE2  LYS 811           HE2      LYS 811  41.984 -25.637 -23.533
   10    HE3  LYS 811           HE3      LYS 811  42.750 -27.098 -24.149
   11    HZ2  LYS 811           HZ1      LYS 811  41.170 -25.137 -25.737
   12    HZ1  LYS 811           HZ2      LYS 811  41.846 -26.553 -26.340
   13    HZ3  LYS 811           HZ3      LYS 811  42.840 -25.325 -25.780

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLU 812           H        GLU 812  42.950 -26.975 -19.148
    2    HA   GLU 812           HA       GLU 812  41.769 -25.093 -17.280
    3    HB2  GLU 812           HB2      GLU 812  44.402 -26.551 -17.275
    4    HB3  GLU 812           HB3      GLU 812  44.074 -25.208 -16.183
    5    HG2  GLU 812           HG2      GLU 812  42.209 -26.383 -15.217
    6    HG3  GLU 812           HG3      GLU 812  42.388 -27.687 -16.382

  No H/Q in entry =           6
  In of MODEL   31
    1    H    GLN 813           H        GLN 813  41.619 -23.175 -17.919
    2    HA   GLN 813           HA       GLN 813  43.672 -22.009 -19.664
    3    HB2  GLN 813           HB2      GLN 813  41.626 -22.093 -20.862
    4    HB3  GLN 813           HB3      GLN 813  40.692 -21.581 -19.464
    5    HG2  GLN 813           HG2      GLN 813  41.571 -19.359 -19.645
    6    HG3  GLN 813           HG3      GLN 813  42.647 -19.841 -20.963
    7   HE21  GLN 813          HE21      GLN 813  39.340 -20.961 -20.718
    8   HE22  GLN 813          HE22      GLN 813  38.740 -20.045 -22.043

  No H/Q in entry =           8
  In of MODEL   31
    1    H    THR 814           H        THR 814  44.538 -20.006 -19.099
    2    HA   THR 814           HA       THR 814  44.294 -19.227 -16.362
    3    HB   THR 814           HB       THR 814  45.659 -17.808 -18.640
    4    HG1  THR 814           HG1      THR 814  47.564 -18.871 -17.880
    5   HG23  THR 814          HG21      THR 814  47.062 -16.816 -16.900
    6   HG22  THR 814          HG22      THR 814  46.157 -17.708 -15.684
    7   HG21  THR 814          HG23      THR 814  45.350 -16.447 -16.632

  No H/Q in entry =           7
  In of MODEL   31
    1    H    MET 815           H        MET 815  42.931 -17.720 -15.651
    2    HA   MET 815           HA       MET 815  41.711 -15.919 -17.633
    3    HB2  MET 815           HB2      MET 815  40.364 -16.859 -15.112
    4    HB3  MET 815           HB3      MET 815  39.658 -15.895 -16.396
    5    HG2  MET 815           HG2      MET 815  40.175 -17.993 -17.865
    6    HG3  MET 815           HG3      MET 815  40.321 -18.744 -16.283
    7    HE3  MET 815           HE1      MET 815  38.286 -19.567 -18.573
    8    HE2  MET 815           HE2      MET 815  36.906 -20.039 -17.564
    9    HE1  MET 815           HE3      MET 815  38.561 -20.443 -17.078

  No H/Q in entry =           9
  In of MODEL   31
    1    H    SER 816           H        SER 816  41.090 -13.921 -16.738
    2    HA   SER 816           HA       SER 816  42.926 -12.916 -14.768
    3    HB2  SER 816           HB2      SER 816  40.386 -11.581 -15.715
    4    HB3  SER 816           HB3      SER 816  41.874 -10.832 -15.141
    5    HG   SER 816           HG       SER 816  42.585 -12.290 -17.178

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLU 817           H        GLU 817  42.256 -12.177 -12.707
    2    HA   GLU 817           HA       GLU 817  40.710 -13.949 -11.223
    3    HB2  GLU 817           HB2      GLU 817  42.574 -12.318 -10.621
    4    HB3  GLU 817           HB3      GLU 817  41.302 -11.119 -10.589
    5    HG2  GLU 817           HG2      GLU 817  40.217 -12.114  -8.808
    6    HG3  GLU 817           HG3      GLU 817  41.248 -13.560  -8.872

  No H/Q in entry =           6
  In of MODEL   31
    1    H    CYS 818           H        CYS 818  40.055 -10.727 -12.453
    2    HA   CYS 818           HA       CYS 818  37.426 -10.427 -11.471
    3    HB2  CYS 818           HB2      CYS 818  37.280  -8.671 -13.231
    4    HB3  CYS 818           HB3      CYS 818  38.711  -8.543 -12.210

  No H/Q in entry =           4
  In of MODEL   31
    1    H    GLU 819           H        GLU 819  38.756 -12.099 -14.151
    2    HA   GLU 819           HA       GLU 819  36.372 -12.212 -15.727
    3    HB2  GLU 819           HB2      GLU 819  38.609 -12.117 -16.700
    4    HB3  GLU 819           HB3      GLU 819  38.988 -13.660 -15.961
    5    HG2  GLU 819           HG2      GLU 819  37.438 -14.784 -17.372
    6    HG3  GLU 819           HG3      GLU 819  36.840 -13.227 -17.975

  No H/Q in entry =           6
  In of MODEL   31
    1    H    ALA 820           H        ALA 820  38.382 -14.673 -14.111
    2    HA   ALA 820           HA       ALA 820  36.663 -16.790 -14.427
    3    HB2  ALA 820           HB1      ALA 820  37.843 -17.843 -12.551
    4    HB3  ALA 820           HB2      ALA 820  38.538 -16.278 -12.134
    5    HB1  ALA 820           HB3      ALA 820  38.951 -17.047 -13.671

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLY 821           H        GLY 821  36.870 -14.302 -11.960
    2    HA3  GLY 821           HA2      GLY 821  34.981 -15.331 -10.139
    3    HA2  GLY 821           HA3      GLY 821  35.513 -13.656 -10.252

  No H/Q in entry =           3
  In of MODEL   31
    1    H    ALA 822           H        ALA 822  34.701 -13.017 -12.835
    2    HA   ALA 822           HA       ALA 822  31.981 -12.489 -12.340
    3    HB1  ALA 822           HB1      ALA 822  33.450 -10.994 -13.642
    4    HB3  ALA 822           HB2      ALA 822  31.884 -11.373 -14.347
    5    HB2  ALA 822           HB3      ALA 822  33.350 -12.154 -14.990

  No H/Q in entry =           5
  In of MODEL   31
    1    H    LEU 823           H        LEU 823  33.602 -14.817 -14.435
    2    HA   LEU 823           HA       LEU 823  31.290 -15.767 -15.679
    3    HB2  LEU 823           HB2      LEU 823  33.970 -16.871 -15.123
    4    HB3  LEU 823           HB3      LEU 823  32.727 -18.033 -15.496
    5    HG   LEU 823           HG       LEU 823  32.293 -16.803 -17.627
    6   HD13  LEU 823          HD11      LEU 823  33.959 -15.280 -18.494
    7   HD12  LEU 823          HD12      LEU 823  34.791 -15.285 -16.936
    8   HD11  LEU 823          HD13      LEU 823  33.154 -14.630 -17.065
    9   HD21  LEU 823          HD21      LEU 823  33.580 -18.783 -17.535
   10   HD23  LEU 823          HD22      LEU 823  35.058 -17.859 -17.196
   11   HD22  LEU 823          HD23      LEU 823  34.234 -17.695 -18.765

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ARG 824           H        ARG 824  32.605 -16.412 -12.543
    2    HA   ARG 824           HA       ARG 824  30.866 -18.596 -11.883
    3    HB2  ARG 824           HB2      ARG 824  33.181 -18.114 -10.944
    4    HB3  ARG 824           HB3      ARG 824  32.447 -16.818 -10.027
    5    HG2  ARG 824           HG2      ARG 824  31.125 -18.342  -8.773
    6    HG3  ARG 824           HG3      ARG 824  31.615 -19.693  -9.799
    7    HD2  ARG 824           HD2      ARG 824  32.930 -19.832  -7.814
    8    HD3  ARG 824           HD3      ARG 824  33.944 -19.294  -9.114
    9    HE   ARG 824           HE       ARG 824  34.009 -17.123  -8.271
   10   HH11  ARG 824          HH11      ARG 824  32.154 -19.196  -6.094
   11   HH12  ARG 824          HH12      ARG 824  32.581 -18.400  -4.667
   12   HH21  ARG 824          HH21      ARG 824  34.658 -15.953  -6.209
   13   HH22  ARG 824          HH22      ARG 824  34.090 -16.550  -4.739

  No H/Q in entry =          13
  In of MODEL   31
    1    H    CYS 825           H        CYS 825  30.445 -15.327 -12.104
    2    HA   CYS 825           HA       CYS 825  28.188 -15.326 -10.249
    3    HB2  CYS 825           HB2      CYS 825  30.002 -13.217 -11.262
    4    HB3  CYS 825           HB3      CYS 825  28.421 -12.779 -10.649

  No H/Q in entry =           4
  In of MODEL   31
    1    H    ARG 826           H        ARG 826  29.131 -14.619 -13.494
    2    HA   ARG 826           HA       ARG 826  26.652 -13.685 -14.425
    3    HB2  ARG 826           HB2      ARG 826  28.258 -13.009 -15.829
    4    HB3  ARG 826           HB3      ARG 826  29.301 -14.372 -15.458
    5    HG2  ARG 826           HG2      ARG 826  28.013 -15.729 -17.007
    6    HG3  ARG 826           HG3      ARG 826  26.995 -14.336 -17.380
    7    HD2  ARG 826           HD2      ARG 826  28.787 -13.158 -18.337
    8    HD3  ARG 826           HD3      ARG 826  29.979 -14.262 -17.652
    9    HE   ARG 826           HE       ARG 826  28.375 -15.802 -19.161
   10   HH11  ARG 826          HH11      ARG 826  30.193 -12.826 -19.877
   11   HH12  ARG 826          HH12      ARG 826  30.781 -13.353 -21.373
   12   HH21  ARG 826          HH21      ARG 826  29.167 -16.537 -21.292
   13   HH22  ARG 826          HH22      ARG 826  30.165 -15.525 -22.203

  No H/Q in entry =          13
  In of MODEL   31
    1    H    GLY 827           H        GLY 827  28.012 -16.862 -14.056
    2    HA3  GLY 827           HA2      GLY 827  26.234 -18.618 -13.838
    3    HA2  GLY 827           HA3      GLY 827  25.516 -17.884 -15.263

  No H/Q in entry =           3
  In of MODEL   31
    1    H    GLN 828           H        GLN 828  28.944 -18.245 -15.259
    2    HA   GLN 828           HA       GLN 828  28.716 -20.373 -17.219
    3    HB2  GLN 828           HB2      GLN 828  30.124 -18.361 -17.634
    4    HB3  GLN 828           HB3      GLN 828  31.130 -18.847 -16.277
    5    HG2  GLN 828           HG2      GLN 828  32.029 -19.437 -18.503
    6    HG3  GLN 828           HG3      GLN 828  31.841 -20.824 -17.419
    7   HE21  GLN 828          HE21      GLN 828  30.693 -19.233 -20.268
    8   HE22  GLN 828          HE22      GLN 828  29.738 -20.547 -20.843

  No H/Q in entry =           8
  In of MODEL   31
    1    H    SER 829           H        SER 829  29.795 -22.370 -16.943
    2    HA   SER 829           HA       SER 829  30.177 -23.165 -14.169
    3    HB2  SER 829           HB2      SER 829  30.123 -24.810 -16.710
    4    HB3  SER 829           HB3      SER 829  30.164 -25.456 -15.066
    5    HG   SER 829           HG       SER 829  28.106 -24.125 -16.427

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ILE 830           H        ILE 830  32.143 -23.018 -13.336
    2    HA   ILE 830           HA       ILE 830  34.520 -23.556 -14.951
    3    HB   ILE 830           HB       ILE 830  35.699 -21.645 -14.073
    4   HG12  ILE 830          HG12      ILE 830  34.335 -21.378 -11.975
    5   HG13  ILE 830          HG13      ILE 830  34.720 -19.838 -12.671
    6   HG21  ILE 830          HG21      ILE 830  34.725 -21.338 -16.229
    7   HG23  ILE 830          HG22      ILE 830  34.660 -19.811 -15.349
    8   HG22  ILE 830          HG23      ILE 830  33.208 -20.797 -15.513
    9   HD11  ILE 830          HD11      ILE 830  32.099 -21.308 -12.802
   10   HD13  ILE 830          HD12      ILE 830  32.435 -19.789 -13.631
   11   HD12  ILE 830          HD13      ILE 830  32.484 -19.869 -11.869

  No H/Q in entry =          11
  In of MODEL   31
    1    H    SER 831           H        SER 831  36.289 -24.228 -13.733
    2    HA   SER 831           HA       SER 831  35.807 -24.584 -10.879
    3    HB2  SER 831           HB2      SER 831  37.031 -26.461 -12.866
    4    HB3  SER 831           HB3      SER 831  36.978 -26.701 -11.121
    5    HG   SER 831           HG       SER 831  34.536 -26.127 -12.244

  No H/Q in entry =           5
  In of MODEL   31
    1    H    VAL 832           H        VAL 832  37.290 -23.053 -10.059
    2    HA   VAL 832           HA       VAL 832  39.759 -22.635 -11.418
    3    HB   VAL 832           HB       VAL 832  38.871 -20.720 -10.239
    4   HG12  VAL 832          HG11      VAL 832  39.111 -22.282  -7.677
    5   HG11  VAL 832          HG12      VAL 832  37.613 -21.794  -8.471
    6   HG13  VAL 832          HG13      VAL 832  38.691 -20.575  -7.796
    7   HG23  VAL 832          HG21      VAL 832  41.370 -21.693  -8.862
    8   HG22  VAL 832          HG22      VAL 832  40.802 -20.023  -8.871
    9   HG21  VAL 832          HG23      VAL 832  41.287 -20.798 -10.379

  No H/Q in entry =           9
  In of MODEL   31
    1    H    THR 833           H        THR 833  41.342 -23.975 -11.451
    2    HA   THR 833           HA       THR 833  41.381 -26.106  -9.547
    3    HB   THR 833           HB       THR 833  43.358 -26.884 -10.957
    4    HG1  THR 833           HG1      THR 833  43.666 -25.802 -12.908
    5   HG22  THR 833          HG21      THR 833  41.914 -27.542 -12.837
    6   HG21  THR 833          HG22      THR 833  40.717 -26.350 -12.331
    7   HG23  THR 833          HG23      THR 833  41.078 -27.729 -11.295

  No H/Q in entry =           7
  In of MODEL   31
    1    H    SER 834           H        SER 834  43.326 -23.301 -10.283
    2    HA   SER 834           HA       SER 834  44.471 -23.414  -7.661
    3    HB2  SER 834           HB2      SER 834  46.251 -23.722 -10.093
    4    HB3  SER 834           HB3      SER 834  46.841 -23.325  -8.481
    5    HG   SER 834           HG       SER 834  45.188 -25.531  -8.627

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ILE 835           H        ILE 835  45.532 -21.464  -7.092
    2    HA   ILE 835           HA       ILE 835  44.412 -19.246  -8.487
    3    HB   ILE 835           HB       ILE 835  45.327 -17.861  -6.623
    4   HG12  ILE 835          HG12      ILE 835  45.973 -19.280  -4.540
    5   HG13  ILE 835          HG13      ILE 835  46.424 -20.514  -5.706
    6   HG22  ILE 835          HG21      ILE 835  43.710 -20.253  -5.848
    7   HG21  ILE 835          HG22      ILE 835  43.103 -18.748  -6.547
    8   HG23  ILE 835          HG23      ILE 835  43.830 -18.752  -4.931
    9   HD11  ILE 835          HD11      ILE 835  47.526 -17.741  -5.531
   10   HD13  ILE 835          HD12      ILE 835  48.048 -18.977  -6.685
   11   HD12  ILE 835          HD13      ILE 835  48.324 -19.201  -4.944

  No H/Q in entry =          11
  In of MODEL   31
    1    H    ARG 836           H        ARG 836  46.873 -20.928  -9.274
    2    HA   ARG 836           HA       ARG 836  48.838 -18.834  -9.877
    3    HB2  ARG 836           HB2      ARG 836  48.925 -21.852 -10.184
    4    HB3  ARG 836           HB3      ARG 836  50.254 -20.752 -10.512
    5    HG2  ARG 836           HG2      ARG 836  49.004 -20.971  -7.795
    6    HG3  ARG 836           HG3      ARG 836  50.291 -22.048  -8.323
    7    HD2  ARG 836           HD2      ARG 836  50.485 -19.040  -8.289
    8    HD3  ARG 836           HD3      ARG 836  51.080 -20.095  -7.005
    9    HE   ARG 836           HE       ARG 836  52.116 -20.004  -9.763
   10   HH11  ARG 836          HH11      ARG 836  52.612 -20.695  -6.328
   11   HH12  ARG 836          HH12      ARG 836  54.239 -21.129  -6.498
   12   HH21  ARG 836          HH21      ARG 836  54.368 -20.596  -9.997
   13   HH22  ARG 836          HH22      ARG 836  55.253 -21.099  -8.626

  No H/Q in entry =          13
  In of MODEL   31
    1    HA   PRO 837           HA       PRO 837  47.061 -18.989 -14.028
    2    HB2  PRO 837           HB2      PRO 837  49.147 -17.859 -15.392
    3    HB3  PRO 837           HB3      PRO 837  47.969 -16.920 -14.476
    4    HG2  PRO 837           HG2      PRO 837  50.734 -17.723 -13.736
    5    HG3  PRO 837           HG3      PRO 837  49.870 -16.218 -13.388
    6    HD2  PRO 837           HD2      PRO 837  50.240 -18.229 -11.576
    7    HD3  PRO 837           HD3      PRO 837  48.883 -17.090 -11.516

  No H/Q in entry =           7
  In of MODEL   31
    1    H    CYS 838           H        CYS 838  47.328 -20.315 -15.931
    2    HA   CYS 838           HA       CYS 838  49.255 -22.393 -15.404
    3    HB2  CYS 838           HB2      CYS 838  47.888 -23.699 -17.105
    4    HB3  CYS 838           HB3      CYS 838  47.072 -23.347 -15.601

  No H/Q in entry =           4
  In of MODEL   31
    1    H    ALA 839           H        ALA 839  49.831 -23.604 -17.582
    2    HA   ALA 839           HA       ALA 839  51.402 -21.752 -19.144
    3    HB1  ALA 839           HB1      ALA 839  52.372 -23.863 -18.367
    4    HB3  ALA 839           HB2      ALA 839  52.340 -23.804 -20.129
    5    HB2  ALA 839           HB3      ALA 839  51.143 -24.761 -19.255

  No H/Q in entry =           5
  In of MODEL   31
    1    H    ALA 840           H        ALA 840  48.453 -21.816 -19.311
    2    HA   ALA 840           HA       ALA 840  47.813 -22.740 -21.963
    3    HB2  ALA 840           HB1      ALA 840  46.207 -22.812 -20.077
    4    HB3  ALA 840           HB2      ALA 840  45.582 -21.876 -21.444
    5    HB1  ALA 840           HB3      ALA 840  46.239 -21.064 -20.014

  No H/Q in entry =           5
  In of MODEL   31
    1    H    GLU 841           H        GLU 841  49.276 -20.067 -20.564
    2    HA   GLU 841           HA       GLU 841  48.405 -18.070 -22.356
    3    HB2  GLU 841           HB2      GLU 841  50.665 -18.187 -20.362
    4    HB3  GLU 841           HB3      GLU 841  50.227 -16.769 -21.293
    5    HG2  GLU 841           HG2      GLU 841  48.028 -16.757 -20.200
    6    HG3  GLU 841           HG3      GLU 841  48.525 -18.158 -19.244

  No H/Q in entry =           6
  In of MODEL   31
    1    H    THR 842           H        THR 842  49.124 -17.896 -24.117
    2    HA   THR 842           HA       THR 842  50.457 -17.640 -25.988
    3    HB   THR 842           HB       THR 842  52.775 -18.720 -24.309
    4    HG1  THR 842           HG1      THR 842  51.387 -16.546 -24.012
    5   HG21  THR 842          HG21      THR 842  53.212 -18.691 -26.760
    6   HG23  THR 842          HG22      THR 842  54.200 -17.507 -25.906
    7   HG22  THR 842          HG23      THR 842  52.778 -16.983 -26.803

  No H/Q in entry =           7
  In of MODEL   31
    1    H    GLN 843           H        GLN 843  49.312 -20.304 -24.721
    2    HA   GLN 843           HA       GLN 843  50.031 -21.894 -27.052
    3    HB2  GLN 843           HB2      GLN 843  49.966 -22.894 -24.194
    4    HB3  GLN 843           HB3      GLN 843  49.962 -23.950 -25.597
    5    HG2  GLN 843           HG2      GLN 843  52.148 -23.075 -26.260
    6    HG3  GLN 843           HG3      GLN 843  52.140 -22.008 -24.855
    7   HE21  GLN 843          HE21      GLN 843  52.496 -22.871 -22.844
    8   HE22  GLN 843          HE22      GLN 843  53.113 -24.465 -22.604

  No H/Q in entry =           8
  In of MODEL   32
    1    H1   GLY 689           H2       GLY 689  45.861  14.372 -14.749
    2    H2   GLY 689           H1       GLY 689  46.938  14.280 -13.425
    3    H3   GLY 689           H3       GLY 689  47.035  13.178 -14.702
    4    HA2  GLY 689           HA2      GLY 689  44.784  13.410 -12.842
    5    HA3  GLY 689           HA3      GLY 689  46.004  12.132 -12.829

  No H/Q in entry =           5
  In of MODEL   32
    1    H    SER 690           H        SER 690  45.430  10.319 -13.859
    2    HA   SER 690           HA       SER 690  43.223  10.470 -15.734
    3    HB2  SER 690           HB2      SER 690  45.237  10.659 -17.125
    4    HB3  SER 690           HB3      SER 690  45.894   9.202 -16.387
    5    HG   SER 690           HG       SER 690  44.911   8.236 -17.983

  No H/Q in entry =           5
  In of MODEL   32
    1    H    HIS 691           H        HIS 691  41.832   9.184 -14.686
    2    HA   HIS 691           HA       HIS 691  42.833   6.507 -14.064
    3    HB2  HIS 691           HB2      HIS 691  40.484   7.990 -12.879
    4    HB3  HIS 691           HB3      HIS 691  40.619   6.240 -12.754
    5    HD1  HIS 691           HD1      HIS 691  40.653   7.960 -10.205
    6    HD2  HIS 691           HD2      HIS 691  44.071   6.725 -12.218
    7    HE1  HIS 691           HE1      HIS 691  42.499   7.973  -8.496
    8    HE2  HIS 691           HE2      HIS 691  44.577   7.525  -9.835

  No H/Q in entry =           8
  In of MODEL   32
    1    H    MET 692           H        MET 692  41.843   7.964 -16.492
    2    HA   MET 692           HA       MET 692  39.669   6.585 -17.659
    3    HB2  MET 692           HB2      MET 692  40.644   8.565 -18.678
    4    HB3  MET 692           HB3      MET 692  42.196   7.763 -18.858
    5    HG2  MET 692           HG2      MET 692  41.112   6.203 -20.467
    6    HG3  MET 692           HG3      MET 692  39.638   7.164 -20.324
    7    HE3  MET 692           HE1      MET 692  41.101   6.564 -23.120
    8    HE2  MET 692           HE2      MET 692  40.964   8.147 -23.886
    9    HE1  MET 692           HE3      MET 692  39.611   7.493 -22.964

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ASN 693           H        ASN 693  43.022   5.937 -17.232
    2    HA   ASN 693           HA       ASN 693  42.712   3.151 -18.017
    3    HB2  ASN 693           HB2      ASN 693  44.982   3.197 -18.956
    4    HB3  ASN 693           HB3      ASN 693  44.018   4.424 -19.764
    5   HD21  ASN 693          HD21      ASN 693  46.723   3.817 -17.674
    6   HD22  ASN 693          HD22      ASN 693  47.309   5.438 -17.631

  No H/Q in entry =           6
  In of MODEL   32
    1    HA   PRO 694           HA       PRO 694  44.447   2.745 -13.919
    2    HB2  PRO 694           HB2      PRO 694  46.057   0.436 -14.772
    3    HB3  PRO 694           HB3      PRO 694  44.712   0.486 -13.630
    4    HG2  PRO 694           HG2      PRO 694  44.474  -0.679 -16.044
    5    HG3  PRO 694           HG3      PRO 694  43.126   0.172 -15.271
    6    HD2  PRO 694           HD2      PRO 694  44.961   1.114 -17.441
    7    HD3  PRO 694           HD3      PRO 694  43.201   1.314 -17.284

  No H/Q in entry =           7
  In of MODEL   32
    1    H    LEU 695           H        LEU 695  46.084   3.904 -13.063
    2    HA   LEU 695           HA       LEU 695  48.435   4.328 -14.653
    3    HB2  LEU 695           HB2      LEU 695  47.636   5.505 -11.997
    4    HB3  LEU 695           HB3      LEU 695  49.139   5.875 -12.811
    5    HG   LEU 695           HG       LEU 695  46.370   6.503 -13.839
    6   HD11  LEU 695          HD11      LEU 695  47.018   7.883 -11.954
    7   HD13  LEU 695          HD12      LEU 695  47.004   8.821 -13.447
    8   HD12  LEU 695          HD13      LEU 695  48.537   8.289 -12.753
    9   HD21  LEU 695          HD21      LEU 695  49.086   7.156 -14.991
   10   HD23  LEU 695          HD22      LEU 695  47.551   7.785 -15.579
   11   HD22  LEU 695          HD23      LEU 695  47.892   6.061 -15.694

  No H/Q in entry =          11
  In of MODEL   32
    1    H    THR 696           H        THR 696  49.180   2.248 -14.618
    2    HA   THR 696           HA       THR 696  50.226   1.196 -12.107
    3    HB   THR 696           HB       THR 696  50.292  -0.082 -14.858
    4    HG1  THR 696           HG1      THR 696  48.240  -1.012 -14.224
    5   HG22  THR 696          HG21      THR 696  50.155  -1.256 -12.059
    6   HG21  THR 696          HG22      THR 696  51.607  -1.171 -13.054
    7   HG23  THR 696          HG23      THR 696  50.251  -2.179 -13.561

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLN 697           H        GLN 697  51.064   3.326 -14.381
    2    HA   GLN 697           HA       GLN 697  52.931   4.435 -14.960
    3    HB2  GLN 697           HB2      GLN 697  54.462   2.540 -13.132
    4    HB3  GLN 697           HB3      GLN 697  55.063   4.049 -13.781
    5    HG2  GLN 697           HG2      GLN 697  53.014   3.621 -11.622
    6    HG3  GLN 697           HG3      GLN 697  54.558   4.458 -11.517
    7   HE21  GLN 697          HE21      GLN 697  51.244   4.704 -12.218
    8   HE22  GLN 697          HE22      GLN 697  51.209   6.391 -12.597

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ALA 698           H        ALA 698  55.526   3.435 -15.546
    2    HA   ALA 698           HA       ALA 698  55.012   1.723 -17.818
    3    HB3  ALA 698           HB1      ALA 698  57.644   2.469 -16.490
    4    HB2  ALA 698           HB2      ALA 698  56.910   3.354 -17.827
    5    HB1  ALA 698           HB3      ALA 698  57.462   1.695 -18.064

  No H/Q in entry =           5
  In of MODEL   32
    1    H    VAL 699           H        VAL 699  54.456  -0.176 -17.656
    2    HA   VAL 699           HA       VAL 699  54.168  -1.503 -15.375
    3    HB   VAL 699           HB       VAL 699  53.692  -3.438 -16.728
    4   HG11  VAL 699          HG11      VAL 699  52.542  -0.854 -17.762
    5   HG13  VAL 699          HG12      VAL 699  51.969  -1.782 -16.375
    6   HG12  VAL 699          HG13      VAL 699  51.817  -2.443 -18.002
    7   HG22  VAL 699          HG21      VAL 699  53.755  -3.308 -19.194
    8   HG21  VAL 699          HG22      VAL 699  55.367  -3.246 -18.476
    9   HG23  VAL 699          HG23      VAL 699  54.609  -1.768 -19.069

  No H/Q in entry =           9
  In of MODEL   32
    1    HA   PRO 700           HA       PRO 700  58.204  -3.333 -14.696
    2    HB2  PRO 700           HB2      PRO 700  57.761  -3.998 -12.179
    3    HB3  PRO 700           HB3      PRO 700  58.012  -2.307 -12.621
    4    HG2  PRO 700           HG2      PRO 700  55.482  -3.725 -11.932
    5    HG3  PRO 700           HG3      PRO 700  55.972  -2.063 -11.564
    6    HD2  PRO 700           HD2      PRO 700  54.289  -2.845 -13.645
    7    HD3  PRO 700           HD3      PRO 700  55.127  -1.285 -13.516

  No H/Q in entry =           7
  In of MODEL   32
    1    H    LYS 701           H        LYS 701  58.897  -5.306 -14.470
    2    HA   LYS 701           HA       LYS 701  57.124  -7.408 -15.227
    3    HB2  LYS 701           HB2      LYS 701  59.101  -8.829 -15.300
    4    HB3  LYS 701           HB3      LYS 701  59.344  -7.334 -16.182
    5    HG2  LYS 701           HG2      LYS 701  60.292  -7.578 -13.375
    6    HG3  LYS 701           HG3      LYS 701  61.242  -8.320 -14.681
    7    HD2  LYS 701           HD2      LYS 701  61.263  -5.956 -15.692
    8    HD3  LYS 701           HD3      LYS 701  60.599  -5.409 -14.154
    9    HE2  LYS 701           HE2      LYS 701  63.002  -5.148 -14.190
   10    HE3  LYS 701           HE3      LYS 701  62.496  -6.301 -12.960
   11    HZ3  LYS 701           HZ1      LYS 701  63.183  -8.108 -14.349
   12    HZ2  LYS 701           HZ2      LYS 701  64.453  -7.011 -14.278
   13    HZ1  LYS 701           HZ3      LYS 701  63.482  -7.085 -15.647

  No H/Q in entry =          13
  In of MODEL   32
    1    H    CYS 702           H        CYS 702  56.372  -6.448 -12.799
    2    HA   CYS 702           HA       CYS 702  57.220  -8.459 -10.821
    3    HB2  CYS 702           HB2      CYS 702  55.538  -6.005 -10.191
    4    HB3  CYS 702           HB3      CYS 702  56.433  -7.032  -9.119

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLN 703           H        GLN 703  55.693  -9.784  -9.990
    2    HA   GLN 703           HA       GLN 703  53.273 -10.037 -11.564
    3    HB2  GLN 703           HB2      GLN 703  54.241 -11.698  -9.234
    4    HB3  GLN 703           HB3      GLN 703  53.037 -12.164 -10.426
    5    HG2  GLN 703           HG2      GLN 703  55.989 -11.749 -10.912
    6    HG3  GLN 703           HG3      GLN 703  55.140 -13.290 -10.869
    7   HE21  GLN 703          HE21      GLN 703  52.860 -12.335 -12.417
    8   HE22  GLN 703          HE22      GLN 703  53.404 -12.144 -14.033

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ARG 704           H        ARG 704  51.424 -10.900  -9.947
    2    HA   ARG 704           HA       ARG 704  50.402  -8.401  -9.066
    3    HB2  ARG 704           HB2      ARG 704  49.284 -11.167  -8.916
    4    HB3  ARG 704           HB3      ARG 704  48.408  -9.754  -8.350
    5    HG2  ARG 704           HG2      ARG 704  49.528  -9.895 -11.105
    6    HG3  ARG 704           HG3      ARG 704  47.951 -10.587 -10.747
    7    HD2  ARG 704           HD2      ARG 704  47.695  -8.394 -11.636
    8    HD3  ARG 704           HD3      ARG 704  47.241  -8.380  -9.922
    9    HE   ARG 704           HE       ARG 704  49.944  -7.507 -10.652
   10   HH11  ARG 704          HH11      ARG 704  46.653  -6.502  -9.645
   11   HH12  ARG 704          HH12      ARG 704  47.148  -4.929  -9.292
   12   HH21  ARG 704          HH21      ARG 704  50.539  -5.352 -10.127
   13   HH22  ARG 704          HH22      ARG 704  49.355  -4.260  -9.513

  No H/Q in entry =          13
  In of MODEL   32
    1    H    TRP 705           H        TRP 705  52.095 -10.781  -7.351
    2    HA   TRP 705           HA       TRP 705  51.176  -9.709  -4.804
    3    HB2  TRP 705           HB2      TRP 705  52.466 -11.655  -3.821
    4    HB3  TRP 705           HB3      TRP 705  51.113 -12.110  -4.846
    5    HD1  TRP 705           HD1      TRP 705  54.891 -12.455  -4.536
    6    HE1  TRP 705           HE1      TRP 705  55.755 -13.940  -6.396
    7    HE3  TRP 705           HE3      TRP 705  50.608 -12.845  -7.343
    8    HZ2  TRP 705           HZ2      TRP 705  54.769 -15.173  -8.768
    9    HZ3  TRP 705           HZ3      TRP 705  50.664 -14.217  -9.378
   10    HH2  TRP 705           HH2      TRP 705  52.702 -15.354 -10.073

  No H/Q in entry =          10
  In of MODEL   32
    1    H    GLU 706           H        GLU 706  53.189  -8.774  -7.007
    2    HA   GLU 706           HA       GLU 706  55.398  -8.102  -5.210
    3    HB2  GLU 706           HB2      GLU 706  55.466  -8.696  -8.161
    4    HB3  GLU 706           HB3      GLU 706  56.839  -8.126  -7.206
    5    HG2  GLU 706           HG2      GLU 706  56.748 -10.215  -5.937
    6    HG3  GLU 706           HG3      GLU 706  55.380 -10.740  -6.919

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LYS 707           H        LYS 707  56.509  -6.152  -5.922
    2    HA   LYS 707           HA       LYS 707  55.060  -4.373  -7.618
    3    HB2  LYS 707           HB2      LYS 707  54.793  -2.565  -5.956
    4    HB3  LYS 707           HB3      LYS 707  53.883  -3.981  -5.514
    5    HG2  LYS 707           HG2      LYS 707  54.746  -3.251  -3.482
    6    HG3  LYS 707           HG3      LYS 707  55.850  -4.538  -3.942
    7    HD2  LYS 707           HD2      LYS 707  57.088  -2.626  -3.067
    8    HD3  LYS 707           HD3      LYS 707  57.446  -2.849  -4.776
    9    HE2  LYS 707           HE2      LYS 707  57.129  -0.475  -4.244
   10    HE3  LYS 707           HE3      LYS 707  55.887  -1.032  -5.346
   11    HZ3  LYS 707           HZ1      LYS 707  54.928   0.330  -3.664
   12    HZ2  LYS 707           HZ2      LYS 707  55.613  -0.545  -2.434
   13    HZ1  LYS 707           HZ3      LYS 707  54.396  -1.237  -3.375

  No H/Q in entry =          13
  In of MODEL   32
    1    H    LEU 708           H        LEU 708  56.287  -2.426  -8.079
    2    HA   LEU 708           HA       LEU 708  59.103  -3.127  -8.247
    3    HB2  LEU 708           HB2      LEU 708  57.918  -2.451 -10.251
    4    HB3  LEU 708           HB3      LEU 708  57.494  -0.915  -9.520
    5    HG   LEU 708           HG       LEU 708  60.028  -0.531  -9.348
    6   HD12  LEU 708          HD11      LEU 708  60.034  -2.729 -11.389
    7   HD11  LEU 708          HD12      LEU 708  60.764  -2.770  -9.784
    8   HD13  LEU 708          HD13      LEU 708  61.391  -1.670 -11.008
    9   HD21  LEU 708          HD21      LEU 708  58.596   0.722 -10.866
   10   HD23  LEU 708          HD22      LEU 708  58.706  -0.561 -12.068
   11   HD22  LEU 708          HD23      LEU 708  60.140   0.357 -11.625

  No H/Q in entry =          11
  In of MODEL   32
    1    H    GLN 709           H        GLN 709  60.464  -2.324  -6.789
    2    HA   GLN 709           HA       GLN 709  60.297   0.487  -6.159
    3    HB2  GLN 709           HB2      GLN 709  60.440   0.241  -3.785
    4    HB3  GLN 709           HB3      GLN 709  59.117  -0.803  -4.263
    5    HG2  GLN 709           HG2      GLN 709  60.690  -2.734  -4.175
    6    HG3  GLN 709           HG3      GLN 709  61.914  -1.636  -3.559
    7   HE21  GLN 709          HE21      GLN 709  62.104  -2.681  -1.622
    8   HE22  GLN 709          HE22      GLN 709  60.877  -2.645  -0.416

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ASN 710           H        ASN 710  62.395   1.269  -5.876
    2    HA   ASN 710           HA       ASN 710  64.693   1.307  -5.989
    3    HB2  ASN 710           HB2      ASN 710  64.218  -0.175  -3.895
    4    HB3  ASN 710           HB3      ASN 710  64.598  -1.533  -4.922
    5   HD21  ASN 710          HD21      ASN 710  65.875  -0.572  -2.495
    6   HD22  ASN 710          HD22      ASN 710  67.532  -0.321  -2.892

  No H/Q in entry =           6
  In of MODEL   32
    1    H    SER 711           H        SER 711  63.095   0.417  -8.222
    2    HA   SER 711           HA       SER 711  63.238  -0.344 -10.330
    3    HB2  SER 711           HB2      SER 711  65.379   0.971 -10.220
    4    HB3  SER 711           HB3      SER 711  66.209  -0.514  -9.772
    5    HG   SER 711           HG       SER 711  64.681  -0.412 -12.123

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ARG 712           H        ARG 712  62.947  -2.315  -8.090
    2    HA   ARG 712           HA       ARG 712  63.691  -4.677  -9.614
    3    HB2  ARG 712           HB2      ARG 712  64.518  -5.789  -7.628
    4    HB3  ARG 712           HB3      ARG 712  65.437  -4.322  -7.929
    5    HG2  ARG 712           HG2      ARG 712  64.003  -3.174  -6.287
    6    HG3  ARG 712           HG3      ARG 712  63.282  -4.726  -5.886
    7    HD2  ARG 712           HD2      ARG 712  65.029  -4.272  -4.302
    8    HD3  ARG 712           HD3      ARG 712  65.605  -5.538  -5.398
    9    HE   ARG 712           HE       ARG 712  66.321  -2.988  -6.372
   10   HH11  ARG 712          HH11      ARG 712  67.231  -5.297  -3.856
   11   HH12  ARG 712          HH12      ARG 712  68.843  -4.787  -3.766
   12   HH21  ARG 712          HH21      ARG 712  68.526  -2.262  -6.245
   13   HH22  ARG 712          HH22      ARG 712  69.599  -3.007  -5.153

  No H/Q in entry =          13
  In of MODEL   32
    1    H    CYS 713           H        CYS 713  62.641  -6.608  -8.650
    2    HA   CYS 713           HA       CYS 713  59.838  -5.971  -8.156
    3    HB2  CYS 713           HB2      CYS 713  61.142  -8.606  -8.874
    4    HB3  CYS 713           HB3      CYS 713  59.426  -8.223  -8.934

  No H/Q in entry =           4
  In of MODEL   32
    1    H    VAL 714           H        VAL 714  59.288  -6.055  -6.018
    2    HA   VAL 714           HA       VAL 714  60.498  -8.191  -4.394
    3    HB   VAL 714           HB       VAL 714  60.290  -6.802  -2.393
    4   HG13  VAL 714          HG11      VAL 714  62.035  -5.146  -2.814
    5   HG12  VAL 714          HG12      VAL 714  61.817  -5.370  -4.548
    6   HG11  VAL 714          HG13      VAL 714  62.408  -6.704  -3.554
    7   HG23  VAL 714          HG21      VAL 714  59.719  -4.410  -2.539
    8   HG22  VAL 714          HG22      VAL 714  58.383  -5.451  -3.030
    9   HG21  VAL 714          HG23      VAL 714  59.349  -4.623  -4.252

  No H/Q in entry =           9
  In of MODEL   32
    1    H    CYS 715           H        CYS 715  59.033  -8.790  -2.549
    2    HA   CYS 715           HA       CYS 715  56.351  -9.039  -3.616
    3    HB2  CYS 715           HB2      CYS 715  57.595 -10.228  -1.122
    4    HB3  CYS 715           HB3      CYS 715  56.039 -10.662  -1.813

  No H/Q in entry =           4
  In of MODEL   32
    1    H    LYS 716           H        LYS 716  54.589  -8.104  -2.709
    2    HA   LYS 716           HA       LYS 716  55.190  -5.950  -0.892
    3    HB2  LYS 716           HB2      LYS 716  52.897  -5.156  -1.314
    4    HB3  LYS 716           HB3      LYS 716  53.784  -5.420  -2.798
    5    HG2  LYS 716           HG2      LYS 716  52.588  -7.602  -3.021
    6    HG3  LYS 716           HG3      LYS 716  51.595  -7.120  -1.639
    7    HD2  LYS 716           HD2      LYS 716  50.976  -5.052  -2.871
    8    HD3  LYS 716           HD3      LYS 716  51.868  -5.660  -4.263
    9    HE2  LYS 716           HE2      LYS 716  50.400  -7.667  -4.231
   10    HE3  LYS 716           HE3      LYS 716  49.481  -6.878  -2.945
   11    HZ2  LYS 716           HZ1      LYS 716  49.860  -5.835  -5.700
   12    HZ1  LYS 716           HZ2      LYS 716  49.005  -5.040  -4.506
   13    HZ3  LYS 716           HZ3      LYS 716  48.425  -6.503  -5.130

  No H/Q in entry =          13
  In of MODEL   32
    1    H    MET 717           H        MET 717  52.699  -5.814   0.515
    2    HA   MET 717           HA       MET 717  53.448  -7.940   2.406
    3    HB2  MET 717           HB2      MET 717  52.424  -5.162   2.992
    4    HB3  MET 717           HB3      MET 717  52.749  -6.373   4.218
    5    HG2  MET 717           HG2      MET 717  54.771  -5.152   2.346
    6    HG3  MET 717           HG3      MET 717  54.561  -4.761   4.051
    7    HE2  MET 717           HE1      MET 717  55.871  -7.973   5.826
    8    HE1  MET 717           HE2      MET 717  54.205  -7.487   5.522
    9    HE3  MET 717           HE3      MET 717  55.396  -6.293   6.032

  No H/Q in entry =           9
  In of MODEL   32
    1    HA   PRO 718           HA       PRO 718  49.427  -9.726   2.479
    2    HB2  PRO 718           HB2      PRO 718  48.965 -10.013   5.197
    3    HB3  PRO 718           HB3      PRO 718  49.923 -11.115   4.205
    4    HG2  PRO 718           HG2      PRO 718  50.839  -8.851   5.938
    5    HG3  PRO 718           HG3      PRO 718  51.532 -10.476   5.765
    6    HD2  PRO 718           HD2      PRO 718  52.655  -8.403   4.569
    7    HD3  PRO 718           HD3      PRO 718  52.521  -9.958   3.721

  No H/Q in entry =           7
  In of MODEL   32
    1    H    TYR 719           H        TYR 719  49.847  -6.737   4.100
    2    HA   TYR 719           HA       TYR 719  46.952  -6.380   4.274
    3    HB2  TYR 719           HB2      TYR 719  47.465  -4.309   5.586
    4    HB3  TYR 719           HB3      TYR 719  48.047  -5.790   6.330
    5    HD1  TYR 719           HD1      TYR 719  48.945  -2.563   5.011
    6    HD2  TYR 719           HD2      TYR 719  50.492  -6.330   6.219
    7    HE1  TYR 719           HE1      TYR 719  51.161  -1.572   5.211
    8    HE2  TYR 719           HE2      TYR 719  52.722  -5.356   6.437
    9    HH   TYR 719           HH       TYR 719  53.220  -1.975   6.338

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLU 720           H        GLU 720  49.348  -5.931   2.130
    2    HA   GLU 720           HA       GLU 720  48.335  -3.482   0.945
    3    HB2  GLU 720           HB2      GLU 720  50.568  -5.396   0.234
    4    HB3  GLU 720           HB3      GLU 720  50.099  -4.073  -0.819
    5    HG2  GLU 720           HG2      GLU 720  51.032  -3.702   2.017
    6    HG3  GLU 720           HG3      GLU 720  52.110  -3.675   0.621

  No H/Q in entry =           6
  In of MODEL   32
    1    H    CYS 721           H        CYS 721  47.449  -6.609   1.179
    2    HA   CYS 721           HA       CYS 721  46.284  -6.662  -1.466
    3    HB2  CYS 721           HB2      CYS 721  46.584  -9.149  -1.388
    4    HB3  CYS 721           HB3      CYS 721  48.064  -8.244  -1.669

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLY 722           H        GLY 722  44.212  -6.940  -1.455
    2    HA3  GLY 722           HA2      GLY 722  42.910  -8.306   0.773
    3    HA2  GLY 722           HA3      GLY 722  42.360  -6.703   0.285

  No H/Q in entry =           3
  In of MODEL   32
    1    HA   PRO 723           HA       PRO 723  39.828  -8.237  -3.047
    2    HB2  PRO 723           HB2      PRO 723  40.906  -7.016  -5.306
    3    HB3  PRO 723           HB3      PRO 723  39.747  -6.265  -4.203
    4    HG2  PRO 723           HG2      PRO 723  42.719  -6.008  -4.311
    5    HG3  PRO 723           HG3      PRO 723  41.500  -4.756  -4.011
    6    HD2  PRO 723           HD2      PRO 723  42.918  -5.786  -2.013
    7    HD3  PRO 723           HD3      PRO 723  41.199  -5.412  -1.798

  No H/Q in entry =           7
  In of MODEL   32
    1    H    SER 724           H        SER 724  40.100 -10.380  -3.454
    2    HA   SER 724           HA       SER 724  41.234 -11.237  -5.877
    3    HB2  SER 724           HB2      SER 724  42.981 -12.719  -5.041
    4    HB3  SER 724           HB3      SER 724  43.310 -11.061  -4.625
    5    HG   SER 724           HG       SER 724  42.358 -11.447  -2.630

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU 725           H        LEU 725  40.993 -13.534  -6.125
    2    HA   LEU 725           HA       LEU 725  38.396 -14.330  -5.429
    3    HB2  LEU 725           HB2      LEU 725  40.791 -15.719  -6.477
    4    HB3  LEU 725           HB3      LEU 725  39.284 -16.618  -6.240
    5    HG   LEU 725           HG       LEU 725  39.677 -14.230  -8.084
    6   HD12  LEU 725          HD11      LEU 725  39.564 -15.847  -9.894
    7   HD11  LEU 725          HD12      LEU 725  39.497 -17.171  -8.729
    8   HD13  LEU 725          HD13      LEU 725  40.949 -16.166  -8.850
    9   HD23  LEU 725          HD21      LEU 725  37.518 -14.914  -9.018
   10   HD22  LEU 725          HD22      LEU 725  37.378 -14.472  -7.319
   11   HD21  LEU 725          HD23      LEU 725  37.388 -16.172  -7.790

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ASP 726           H        ASP 726  37.567 -15.317  -3.764
    2    HA   ASP 726           HA       ASP 726  39.077 -15.778  -1.385
    3    HB2  ASP 726           HB2      ASP 726  36.228 -16.593  -2.040
    4    HB3  ASP 726           HB3      ASP 726  36.952 -16.513  -0.444

  No H/Q in entry =           4
  In of MODEL   32
    1    H    VAL 727           H        VAL 727  40.105 -17.643  -0.897
    2    HA   VAL 727           HA       VAL 727  39.178 -20.101  -2.167
    3    HB   VAL 727           HB       VAL 727  41.542 -20.796  -2.617
    4   HG11  VAL 727          HG11      VAL 727  40.142 -19.982  -4.439
    5   HG13  VAL 727          HG12      VAL 727  41.806 -19.475  -4.691
    6   HG12  VAL 727          HG13      VAL 727  40.620 -18.325  -4.086
    7   HG22  VAL 727          HG21      VAL 727  43.293 -19.063  -2.754
    8   HG21  VAL 727          HG22      VAL 727  42.703 -19.263  -1.104
    9   HG23  VAL 727          HG23      VAL 727  42.170 -17.888  -2.069

  No H/Q in entry =           9
  In of MODEL   32
    1    H    CYS 728           H        CYS 728  39.845 -22.057  -1.071
    2    HA   CYS 728           HA       CYS 728  40.262 -21.539   1.762
    3    HB2  CYS 728           HB2      CYS 728  39.412 -24.135   0.433
    4    HB3  CYS 728           HB3      CYS 728  39.409 -23.752   2.139

  No H/Q in entry =           4
  In of MODEL   32
    1    H    ALA 729           H        ALA 729  42.064 -22.166   2.758
    2    HA   ALA 729           HA       ALA 729  43.961 -23.730   1.196
    3    HB1  ALA 729           HB1      ALA 729  44.536 -21.297   2.871
    4    HB3  ALA 729           HB2      ALA 729  44.573 -21.377   1.107
    5    HB2  ALA 729           HB3      ALA 729  45.739 -22.298   2.058

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLN 730           H        GLN 730  45.608 -24.639   2.565
    2    HA   GLN 730           HA       GLN 730  44.632 -25.218   5.261
    3    HB2  GLN 730           HB2      GLN 730  44.529 -27.218   3.778
    4    HB3  GLN 730           HB3      GLN 730  46.240 -27.017   3.468
    5    HG2  GLN 730           HG2      GLN 730  46.798 -27.405   5.742
    6    HG3  GLN 730           HG3      GLN 730  45.119 -27.489   6.219
    7   HE21  GLN 730          HE21      GLN 730  45.201 -29.581   6.965
    8   HE22  GLN 730          HE22      GLN 730  45.469 -30.935   5.937

  No H/Q in entry =           8
  In of MODEL   32
    1    H    ASP 731           H        ASP 731  45.905 -24.707   6.751
    2    HA   ASP 731           HA       ASP 731  48.373 -23.340   6.292
    3    HB2  ASP 731           HB2      ASP 731  46.750 -22.798   8.120
    4    HB3  ASP 731           HB3      ASP 731  47.142 -24.344   8.857

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLU 732           H        GLU 732  50.436 -24.257   6.346
    2    HA   GLU 732           HA       GLU 732  50.516 -27.116   6.535
    3    HB2  GLU 732           HB2      GLU 732  52.589 -25.078   5.816
    4    HB3  GLU 732           HB3      GLU 732  52.940 -26.799   5.930
    5    HG2  GLU 732           HG2      GLU 732  50.842 -25.595   4.152
    6    HG3  GLU 732           HG3      GLU 732  52.469 -26.035   3.629

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ARG 733           H        ARG 733  50.708 -24.831   8.894
    2    HA   ARG 733           HA       ARG 733  52.671 -26.408  10.354
    3    HB2  ARG 733           HB2      ARG 733  52.832 -23.825  10.117
    4    HB3  ARG 733           HB3      ARG 733  51.502 -23.770  11.259
    5    HG2  ARG 733           HG2      ARG 733  54.165 -25.087  11.804
    6    HG3  ARG 733           HG3      ARG 733  53.752 -23.444  12.272
    7    HD2  ARG 733           HD2      ARG 733  52.028 -24.242  13.741
    8    HD3  ARG 733           HD3      ARG 733  52.223 -25.883  13.138
    9    HE   ARG 733           HE       ARG 733  54.552 -25.682  14.054
   10   HH11  ARG 733          HH11      ARG 733  51.874 -23.880  15.522
   11   HH12  ARG 733          HH12      ARG 733  52.486 -24.053  17.108
   12   HH21  ARG 733          HH21      ARG 733  55.341 -25.897  16.236
   13   HH22  ARG 733          HH22      ARG 733  54.465 -25.215  17.523

  No H/Q in entry =          13
  In of MODEL   32
    1    H    SER 734           H        SER 734  49.516 -24.868  10.771
    2    HA   SER 734           HA       SER 734  48.934 -26.617  13.017
    3    HB2  SER 734           HB2      SER 734  47.247 -24.450  11.760
    4    HB3  SER 734           HB3      SER 734  46.965 -25.217  13.325
    5    HG   SER 734           HG       SER 734  49.052 -24.426  13.934

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LYS 735           H        LYS 735  48.431 -26.648   9.653
    2    HA   LYS 735           HA       LYS 735  47.357 -27.965   8.190
    3    HB2  LYS 735           HB2      LYS 735  46.935 -29.850  10.516
    4    HB3  LYS 735           HB3      LYS 735  46.822 -30.270   8.813
    5    HG2  LYS 735           HG2      LYS 735  49.313 -29.415  10.294
    6    HG3  LYS 735           HG3      LYS 735  48.934 -31.037   9.733
    7    HD2  LYS 735           HD2      LYS 735  49.392 -28.622   7.959
    8    HD3  LYS 735           HD3      LYS 735  50.573 -29.880   8.286
    9    HE2  LYS 735           HE2      LYS 735  49.011 -31.532   7.293
   10    HE3  LYS 735           HE3      LYS 735  47.932 -30.206   6.866
   11    HZ3  LYS 735           HZ1      LYS 735  49.347 -30.862   5.015
   12    HZ2  LYS 735           HZ2      LYS 735  50.712 -30.580   5.917
   13    HZ1  LYS 735           HZ3      LYS 735  49.746 -29.286   5.450

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ARG 736           H        ARG 736  45.932 -26.087   9.812
    2    HA   ARG 736           HA       ARG 736  43.186 -26.962   9.928
    3    HB2  ARG 736           HB2      ARG 736  42.765 -24.584  10.551
    4    HB3  ARG 736           HB3      ARG 736  43.974 -25.344  11.589
    5    HG2  ARG 736           HG2      ARG 736  45.741 -24.309  10.313
    6    HG3  ARG 736           HG3      ARG 736  44.572 -23.611   9.211
    7    HD2  ARG 736           HD2      ARG 736  43.756 -22.160  10.965
    8    HD3  ARG 736           HD3      ARG 736  44.818 -22.952  12.146
    9    HE   ARG 736           HE       ARG 736  46.443 -22.185  10.079
   10   HH11  ARG 736          HH11      ARG 736  44.404 -20.355  12.315
   11   HH12  ARG 736          HH12      ARG 736  45.469 -19.023  12.326
   12   HH21  ARG 736          HH21      ARG 736  47.831 -20.448  10.131
   13   HH22  ARG 736          HH22      ARG 736  47.482 -19.066  11.065

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ILE 737           H        ILE 737  41.574 -26.296   8.467
    2    HA   ILE 737           HA       ILE 737  42.506 -25.216   5.953
    3    HB   ILE 737           HB       ILE 737  39.662 -25.857   6.753
    4   HG12  ILE 737          HG12      ILE 737  41.102 -27.880   7.041
    5   HG13  ILE 737          HG13      ILE 737  39.914 -28.067   5.761
    6   HG23  ILE 737          HG21      ILE 737  39.283 -25.955   4.395
    7   HG22  ILE 737          HG22      ILE 737  41.000 -25.788   4.053
    8   HG21  ILE 737          HG23      ILE 737  40.106 -24.433   4.750
    9   HD12  ILE 737          HD11      ILE 737  42.050 -29.004   5.121
   10   HD11  ILE 737          HD12      ILE 737  42.832 -27.444   5.412
   11   HD13  ILE 737          HD13      ILE 737  41.631 -27.609   4.121

  No H/Q in entry =          11
  In of MODEL   32
    1    H    LEU 738           H        LEU 738  42.472 -23.094   5.664
    2    HA   LEU 738           HA       LEU 738  40.558 -21.534   7.201
    3    HB2  LEU 738           HB2      LEU 738  42.075 -19.790   7.691
    4    HB3  LEU 738           HB3      LEU 738  42.820 -21.273   8.268
    5    HG   LEU 738           HG       LEU 738  43.562 -19.664   5.816
    6   HD12  LEU 738          HD11      LEU 738  45.652 -19.255   7.008
    7   HD11  LEU 738          HD12      LEU 738  45.006 -20.109   8.410
    8   HD13  LEU 738          HD13      LEU 738  44.247 -18.614   7.857
    9   HD23  LEU 738          HD21      LEU 738  45.447 -21.188   5.571
   10   HD22  LEU 738          HD22      LEU 738  43.879 -21.974   5.399
   11   HD21  LEU 738          HD23      LEU 738  44.798 -22.176   6.900

  No H/Q in entry =          11
  In of MODEL   32
    1    HA   PRO 739           HA       PRO 739  39.703 -19.681   3.327
    2    HB2  PRO 739           HB2      PRO 739  38.460 -17.477   4.176
    3    HB3  PRO 739           HB3      PRO 739  37.722 -19.089   4.369
    4    HG2  PRO 739           HG2      PRO 739  39.163 -17.392   6.367
    5    HG3  PRO 739           HG3      PRO 739  37.680 -18.347   6.568
    6    HD2  PRO 739           HD2      PRO 739  40.191 -19.250   7.327
    7    HD3  PRO 739           HD3      PRO 739  38.837 -20.309   6.849

  No H/Q in entry =           7
  In of MODEL   32
    1    H    LEU 740           H        LEU 740  41.198 -18.741   2.103
    2    HA   LEU 740           HA       LEU 740  42.458 -16.283   3.070
    3    HB2  LEU 740           HB2      LEU 740  43.728 -18.527   1.504
    4    HB3  LEU 740           HB3      LEU 740  44.419 -16.930   1.628
    5    HG   LEU 740           HG       LEU 740  44.026 -18.891   3.888
    6   HD12  LEU 740          HD11      LEU 740  46.490 -18.885   3.917
    7   HD11  LEU 740          HD12      LEU 740  46.475 -17.864   2.466
    8   HD13  LEU 740          HD13      LEU 740  45.821 -19.493   2.403
    9   HD23  LEU 740          HD21      LEU 740  45.271 -17.250   5.247
   10   HD22  LEU 740          HD22      LEU 740  43.724 -16.609   4.708
   11   HD21  LEU 740          HD23      LEU 740  45.211 -16.105   3.907

  No H/Q in entry =          11
  In of MODEL   32
    1    H    THR 741           H        THR 741  43.522 -15.289   1.050
    2    HA   THR 741           HA       THR 741  41.650 -15.458  -1.153
    3    HB   THR 741           HB       THR 741  42.852 -12.969  -1.187
    4    HG1  THR 741           HG1      THR 741  41.779 -13.164   1.382
    5   HG22  THR 741          HG21      THR 741  40.148 -13.737  -0.085
    6   HG21  THR 741          HG22      THR 741  40.576 -13.470  -1.789
    7   HG23  THR 741          HG23      THR 741  40.643 -12.127  -0.645

  No H/Q in entry =           7
  In of MODEL   32
    1    H    VAL 742           H        VAL 742  42.637 -15.204  -3.152
    2    HA   VAL 742           HA       VAL 742  45.018 -16.492  -3.627
    3    HB   VAL 742           HB       VAL 742  43.764 -14.355  -5.312
    4   HG11  VAL 742          HG11      VAL 742  45.713 -16.400  -6.206
    5   HG13  VAL 742          HG12      VAL 742  45.901 -14.634  -6.092
    6   HG12  VAL 742          HG13      VAL 742  44.736 -15.314  -7.215
    7   HG23  VAL 742          HG21      VAL 742  42.812 -16.222  -6.552
    8   HG22  VAL 742          HG22      VAL 742  42.178 -15.945  -4.921
    9   HG21  VAL 742          HG23      VAL 742  43.310 -17.278  -5.210

  No H/Q in entry =           9
  In of MODEL   32
    1    H    CYS 743           H        CYS 743  44.463 -13.037  -3.173
    2    HA   CYS 743           HA       CYS 743  47.053 -12.245  -3.922
    3    HB2  CYS 743           HB2      CYS 743  46.434 -10.050  -3.131
    4    HB3  CYS 743           HB3      CYS 743  45.077 -10.768  -3.929

  No H/Q in entry =           4
  In of MODEL   32
    1    H    LYS 744           H        LYS 744  45.548 -12.541  -0.728
    2    HA   LYS 744           HA       LYS 744  47.834 -12.077   0.775
    3    HB2  LYS 744           HB2      LYS 744  45.396 -13.706   1.413
    4    HB3  LYS 744           HB3      LYS 744  46.646 -13.352   2.593
    5    HG2  LYS 744           HG2      LYS 744  46.205 -10.919   2.227
    6    HG3  LYS 744           HG3      LYS 744  44.890 -11.364   1.141
    7    HD2  LYS 744           HD2      LYS 744  43.798 -12.565   2.992
    8    HD3  LYS 744           HD3      LYS 744  45.099 -12.057   4.068
    9    HE2  LYS 744           HE2      LYS 744  43.185 -10.236   2.605
   10    HE3  LYS 744           HE3      LYS 744  43.124 -10.638   4.317
   11    HZ3  LYS 744           HZ1      LYS 744  44.143  -8.513   4.028
   12    HZ2  LYS 744           HZ2      LYS 744  45.248  -9.086   2.924
   13    HZ1  LYS 744           HZ3      LYS 744  45.345  -9.581   4.546

  No H/Q in entry =          13
  In of MODEL   32
    1    H    MET 745           H        MET 745  46.494 -15.169  -0.305
    2    HA   MET 745           HA       MET 745  48.348 -16.928   0.793
    3    HB2  MET 745           HB2      MET 745  46.725 -18.039  -0.062
    4    HB3  MET 745           HB3      MET 745  46.410 -16.978  -1.435
    5    HG2  MET 745           HG2      MET 745  47.098 -19.013  -2.425
    6    HG3  MET 745           HG3      MET 745  48.553 -18.043  -2.421
    7    HE1  MET 745           HE1      MET 745  46.660 -21.005  -0.936
    8    HE3  MET 745           HE2      MET 745  46.870 -20.115   0.580
    9    HE2  MET 745           HE3      MET 745  47.726 -21.634   0.305

  No H/Q in entry =           9
  In of MODEL   32
    1    H    HIS 746           H        HIS 746  48.563 -15.182  -2.290
    2    HA   HIS 746           HA       HIS 746  51.045 -16.480  -2.970
    3    HB2  HIS 746           HB2      HIS 746  49.467 -14.312  -4.153
    4    HB3  HIS 746           HB3      HIS 746  51.172 -14.363  -4.620
    5    HD1  HIS 746           HD1      HIS 746  51.866 -16.648  -5.938
    6    HD2  HIS 746           HD2      HIS 746  47.801 -15.987  -5.410
    7    HE1  HIS 746           HE1      HIS 746  50.735 -18.066  -7.643
    8    HE2  HIS 746           HE2      HIS 746  48.296 -17.430  -7.471

  No H/Q in entry =           8
  In of MODEL   32
    1    H    VAL 747           H        VAL 747  50.218 -13.329  -1.636
    2    HA   VAL 747           HA       VAL 747  52.828 -12.308  -1.544
    3    HB   VAL 747           HB       VAL 747  50.338 -11.686   0.067
    4   HG11  VAL 747          HG11      VAL 747  52.309 -11.208   1.486
    5   HG13  VAL 747          HG12      VAL 747  51.496  -9.735   0.984
    6   HG12  VAL 747          HG13      VAL 747  52.991 -10.226   0.190
    7   HG22  VAL 747          HG21      VAL 747  50.415  -9.618  -1.232
    8   HG21  VAL 747          HG22      VAL 747  50.374 -11.055  -2.274
    9   HG23  VAL 747          HG23      VAL 747  51.896 -10.201  -2.004

  No H/Q in entry =           9
  In of MODEL   32
    1    H    LEU 748           H        LEU 748  50.891 -13.852   0.943
    2    HA   LEU 748           HA       LEU 748  52.874 -13.916   2.870
    3    HB2  LEU 748           HB2      LEU 748  50.951 -14.208   3.970
    4    HB3  LEU 748           HB3      LEU 748  50.134 -14.736   2.533
    5    HG   LEU 748           HG       LEU 748  51.667 -16.606   4.359
    6   HD12  LEU 748          HD11      LEU 748  48.722 -15.969   4.228
    7   HD11  LEU 748          HD12      LEU 748  49.806 -15.484   5.541
    8   HD13  LEU 748          HD13      LEU 748  49.470 -17.194   5.248
    9   HD21  LEU 748          HD21      LEU 748  51.254 -17.417   2.037
   10   HD23  LEU 748          HD22      LEU 748  49.527 -17.123   2.275
   11   HD22  LEU 748          HD23      LEU 748  50.356 -18.321   3.250

  No H/Q in entry =          11
  In of MODEL   32
    1    H    HIS 749           H        HIS 749  52.137 -16.148   0.298
    2    HA   HIS 749           HA       HIS 749  53.776 -18.294   1.138
    3    HB2  HIS 749           HB2      HIS 749  52.017 -18.283  -0.729
    4    HB3  HIS 749           HB3      HIS 749  53.238 -17.516  -1.731
    5    HD1  HIS 749           HD1      HIS 749  55.289 -19.033  -2.459
    6    HD2  HIS 749           HD2      HIS 749  52.296 -20.972  -0.338
    7    HE1  HIS 749           HE1      HIS 749  55.703 -21.460  -2.804
    8    HE2  HIS 749           HE2      HIS 749  54.023 -22.614  -1.349

  No H/Q in entry =           8
  In of MODEL   32
    1    H    CYS 750           H        CYS 750  54.342 -15.429  -0.862
    2    HA   CYS 750           HA       CYS 750  57.043 -16.141  -1.390
    3    HB2  CYS 750           HB2      CYS 750  55.475 -13.638  -1.963
    4    HB3  CYS 750           HB3      CYS 750  57.166 -13.867  -2.415

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLN 751           H        GLN 751  55.402 -14.388   1.088
    2    HA   GLN 751           HA       GLN 751  57.756 -13.218   2.146
    3    HB2  GLN 751           HB2      GLN 751  55.039 -13.689   3.368
    4    HB3  GLN 751           HB3      GLN 751  56.324 -12.756   4.128
    5    HG2  GLN 751           HG2      GLN 751  55.176 -12.126   1.431
    6    HG3  GLN 751           HG3      GLN 751  54.591 -11.403   2.922
    7   HE21  GLN 751          HE21      GLN 751  55.158  -9.404   2.089
    8   HE22  GLN 751          HE22      GLN 751  56.771  -8.820   2.094

  No H/Q in entry =           8
  In of MODEL   32
    1    H    GLY 752           H        GLY 752  56.914 -16.383   1.919
    2    HA3  GLY 752           HA2      GLY 752  58.628 -17.903   2.669
    3    HA2  GLY 752           HA3      GLY 752  58.701 -16.992   4.162

  No H/Q in entry =           3
  In of MODEL   32
    1    H    ARG 753           H        ARG 753  55.476 -17.396   3.304
    2    HA   ARG 753           HA       ARG 753  55.316 -19.495   5.327
    3    HB2  ARG 753           HB2      ARG 753  53.118 -17.829   4.152
    4    HB3  ARG 753           HB3      ARG 753  52.977 -18.890   5.553
    5    HG2  ARG 753           HG2      ARG 753  54.572 -16.339   5.348
    6    HG3  ARG 753           HG3      ARG 753  53.106 -16.593   6.298
    7    HD2  ARG 753           HD2      ARG 753  54.283 -18.224   7.694
    8    HD3  ARG 753           HD3      ARG 753  55.737 -18.013   6.722
    9    HE   ARG 753           HE       ARG 753  54.607 -15.695   8.084
   10   HH11  ARG 753          HH11      ARG 753  57.248 -18.077   7.844
   11   HH12  ARG 753          HH12      ARG 753  58.302 -17.232   8.848
   12   HH21  ARG 753          HH21      ARG 753  56.105 -14.529   9.497
   13   HH22  ARG 753          HH22      ARG 753  57.636 -15.171   9.828

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ASN 754           H        ASN 754  54.137 -21.388   5.013
    2    HA   ASN 754           HA       ASN 754  53.862 -22.103   2.182
    3    HB2  ASN 754           HB2      ASN 754  54.491 -23.896   4.536
    4    HB3  ASN 754           HB3      ASN 754  54.371 -24.404   2.861
    5   HD21  ASN 754          HD21      ASN 754  56.541 -24.521   4.797
    6   HD22  ASN 754          HD22      ASN 754  57.895 -23.725   4.078

  No H/Q in entry =           6
  In of MODEL   32
    1    H    TYR 755           H        TYR 755  51.960 -22.859   1.529
    2    HA   TYR 755           HA       TYR 755  50.007 -23.794   3.444
    3    HB2  TYR 755           HB2      TYR 755  49.673 -21.343   1.746
    4    HB3  TYR 755           HB3      TYR 755  48.271 -22.314   2.157
    5    HD1  TYR 755           HD1      TYR 755  47.361 -22.254   4.354
    6    HD2  TYR 755           HD2      TYR 755  50.954 -20.190   3.505
    7    HE1  TYR 755           HE1      TYR 755  47.205 -21.097   6.512
    8    HE2  TYR 755           HE2      TYR 755  50.801 -19.014   5.638
    9    HH   TYR 755           HH       TYR 755  48.789 -20.100   8.074

  No H/Q in entry =           9
  In of MODEL   32
    1    H    THR 756           H        THR 756  48.311 -24.937   2.467
    2    HA   THR 756           HA       THR 756  48.906 -25.897  -0.254
    3    HB   THR 756           HB       THR 756  47.360 -27.259   1.985
    4    HG1  THR 756           HG1      THR 756  49.309 -27.621   2.741
    5   HG21  THR 756          HG21      THR 756  46.738 -27.992  -0.248
    6   HG23  THR 756          HG22      THR 756  47.586 -29.276   0.626
    7   HG22  THR 756          HG23      THR 756  48.429 -28.340  -0.619

  No H/Q in entry =           7
  In of MODEL   32
    1    H    LEU 757           H        LEU 757  46.936 -26.088  -1.630
    2    HA   LEU 757           HA       LEU 757  44.780 -24.573  -0.440
    3    HB2  LEU 757           HB2      LEU 757  45.378 -25.019  -3.335
    4    HB3  LEU 757           HB3      LEU 757  43.872 -24.330  -2.756
    5    HG   LEU 757           HG       LEU 757  45.623 -22.775  -1.482
    6   HD13  LEU 757          HD11      LEU 757  47.582 -23.745  -2.444
    7   HD12  LEU 757          HD12      LEU 757  47.386 -22.088  -3.014
    8   HD11  LEU 757          HD13      LEU 757  46.977 -23.437  -4.073
    9   HD23  LEU 757          HD21      LEU 757  44.577 -22.365  -4.258
   10   HD22  LEU 757          HD22      LEU 757  45.096 -21.094  -3.127
   11   HD21  LEU 757          HD23      LEU 757  43.704 -22.108  -2.748

  No H/Q in entry =          11
  In of MODEL   32
    1    H    THR 758           H        THR 758  42.703 -25.186  -0.523
    2    HA   THR 758           HA       THR 758  42.347 -28.018  -1.050
    3    HB   THR 758           HB       THR 758  40.867 -27.993   1.054
    4    HG1  THR 758           HG1      THR 758  42.132 -26.222   2.463
    5   HG22  THR 758          HG21      THR 758  43.854 -27.599   1.402
    6   HG21  THR 758          HG22      THR 758  43.075 -29.114   0.963
    7   HG23  THR 758          HG23      THR 758  42.787 -28.406   2.550

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLY 759           H        GLY 759  39.815 -28.404  -0.710
    2    HA3  GLY 759           HA2      GLY 759  38.595 -26.875  -2.790
    3    HA2  GLY 759           HA3      GLY 759  37.880 -28.207  -1.886

  No H/Q in entry =           3
  In of MODEL   32
    1    H    ARG 760           H        ARG 760  36.505 -25.869  -2.549
    2    HA   ARG 760           HA       ARG 760  36.492 -23.958  -0.464
    3    HB2  ARG 760           HB2      ARG 760  34.475 -23.062  -1.501
    4    HB3  ARG 760           HB3      ARG 760  35.634 -23.481  -2.746
    5    HG2  ARG 760           HG2      ARG 760  33.670 -24.255  -3.679
    6    HG3  ARG 760           HG3      ARG 760  34.258 -25.706  -2.862
    7    HD2  ARG 760           HD2      ARG 760  32.814 -25.160  -0.924
    8    HD3  ARG 760           HD3      ARG 760  32.188 -23.778  -1.820
    9    HE   ARG 760           HE       ARG 760  31.935 -26.499  -2.858
   10   HH11  ARG 760          HH11      ARG 760  30.386 -23.521  -1.686
   11   HH12  ARG 760          HH12      ARG 760  28.840 -23.924  -2.246
   12   HH21  ARG 760          HH21      ARG 760  29.784 -27.061  -3.604
   13   HH22  ARG 760          HH22      ARG 760  28.491 -25.966  -3.394

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ASP 761           H        ASP 761  35.205 -27.056  -0.742
    2    HA   ASP 761           HA       ASP 761  33.120 -26.782   1.231
    3    HB2  ASP 761           HB2      ASP 761  34.349 -29.200  -0.089
    4    HB3  ASP 761           HB3      ASP 761  33.027 -29.293   1.066

  No H/Q in entry =           4
  In of MODEL   32
    1    H    SER 762           H        SER 762  36.358 -26.675   1.565
    2    HA   SER 762           HA       SER 762  36.591 -28.583   3.727
    3    HB2  SER 762           HB2      SER 762  38.629 -26.628   2.695
    4    HB3  SER 762           HB3      SER 762  38.951 -28.035   3.719
    5    HG   SER 762           HG       SER 762  38.192 -27.819   1.053

  No H/Q in entry =           5
  In of MODEL   32
    1    H    CYS 763           H        CYS 763  36.208 -25.076   3.381
    2    HA   CYS 763           HA       CYS 763  35.870 -24.927   6.261
    3    HB2  CYS 763           HB2      CYS 763  37.378 -23.033   6.557
    4    HB3  CYS 763           HB3      CYS 763  38.252 -24.392   5.851

  No H/Q in entry =           4
  In of MODEL   32
    1    H    THR 764           H        THR 764  35.257 -22.505   6.780
    2    HA   THR 764           HA       THR 764  33.090 -21.839   4.978
    3    HB   THR 764           HB       THR 764  33.834 -20.582   7.639
    4    HG1  THR 764           HG1      THR 764  33.058 -23.051   7.181
    5   HG21  THR 764          HG21      THR 764  32.253 -19.295   6.244
    6   HG23  THR 764          HG22      THR 764  31.457 -19.937   7.679
    7   HG22  THR 764          HG23      THR 764  31.213 -20.712   6.116

  No H/Q in entry =           7
  In of MODEL   32
    1    H    LEU 765           H        LEU 765  33.455 -20.464   3.443
    2    HA   LEU 765           HA       LEU 765  35.811 -18.805   3.431
    3    HB2  LEU 765           HB2      LEU 765  34.713 -20.362   1.593
    4    HB3  LEU 765           HB3      LEU 765  33.699 -18.957   1.357
    5    HG   LEU 765           HG       LEU 765  35.610 -17.632   0.710
    6   HD12  LEU 765          HD11      LEU 765  37.809 -18.747   0.420
    7   HD11  LEU 765          HD12      LEU 765  37.132 -20.202   1.174
    8   HD13  LEU 765          HD13      LEU 765  37.309 -18.737   2.113
    9   HD22  LEU 765          HD21      LEU 765  36.112 -18.796  -1.373
   10   HD21  LEU 765          HD22      LEU 765  34.394 -18.900  -0.979
   11   HD23  LEU 765          HD23      LEU 765  35.449 -20.286  -0.706

  No H/Q in entry =          11
  In of MODEL   32
    1    HA   PRO 766           HA       PRO 766  33.752 -15.142   4.860
    2    HB2  PRO 766           HB2      PRO 766  34.780 -13.278   3.025
    3    HB3  PRO 766           HB3      PRO 766  35.486 -13.718   4.580
    4    HG2  PRO 766           HG2      PRO 766  36.194 -14.633   1.853
    5    HG3  PRO 766           HG3      PRO 766  37.221 -14.451   3.280
    6    HD2  PRO 766           HD2      PRO 766  36.406 -16.858   2.361
    7    HD3  PRO 766           HD3      PRO 766  36.676 -16.565   4.078

  No H/Q in entry =           7
  In of MODEL   32
    1    H    ALA 767           H        ALA 767  33.840 -14.999   1.280
    2    HA   ALA 767           HA       ALA 767  31.014 -14.245   1.481
    3    HB3  ALA 767           HB1      ALA 767  32.827 -13.630  -0.809
    4    HB1  ALA 767           HB2      ALA 767  32.410 -12.478   0.484
    5    HB2  ALA 767           HB3      ALA 767  31.150 -13.127  -0.592

  No H/Q in entry =           5
  In of MODEL   32
    1    H    SER 768           H        SER 768  30.717 -16.323   1.795
    2    HA   SER 768           HA       SER 768  30.806 -18.018  -0.534
    3    HB2  SER 768           HB2      SER 768  29.662 -18.558   2.212
    4    HB3  SER 768           HB3      SER 768  29.897 -19.718   0.909
    5    HG   SER 768           HG       SER 768  31.811 -18.454   2.533

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA 769           H        ALA 769  28.419 -16.760   1.760
    2    HA   ALA 769           HA       ALA 769  26.244 -17.570   0.076
    3    HB1  ALA 769           HB1      ALA 769  26.195 -16.060   2.676
    4    HB3  ALA 769           HB2      ALA 769  26.113 -17.814   2.508
    5    HB2  ALA 769           HB3      ALA 769  24.815 -16.806   1.871

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLU 770           H        GLU 770  24.392 -15.821   0.207
    2    HA   GLU 770           HA       GLU 770  25.075 -14.056  -1.840
    3    HB2  GLU 770           HB2      GLU 770  22.734 -13.329  -1.690
    4    HB3  GLU 770           HB3      GLU 770  22.923 -15.072  -1.808
    5    HG2  GLU 770           HG2      GLU 770  22.510 -15.303   0.574
    6    HG3  GLU 770           HG3      GLU 770  22.418 -13.553   0.738

  No H/Q in entry =           6
  In of MODEL   32
    1    H    LYS 771           H        LYS 771  25.416 -12.011  -1.992
    2    HA   LYS 771           HA       LYS 771  25.121 -10.265   0.327
    3    HB2  LYS 771           HB2      LYS 771  27.515 -10.277  -1.555
    4    HB3  LYS 771           HB3      LYS 771  27.250  -9.205  -0.189
    5    HG2  LYS 771           HG2      LYS 771  27.597 -12.184   0.034
    6    HG3  LYS 771           HG3      LYS 771  28.889 -11.006   0.266
    7    HD2  LYS 771           HD2      LYS 771  27.893 -10.139   2.211
    8    HD3  LYS 771           HD3      LYS 771  26.330 -10.865   1.825
    9    HE2  LYS 771           HE2      LYS 771  27.177 -13.028   2.185
   10    HE3  LYS 771           HE3      LYS 771  28.813 -12.430   2.465
   11    HZ2  LYS 771           HZ1      LYS 771  26.431 -11.880   4.195
   12    HZ1  LYS 771           HZ2      LYS 771  27.980 -11.242   4.437
   13    HZ3  LYS 771           HZ3      LYS 771  27.725 -12.892   4.565

  No H/Q in entry =          13
  In of MODEL   32
    1    H    ALA 772           H        ALA 772  23.956  -8.573  -0.287
    2    HA   ALA 772           HA       ALA 772  23.047  -8.162  -2.967
    3    HB1  ALA 772           HB1      ALA 772  21.709  -7.512  -1.075
    4    HB2  ALA 772           HB2      ALA 772  22.111  -6.075  -2.031
    5    HB3  ALA 772           HB3      ALA 772  22.957  -6.395  -0.516

  No H/Q in entry =           5
  In of MODEL   32
    1    H    CYS 773           H        CYS 773  24.229  -7.394  -4.488
    2    HA   CYS 773           HA       CYS 773  26.778  -6.363  -4.164
    3    HB2  CYS 773           HB2      CYS 773  24.951  -6.210  -6.527
    4    HB3  CYS 773           HB3      CYS 773  26.667  -5.794  -6.568

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLY 774           H        GLY 774  27.692  -4.389  -4.706
    2    HA3  GLY 774           HA2      GLY 774  27.232  -1.960  -5.104
    3    HA2  GLY 774           HA3      GLY 774  26.114  -2.111  -3.738

  No H/Q in entry =           3
  In of MODEL   32
    1    H    ALA 775           H        ALA 775  27.687  -4.101  -2.516
    2    HA   ALA 775           HA       ALA 775  30.342  -3.090  -2.040
    3    HB3  ALA 775           HB1      ALA 775  28.305  -3.656   0.151
    4    HB1  ALA 775           HB2      ALA 775  29.005  -2.080  -0.214
    5    HB2  ALA 775           HB3      ALA 775  30.023  -3.371   0.425

  No H/Q in entry =           5
  In of MODEL   32
    1    H    CYS 776           H        CYS 776  31.303  -4.846  -2.849
    2    HA   CYS 776           HA       CYS 776  30.919  -7.455  -1.820
    3    HB2  CYS 776           HB2      CYS 776  30.030  -8.374  -4.039
    4    HB3  CYS 776           HB3      CYS 776  28.873  -7.411  -3.133

  No H/Q in entry =           4
  In of MODEL   32
    1    HA   PRO 777           HA       PRO 777  34.922  -8.063  -3.914
    2    HB2  PRO 777           HB2      PRO 777  33.607 -10.052  -5.724
    3    HB3  PRO 777           HB3      PRO 777  35.130 -10.195  -4.843
    4    HG2  PRO 777           HG2      PRO 777  33.014 -11.437  -3.916
    5    HG3  PRO 777           HG3      PRO 777  34.052 -10.534  -2.793
    6    HD2  PRO 777           HD2      PRO 777  31.404  -9.788  -3.941
    7    HD3  PRO 777           HD3      PRO 777  32.017  -9.546  -2.291

  No H/Q in entry =           7
  In of MODEL   32
    1    H    LEU 778           H        LEU 778  36.021  -7.682  -5.948
    2    HA   LEU 778           HA       LEU 778  34.802  -5.582  -7.304
    3    HB2  LEU 778           HB2      LEU 778  36.846  -5.459  -8.772
    4    HB3  LEU 778           HB3      LEU 778  37.117  -5.314  -7.062
    5    HG   LEU 778           HG       LEU 778  38.919  -6.510  -8.169
    6   HD13  LEU 778          HD11      LEU 778  39.140  -8.440  -6.792
    7   HD12  LEU 778          HD12      LEU 778  37.422  -8.456  -6.463
    8   HD11  LEU 778          HD13      LEU 778  38.420  -7.123  -5.859
    9   HD21  LEU 778          HD21      LEU 778  36.823  -8.484  -8.957
   10   HD23  LEU 778          HD22      LEU 778  38.550  -8.788  -9.076
   11   HD22  LEU 778          HD23      LEU 778  37.807  -7.502 -10.047

  No H/Q in entry =          11
  In of MODEL   32
    1    H    TRP 779           H        TRP 779  34.768  -8.891  -8.198
    2    HA   TRP 779           HA       TRP 779  33.841  -8.277 -10.890
    3    HB2  TRP 779           HB2      TRP 779  33.563 -10.788 -11.089
    4    HB3  TRP 779           HB3      TRP 779  35.208 -10.282 -10.721
    5    HD1  TRP 779           HD1      TRP 779  32.177 -12.023  -9.090
    6    HE1  TRP 779           HE1      TRP 779  32.982 -13.213  -6.964
    7    HE3  TRP 779           HE3      TRP 779  36.978 -10.397  -9.048
    8    HZ2  TRP 779           HZ2      TRP 779  35.363 -13.403  -5.458
    9    HZ3  TRP 779           HZ3      TRP 779  38.463 -11.100  -7.223
   10    HH2  TRP 779           HH2      TRP 779  37.671 -12.574  -5.476

  No H/Q in entry =          10
  In of MODEL   32
    1    H    GLY 780           H        GLY 780  32.526  -8.214  -7.885
    2    HA3  GLY 780           HA2      GLY 780  30.279  -7.683  -7.508
    3    HA2  GLY 780           HA3      GLY 780  29.840  -8.617  -8.935

  No H/Q in entry =           3
  In of MODEL   32
    1    H    LYS 781           H        LYS 781  28.347  -9.789  -7.783
    2    HA   LYS 781           HA       LYS 781  29.344 -12.165  -6.584
    3    HB2  LYS 781           HB2      LYS 781  29.395 -11.126  -4.499
    4    HB3  LYS 781           HB3      LYS 781  28.064 -10.045  -4.879
    5    HG2  LYS 781           HG2      LYS 781  27.413 -11.615  -3.145
    6    HG3  LYS 781           HG3      LYS 781  26.488 -11.908  -4.605
    7    HD2  LYS 781           HD2      LYS 781  27.028 -14.040  -3.805
    8    HD3  LYS 781           HD3      LYS 781  28.187 -13.756  -5.092
    9    HE2  LYS 781           HE2      LYS 781  29.927 -13.296  -3.499
   10    HE3  LYS 781           HE3      LYS 781  28.772 -13.312  -2.163
   11    HZ1  LYS 781           HZ1      LYS 781  28.296 -15.646  -2.723
   12    HZ3  LYS 781           HZ2      LYS 781  29.901 -15.464  -2.226
   13    HZ2  LYS 781           HZ3      LYS 781  29.515 -15.647  -3.858

  No H/Q in entry =          13
  In of MODEL   32
    1    H    CYS 782           H        CYS 782  28.147 -13.654  -7.442
    2    HA   CYS 782           HA       CYS 782  25.277 -13.341  -7.471
    3    HB2  CYS 782           HB2      CYS 782  26.045 -12.531  -9.724
    4    HB3  CYS 782           HB3      CYS 782  26.782 -14.108  -9.979

  No H/Q in entry =           4
  In of MODEL   32
    1    H    ASP 783           H        ASP 783  24.750 -14.997  -6.230
    2    HA   ASP 783           HA       ASP 783  26.091 -17.548  -6.758
    3    HB2  ASP 783           HB2      ASP 783  24.568 -16.642  -4.286
    4    HB3  ASP 783           HB3      ASP 783  25.181 -18.272  -4.521

  No H/Q in entry =           4
  In of MODEL   32
    1    H    ALA 784           H        ALA 784  24.155 -19.238  -5.713
    2    HA   ALA 784           HA       ALA 784  22.470 -19.442  -7.965
    3    HB3  ALA 784           HB1      ALA 784  22.285 -20.903  -5.334
    4    HB1  ALA 784           HB2      ALA 784  23.227 -21.407  -6.736
    5    HB2  ALA 784           HB3      ALA 784  21.467 -21.363  -6.827

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLU 785           H        GLU 785  21.919 -18.162  -4.744
    2    HA   GLU 785           HA       GLU 785  19.445 -16.947  -5.694
    3    HB2  GLU 785           HB2      GLU 785  18.862 -19.083  -4.538
    4    HB3  GLU 785           HB3      GLU 785  19.707 -18.513  -3.112
    5    HG2  GLU 785           HG2      GLU 785  18.091 -16.730  -2.848
    6    HG3  GLU 785           HG3      GLU 785  17.263 -17.247  -4.318

  No H/Q in entry =           6
  In of MODEL   32
    1    H    SER 786           H        SER 786  19.320 -14.810  -4.928
    2    HA   SER 786           HA       SER 786  20.862 -13.966  -2.646
    3    HB2  SER 786           HB2      SER 786  21.643 -12.971  -5.398
    4    HB3  SER 786           HB3      SER 786  22.320 -12.423  -3.867
    5    HG   SER 786           HG       SER 786  22.541 -15.042  -3.936

  No H/Q in entry =           5
  In of MODEL   32
    1    H    SER 787           H        SER 787  19.948 -12.148  -1.785
    2    HA   SER 787           HA       SER 787  17.592 -10.986  -2.632
    3    HB2  SER 787           HB2      SER 787  18.607 -10.718  -0.351
    4    HB3  SER 787           HB3      SER 787  19.773  -9.591  -1.032
    5    HG   SER 787           HG       SER 787  16.975  -9.239  -1.205

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LYS 788           H        LYS 788  20.869  -9.560  -3.099
    2    HA   LYS 788           HA       LYS 788  19.985  -8.689  -5.688
    3    HB2  LYS 788           HB2      LYS 788  19.668  -6.636  -4.409
    4    HB3  LYS 788           HB3      LYS 788  21.266  -6.798  -3.697
    5    HG2  LYS 788           HG2      LYS 788  21.208  -5.078  -5.460
    6    HG3  LYS 788           HG3      LYS 788  22.315  -6.391  -5.851
    7    HD2  LYS 788           HD2      LYS 788  20.482  -7.396  -7.248
    8    HD3  LYS 788           HD3      LYS 788  19.544  -5.926  -6.975
    9    HE2  LYS 788           HE2      LYS 788  21.276  -4.605  -8.061
   10    HE3  LYS 788           HE3      LYS 788  22.284  -6.040  -8.243
   11    HZ2  LYS 788           HZ1      LYS 788  19.655  -5.586  -9.562
   12    HZ1  LYS 788           HZ2      LYS 788  20.581  -6.979  -9.715
   13    HZ3  LYS 788           HZ3      LYS 788  21.168  -5.522 -10.300

  No H/Q in entry =          13
  In of MODEL   32
    1    H    CYS 789           H        CYS 789  21.379  -9.178  -7.182
    2    HA   CYS 789           HA       CYS 789  24.147  -9.469  -6.465
    3    HB2  CYS 789           HB2      CYS 789  24.195 -11.760  -7.365
    4    HB3  CYS 789           HB3      CYS 789  23.277 -11.576  -5.865

  No H/Q in entry =           4
  In of MODEL   32
    1    H    VAL 790           H        VAL 790  25.517  -9.396  -8.232
    2    HA   VAL 790           HA       VAL 790  24.624  -9.501 -10.890
    3    HB   VAL 790           HB       VAL 790  23.812  -7.215 -10.228
    4   HG12  VAL 790          HG11      VAL 790  26.716  -6.562  -9.819
    5   HG11  VAL 790          HG12      VAL 790  25.456  -6.608  -8.588
    6   HG13  VAL 790          HG13      VAL 790  25.398  -5.387  -9.861
    7   HG23  VAL 790          HG21      VAL 790  24.804  -5.974 -12.123
    8   HG22  VAL 790          HG22      VAL 790  24.319  -7.619 -12.544
    9   HG21  VAL 790          HG23      VAL 790  26.021  -7.246 -12.264

  No H/Q in entry =           9
  In of MODEL   32
    1    H    CYS 791           H        CYS 791  26.499  -9.412 -12.278
    2    HA   CYS 791           HA       CYS 791  29.010  -9.254 -10.839
    3    HB2  CYS 791           HB2      CYS 791  29.883 -11.100 -12.335
    4    HB3  CYS 791           HB3      CYS 791  28.737 -11.589 -11.098

  No H/Q in entry =           4
  In of MODEL   32
    1    H    ARG 792           H        ARG 792  30.612  -8.305 -11.847
    2    HA   ARG 792           HA       ARG 792  29.854  -6.625 -14.093
    3    HB2  ARG 792           HB2      ARG 792  32.373  -6.716 -12.412
    4    HB3  ARG 792           HB3      ARG 792  32.061  -5.547 -13.686
    5    HG2  ARG 792           HG2      ARG 792  30.411  -5.859 -11.184
    6    HG3  ARG 792           HG3      ARG 792  31.655  -4.632 -11.443
    7    HD2  ARG 792           HD2      ARG 792  30.407  -3.693 -13.278
    8    HD3  ARG 792           HD3      ARG 792  29.214  -4.981 -13.177
    9    HE   ARG 792           HE       ARG 792  29.367  -3.688 -10.715
   10   HH11  ARG 792          HH11      ARG 792  28.375  -2.949 -14.022
   11   HH12  ARG 792          HH12      ARG 792  27.065  -1.960 -13.588
   12   HH21  ARG 792          HH21      ARG 792  27.634  -2.317 -10.066
   13   HH22  ARG 792          HH22      ARG 792  26.638  -1.565 -11.235

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLU 793           H        GLU 793  30.197  -7.195 -16.050
    2    HA   GLU 793           HA       GLU 793  31.369  -9.474 -16.962
    3    HB2  GLU 793           HB2      GLU 793  31.316  -6.835 -18.448
    4    HB3  GLU 793           HB3      GLU 793  31.464  -8.425 -19.170
    5    HG2  GLU 793           HG2      GLU 793  29.250  -7.958 -19.549
    6    HG3  GLU 793           HG3      GLU 793  29.158  -8.860 -18.043

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ALA 794           H        ALA 794  33.384  -9.845 -18.151
    2    HA   ALA 794           HA       ALA 794  35.594  -9.217 -16.530
    3    HB3  ALA 794           HB1      ALA 794  36.910 -10.474 -18.143
    4    HB1  ALA 794           HB2      ALA 794  35.587 -10.408 -19.302
    5    HB2  ALA 794           HB3      ALA 794  35.397 -11.313 -17.799

  No H/Q in entry =           5
  In of MODEL   32
    1    H    SER 795           H        SER 795  34.263  -7.795 -19.364
    2    HA   SER 795           HA       SER 795  36.592  -6.263 -19.991
    3    HB2  SER 795           HB2      SER 795  33.784  -5.895 -21.033
    4    HB3  SER 795           HB3      SER 795  35.271  -5.294 -21.765
    5    HG   SER 795           HG       SER 795  35.330  -7.966 -21.276

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLU 796           H        GLU 796  34.016  -5.928 -17.784
    2    HA   GLU 796           HA       GLU 796  34.135  -3.016 -17.852
    3    HB2  GLU 796           HB2      GLU 796  31.900  -4.092 -17.956
    4    HB3  GLU 796           HB3      GLU 796  32.188  -4.792 -16.374
    5    HG2  GLU 796           HG2      GLU 796  32.107  -2.690 -15.312
    6    HG3  GLU 796           HG3      GLU 796  32.236  -1.831 -16.845

  No H/Q in entry =           6
  In of MODEL   32
    1    H    CYS 797           H        CYS 797  35.143  -5.713 -16.014
    2    HA   CYS 797           HA       CYS 797  35.707  -4.023 -13.724
    3    HB2  CYS 797           HB2      CYS 797  34.873  -6.370 -13.407
    4    HB3  CYS 797           HB3      CYS 797  36.370  -6.947 -14.133

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLU 798           H        GLU 798  37.445  -2.827 -13.794
    2    HA   GLU 798           HA       GLU 798  39.499  -3.446 -15.783
    3    HB2  GLU 798           HB2      GLU 798  40.046  -1.058 -15.626
    4    HB3  GLU 798           HB3      GLU 798  38.373  -1.349 -16.082
    5    HG2  GLU 798           HG2      GLU 798  37.665  -0.914 -13.795
    6    HG3  GLU 798           HG3      GLU 798  39.341  -0.624 -13.334

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU 799           H        GLU 799  39.165  -3.970 -12.596
    2    HA   GLU 799           HA       GLU 799  41.494  -2.873 -11.473
    3    HB2  GLU 799           HB2      GLU 799  39.669  -3.819 -10.106
    4    HB3  GLU 799           HB3      GLU 799  40.075  -5.429 -10.678
    5    HG2  GLU 799           HG2      GLU 799  40.927  -5.041  -8.411
    6    HG3  GLU 799           HG3      GLU 799  42.235  -5.311  -9.557

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLU 800           H        GLU 800  40.938  -5.982 -13.041
    2    HA   GLU 800           HA       GLU 800  42.282  -7.646 -13.748
    3    HB2  GLU 800           HB2      GLU 800  44.281  -5.406 -14.150
    4    HB3  GLU 800           HB3      GLU 800  44.457  -7.026 -14.803
    5    HG2  GLU 800           HG2      GLU 800  42.474  -6.690 -16.173
    6    HG3  GLU 800           HG3      GLU 800  42.265  -5.078 -15.487

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLY 801           H        GLY 801  42.203  -8.457 -11.654
    2    HA3  GLY 801           HA2      GLY 801  44.377  -7.920  -9.849
    3    HA2  GLY 801           HA3      GLY 801  43.029  -9.004  -9.562

  No H/Q in entry =           3
  In of MODEL   32
    1    H    PHE 802           H        PHE 802  44.074 -10.747  -8.925
    2    HA   PHE 802           HA       PHE 802  46.529 -11.635  -9.954
    3    HB2  PHE 802           HB2      PHE 802  44.526 -12.749  -8.089
    4    HB3  PHE 802           HB3      PHE 802  45.785 -13.800  -8.729
    5    HD1  PHE 802           HD1      PHE 802  47.598 -14.044  -7.429
    6    HD2  PHE 802           HD2      PHE 802  45.552 -10.338  -7.360
    7    HE1  PHE 802           HE1      PHE 802  49.167 -13.247  -5.824
    8    HE2  PHE 802           HE2      PHE 802  47.139  -9.482  -5.733
    9    HZ   PHE 802           HZ       PHE 802  48.982 -10.929  -4.927

  No H/Q in entry =           9
  In of MODEL   32
    1    H    SER 803           H        SER 803  47.083 -13.057 -11.352
    2    HA   SER 803           HA       SER 803  44.999 -14.075 -13.075
    3    HB2  SER 803           HB2      SER 803  46.857 -12.933 -14.126
    4    HB3  SER 803           HB3      SER 803  48.014 -14.073 -13.410
    5    HG   SER 803           HG       SER 803  45.867 -14.923 -14.997

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ILE 804           H        ILE 804  44.480 -16.132 -13.211
    2    HA   ILE 804           HA       ILE 804  45.875 -18.077 -11.538
    3    HB   ILE 804           HB       ILE 804  43.822 -18.882 -10.527
    4   HG12  ILE 804          HG12      ILE 804  42.179 -18.372 -12.343
    5   HG13  ILE 804          HG13      ILE 804  41.629 -17.844 -10.758
    6   HG21  ILE 804          HG21      ILE 804  44.920 -17.141  -9.295
    7   HG23  ILE 804          HG22      ILE 804  43.174 -17.006  -9.081
    8   HG22  ILE 804          HG23      ILE 804  44.019 -15.903 -10.169
    9   HD13  ILE 804          HD11      ILE 804  41.036 -16.227 -12.415
   10   HD12  ILE 804          HD12      ILE 804  42.697 -16.097 -12.958
   11   HD11  ILE 804          HD13      ILE 804  42.253 -15.534 -11.344

  No H/Q in entry =          11
  In of MODEL   32
    1    H    CYS 805           H        CYS 805  44.987 -20.333 -12.012
    2    HA   CYS 805           HA       CYS 805  44.514 -20.548 -14.885
    3    HB2  CYS 805           HB2      CYS 805  46.406 -21.855 -14.058
    4    HB3  CYS 805           HB3      CYS 805  45.348 -22.664 -12.898

  No H/Q in entry =           4
  In of MODEL   32
    1    H    VAL 806           H        VAL 806  42.480 -21.217 -15.548
    2    HA   VAL 806           HA       VAL 806  40.809 -22.573 -13.566
    3    HB   VAL 806           HB       VAL 806  39.779 -20.619 -15.609
    4   HG13  VAL 806          HG11      VAL 806  37.694 -20.714 -14.299
    5   HG12  VAL 806          HG12      VAL 806  38.448 -21.928 -13.248
    6   HG11  VAL 806          HG13      VAL 806  38.193 -22.285 -14.936
    7   HG23  VAL 806          HG21      VAL 806  39.369 -19.032 -13.763
    8   HG22  VAL 806          HG22      VAL 806  41.075 -19.320 -14.068
    9   HG21  VAL 806          HG23      VAL 806  40.287 -20.087 -12.680

  No H/Q in entry =           9
  In of MODEL   32
    1    H    GLU 807           H        GLU 807  39.820 -24.341 -14.353
    2    HA   GLU 807           HA       GLU 807  40.331 -25.146 -17.053
    3    HB2  GLU 807           HB2      GLU 807  40.465 -26.779 -15.235
    4    HB3  GLU 807           HB3      GLU 807  38.809 -26.429 -14.776
    5    HG2  GLU 807           HG2      GLU 807  38.026 -27.345 -16.886
    6    HG3  GLU 807           HG3      GLU 807  39.693 -27.652 -17.370

  No H/Q in entry =           6
  In of MODEL   32
    1    H    VAL 808           H        VAL 808  39.077 -24.534 -18.580
    2    HA   VAL 808           HA       VAL 808  36.285 -23.934 -18.030
    3    HB   VAL 808           HB       VAL 808  37.352 -21.770 -18.185
    4   HG12  VAL 808          HG11      VAL 808  38.541 -22.681 -20.794
    5   HG11  VAL 808          HG12      VAL 808  39.411 -22.409 -19.287
    6   HG13  VAL 808          HG13      VAL 808  38.662 -21.051 -20.131
    7   HG23  VAL 808          HG21      VAL 808  36.003 -22.359 -20.818
    8   HG22  VAL 808          HG22      VAL 808  36.275 -20.756 -20.144
    9   HG21  VAL 808          HG23      VAL 808  35.185 -21.882 -19.329

  No H/Q in entry =           9
  In of MODEL   32
    1    H    ASN 809           H        ASN 809  35.074 -25.222 -19.123
    2    HA   ASN 809           HA       ASN 809  34.132 -26.342 -20.876
    3    HB2  ASN 809           HB2      ASN 809  36.095 -24.639 -22.295
    4    HB3  ASN 809           HB3      ASN 809  35.263 -25.882 -23.222
    5   HD21  ASN 809          HD21      ASN 809  33.963 -23.904 -20.570
    6   HD22  ASN 809          HD22      ASN 809  32.823 -23.020 -21.490

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLY 810           H        GLY 810  36.545 -27.154 -19.360
    2    HA3  GLY 810           HA2      GLY 810  37.526 -29.216 -19.197
    3    HA2  GLY 810           HA3      GLY 810  37.113 -29.561 -20.885

  No H/Q in entry =           3
  In of MODEL   32
    1    H    LYS 811           H        LYS 811  38.397 -26.580 -20.926
    2    HA   LYS 811           HA       LYS 811  41.121 -27.556 -21.495
    3    HB2  LYS 811           HB2      LYS 811  40.113 -24.744 -21.887
    4    HB3  LYS 811           HB3      LYS 811  41.468 -25.526 -22.676
    5    HG2  LYS 811           HG2      LYS 811  38.551 -26.013 -23.155
    6    HG3  LYS 811           HG3      LYS 811  39.704 -25.161 -24.197
    7    HD2  LYS 811           HD2      LYS 811  39.860 -28.077 -23.454
    8    HD3  LYS 811           HD3      LYS 811  39.162 -27.473 -24.949
    9    HE2  LYS 811           HE2      LYS 811  41.321 -26.490 -25.573
   10    HE3  LYS 811           HE3      LYS 811  42.024 -27.057 -24.061
   11    HZ1  LYS 811           HZ1      LYS 811  41.560 -29.327 -24.763
   12    HZ3  LYS 811           HZ2      LYS 811  42.571 -28.540 -25.860
   13    HZ2  LYS 811           HZ3      LYS 811  40.942 -28.766 -26.225

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLU 812           H        GLU 812  42.721 -25.735 -20.812
    2    HA   GLU 812           HA       GLU 812  41.889 -24.621 -18.240
    3    HB2  GLU 812           HB2      GLU 812  44.583 -25.873 -18.836
    4    HB3  GLU 812           HB3      GLU 812  44.309 -24.815 -17.463
    5    HG2  GLU 812           HG2      GLU 812  42.626 -26.405 -16.613
    6    HG3  GLU 812           HG3      GLU 812  42.979 -27.493 -17.945

  No H/Q in entry =           6
  In of MODEL   32
    1    H    GLN 813           H        GLN 813  42.028 -22.548 -18.146
    2    HA   GLN 813           HA       GLN 813  43.734 -21.190 -20.084
    3    HB2  GLN 813           HB2      GLN 813  41.514 -21.177 -20.958
    4    HB3  GLN 813           HB3      GLN 813  40.845 -20.677 -19.417
    5    HG2  GLN 813           HG2      GLN 813  41.934 -18.525 -19.649
    6    HG3  GLN 813           HG3      GLN 813  42.620 -19.015 -21.199
    7   HE21  GLN 813          HE21      GLN 813  40.749 -16.859 -20.557
    8   HE22  GLN 813          HE22      GLN 813  39.351 -17.125 -21.520

  No H/Q in entry =           8
  In of MODEL   32
    1    H    THR 814           H        THR 814  44.732 -19.464 -19.325
    2    HA   THR 814           HA       THR 814  44.675 -18.976 -16.492
    3    HB   THR 814           HB       THR 814  46.277 -17.764 -18.721
    4    HG1  THR 814           HG1      THR 814  47.928 -19.231 -17.897
    5   HG21  THR 814          HG21      THR 814  46.678 -17.713 -15.735
    6   HG23  THR 814          HG22      THR 814  46.206 -16.351 -16.745
    7   HG22  THR 814          HG23      THR 814  47.818 -17.056 -16.907

  No H/Q in entry =           7
  In of MODEL   32
    1    H    MET 815           H        MET 815  43.443 -17.411 -15.649
    2    HA   MET 815           HA       MET 815  42.448 -15.310 -17.468
    3    HB2  MET 815           HB2      MET 815  40.907 -16.376 -15.110
    4    HB3  MET 815           HB3      MET 815  40.325 -15.321 -16.384
    5    HG2  MET 815           HG2      MET 815  40.799 -17.368 -17.934
    6    HG3  MET 815           HG3      MET 815  40.887 -18.204 -16.397
    7    HE2  MET 815           HE1      MET 815  37.439 -19.344 -17.764
    8    HE1  MET 815           HE2      MET 815  39.091 -19.820 -17.333
    9    HE3  MET 815           HE3      MET 815  38.799 -18.859 -18.778

  No H/Q in entry =           9
  In of MODEL   32
    1    H    SER 816           H        SER 816  41.634 -13.431 -16.157
    2    HA   SER 816           HA       SER 816  43.399 -12.993 -13.897
    3    HB2  SER 816           HB2      SER 816  43.186 -11.176 -15.689
    4    HB3  SER 816           HB3      SER 816  41.497 -11.017 -15.161
    5    HG   SER 816           HG       SER 816  43.852 -10.356 -13.755

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLU 817           H        GLU 817  42.477 -12.138 -12.062
    2    HA   GLU 817           HA       GLU 817  40.756 -13.541 -10.578
    3    HB2  GLU 817           HB2      GLU 817  42.402 -11.599 -10.289
    4    HB3  GLU 817           HB3      GLU 817  40.987 -10.613 -10.422
    5    HG2  GLU 817           HG2      GLU 817  39.940 -11.759  -8.553
    6    HG3  GLU 817           HG3      GLU 817  41.410 -12.716  -8.344

  No H/Q in entry =           6
  In of MODEL   32
    1    H    CYS 818           H        CYS 818  40.081 -10.465 -12.131
    2    HA   CYS 818           HA       CYS 818  37.427 -10.070 -11.417
    3    HB2  CYS 818           HB2      CYS 818  38.711  -9.176 -13.974
    4    HB3  CYS 818           HB3      CYS 818  37.476  -8.342 -13.028

  No H/Q in entry =           4
  In of MODEL   32
    1    H    GLU 819           H        GLU 819  38.892 -11.465 -14.291
    2    HA   GLU 819           HA       GLU 819  36.568 -11.942 -15.755
    3    HB2  GLU 819           HB2      GLU 819  38.765 -11.790 -16.780
    4    HB3  GLU 819           HB3      GLU 819  39.311 -13.189 -15.880
    5    HG2  GLU 819           HG2      GLU 819  37.802 -14.611 -17.118
    6    HG3  GLU 819           HG3      GLU 819  37.144 -13.200 -17.950

  No H/Q in entry =           6
  In of MODEL   32
    1    H    ALA 820           H        ALA 820  38.686 -14.316 -14.128
    2    HA   ALA 820           HA       ALA 820  37.150 -16.540 -14.460
    3    HB3  ALA 820           HB1      ALA 820  38.900 -15.889 -12.111
    4    HB1  ALA 820           HB2      ALA 820  39.407 -16.614 -13.644
    5    HB2  ALA 820           HB3      ALA 820  38.340 -17.499 -12.553

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLY 821           H        GLY 821  37.022 -14.201 -11.786
    2    HA3  GLY 821           HA2      GLY 821  35.161 -15.542 -10.164
    3    HA2  GLY 821           HA3      GLY 821  35.483 -13.812 -10.142

  No H/Q in entry =           3
  In of MODEL   32
    1    H    ALA 822           H        ALA 822  34.736 -13.111 -12.710
    2    HA   ALA 822           HA       ALA 822  31.961 -12.902 -12.366
    3    HB2  ALA 822           HB1      ALA 822  33.570 -12.221 -14.816
    4    HB1  ALA 822           HB2      ALA 822  33.342 -11.180 -13.409
    5    HB3  ALA 822           HB3      ALA 822  31.947 -11.645 -14.392

  No H/Q in entry =           5
  In of MODEL   32
    1    H    LEU 823           H        LEU 823  33.960 -14.942 -14.481
    2    HA   LEU 823           HA       LEU 823  31.811 -16.026 -15.933
    3    HB2  LEU 823           HB2      LEU 823  34.511 -17.221 -15.318
    4    HB3  LEU 823           HB3      LEU 823  33.280 -18.181 -16.102
    5    HG   LEU 823           HG       LEU 823  34.747 -17.422 -17.793
    6   HD13  LEU 823          HD11      LEU 823  33.366 -16.186 -19.279
    7   HD12  LEU 823          HD12      LEU 823  32.401 -15.598 -17.942
    8   HD11  LEU 823          HD13      LEU 823  32.361 -17.318 -18.359
    9   HD23  LEU 823          HD21      LEU 823  34.353 -14.622 -16.798
   10   HD22  LEU 823          HD22      LEU 823  35.255 -15.090 -18.239
   11   HD21  LEU 823          HD23      LEU 823  35.817 -15.585 -16.638

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ARG 824           H        ARG 824  33.106 -16.945 -12.811
    2    HA   ARG 824           HA       ARG 824  31.477 -19.266 -12.427
    3    HB2  ARG 824           HB2      ARG 824  32.373 -17.391 -10.227
    4    HB3  ARG 824           HB3      ARG 824  31.949 -19.085 -10.066
    5    HG2  ARG 824           HG2      ARG 824  33.976 -19.624 -11.446
    6    HG3  ARG 824           HG3      ARG 824  34.407 -17.914 -11.347
    7    HD2  ARG 824           HD2      ARG 824  34.088 -19.884  -9.111
    8    HD3  ARG 824           HD3      ARG 824  35.588 -19.161  -9.679
    9    HE   ARG 824           HE       ARG 824  33.901 -17.097  -8.875
   10   HH11  ARG 824          HH11      ARG 824  35.632 -19.841  -7.450
   11   HH12  ARG 824          HH12      ARG 824  35.692 -19.184  -5.887
   12   HH21  ARG 824          HH21      ARG 824  34.001 -16.167  -6.632
   13   HH22  ARG 824          HH22      ARG 824  34.763 -17.098  -5.434

  No H/Q in entry =          13
  In of MODEL   32
    1    H    CYS 825           H        CYS 825  31.115 -15.928 -11.458
    2    HA   CYS 825           HA       CYS 825  28.660 -16.109 -10.219
    3    HB2  CYS 825           HB2      CYS 825  30.129 -13.885 -11.531
    4    HB3  CYS 825           HB3      CYS 825  28.573 -13.583 -10.791

  No H/Q in entry =           4
  In of MODEL   32
    1    H    ARG 826           H        ARG 826  29.313 -15.398 -13.673
    2    HA   ARG 826           HA       ARG 826  26.557 -14.944 -14.219
    3    HB2  ARG 826           HB2      ARG 826  27.168 -15.052 -16.603
    4    HB3  ARG 826           HB3      ARG 826  28.173 -13.921 -15.684
    5    HG2  ARG 826           HG2      ARG 826  29.951 -15.488 -15.699
    6    HG3  ARG 826           HG3      ARG 826  28.944 -16.704 -16.494
    7    HD2  ARG 826           HD2      ARG 826  29.652 -14.009 -17.642
    8    HD3  ARG 826           HD3      ARG 826  30.449 -15.522 -18.056
    9    HE   ARG 826           HE       ARG 826  27.856 -16.052 -18.545
   10   HH11  ARG 826          HH11      ARG 826  29.813 -13.275 -19.519
   11   HH12  ARG 826          HH12      ARG 826  29.224 -13.228 -21.109
   12   HH21  ARG 826          HH21      ARG 826  27.009 -15.968 -20.744
   13   HH22  ARG 826          HH22      ARG 826  27.613 -14.771 -21.811

  No H/Q in entry =          13
  In of MODEL   32
    1    H    GLY 827           H        GLY 827  28.346 -17.819 -13.900
    2    HA3  GLY 827           HA2      GLY 827  27.088 -19.842 -13.655
    3    HA2  GLY 827           HA3      GLY 827  25.967 -19.245 -14.864

  No H/Q in entry =           3
  In of MODEL   32
    1    H    GLN 828           H        GLN 828  29.101 -18.592 -15.815
    2    HA   GLN 828           HA       GLN 828  29.094 -20.519 -17.904
    3    HB2  GLN 828           HB2      GLN 828  30.421 -18.481 -18.153
    4    HB3  GLN 828           HB3      GLN 828  31.371 -18.885 -16.733
    5    HG2  GLN 828           HG2      GLN 828  32.732 -19.340 -18.663
    6    HG3  GLN 828           HG3      GLN 828  32.247 -20.869 -17.954
    7   HE21  GLN 828          HE21      GLN 828  30.217 -18.854 -20.020
    8   HE22  GLN 828          HE22      GLN 828  30.146 -19.985 -21.310

  No H/Q in entry =           8
  In of MODEL   32
    1    H    SER 829           H        SER 829  30.327 -22.453 -18.056
    2    HA   SER 829           HA       SER 829  30.617 -23.726 -15.457
    3    HB2  SER 829           HB2      SER 829  30.827 -24.941 -18.213
    4    HB3  SER 829           HB3      SER 829  30.575 -25.808 -16.692
    5    HG   SER 829           HG       SER 829  28.821 -23.779 -17.448

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ILE 830           H        ILE 830  32.514 -23.400 -14.506
    2    HA   ILE 830           HA       ILE 830  34.956 -24.086 -15.916
    3    HB   ILE 830           HB       ILE 830  36.203 -22.170 -15.179
    4   HG12  ILE 830          HG12      ILE 830  35.044 -21.631 -13.048
    5   HG13  ILE 830          HG13      ILE 830  35.296 -20.215 -14.040
    6   HG22  ILE 830          HG21      ILE 830  35.227 -20.318 -16.461
    7   HG21  ILE 830          HG22      ILE 830  33.736 -21.268 -16.576
    8   HG23  ILE 830          HG23      ILE 830  35.221 -21.875 -17.303
    9   HD11  ILE 830          HD11      ILE 830  32.961 -20.324 -14.780
   10   HD13  ILE 830          HD12      ILE 830  33.128 -20.109 -13.047
   11   HD12  ILE 830          HD13      ILE 830  32.709 -21.694 -13.700

  No H/Q in entry =          11
  In of MODEL   32
    1    H    SER 831           H        SER 831  36.693 -24.426 -14.462
    2    HA   SER 831           HA       SER 831  35.956 -24.846 -11.672
    3    HB2  SER 831           HB2      SER 831  37.314 -26.690 -13.586
    4    HB3  SER 831           HB3      SER 831  37.471 -26.828 -11.837
    5    HG   SER 831           HG       SER 831  35.128 -27.044 -13.465

  No H/Q in entry =           5
  In of MODEL   32
    1    H    VAL 832           H        VAL 832  37.242 -23.380 -10.627
    2    HA   VAL 832           HA       VAL 832  39.754 -22.521 -11.659
    3    HB   VAL 832           HB       VAL 832  38.627 -22.260  -8.856
    4   HG11  VAL 832          HG11      VAL 832  41.072 -21.947  -8.878
    5   HG13  VAL 832          HG12      VAL 832  40.255 -20.415  -8.566
    6   HG12  VAL 832          HG13      VAL 832  40.911 -20.754 -10.168
    7   HG22  VAL 832          HG21      VAL 832  38.028 -19.967  -9.526
    8   HG21  VAL 832          HG22      VAL 832  37.216 -21.182 -10.515
    9   HG23  VAL 832          HG23      VAL 832  38.602 -20.307 -11.156

  No H/Q in entry =           9
  In of MODEL   32
    1    H    THR 833           H        THR 833  41.504 -23.735 -11.782
    2    HA   THR 833           HA       THR 833  41.671 -26.112 -10.171
    3    HB   THR 833           HB       THR 833  43.567 -26.603 -11.765
    4    HG1  THR 833           HG1      THR 833  43.954 -25.195 -13.352
    5   HG23  THR 833          HG21      THR 833  41.315 -27.505 -12.120
    6   HG22  THR 833          HG22      THR 833  42.037 -27.045 -13.666
    7   HG21  THR 833          HG23      THR 833  40.833 -26.008 -12.912

  No H/Q in entry =           7
  In of MODEL   32
    1    H    SER 834           H        SER 834  43.376 -23.073 -10.616
    2    HA   SER 834           HA       SER 834  44.911 -23.558  -8.203
    3    HB2  SER 834           HB2      SER 834  46.228 -23.063 -10.887
    4    HB3  SER 834           HB3      SER 834  47.040 -22.982  -9.331
    5    HG   SER 834           HG       SER 834  45.631 -25.310  -9.939

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ILE 835           H        ILE 835  45.750 -21.544  -7.321
    2    HA   ILE 835           HA       ILE 835  44.451 -19.283  -8.585
    3    HB   ILE 835           HB       ILE 835  44.433 -18.077  -6.669
    4   HG12  ILE 835          HG12      ILE 835  46.849 -18.087  -6.091
    5   HG13  ILE 835          HG13      ILE 835  45.833 -18.265  -4.673
    6   HG23  ILE 835          HG21      ILE 835  43.011 -19.879  -6.330
    7   HG22  ILE 835          HG22      ILE 835  43.827 -19.562  -4.777
    8   HG21  ILE 835          HG23      ILE 835  44.338 -20.905  -5.789
    9   HD12  ILE 835          HD11      ILE 835  47.398 -20.360  -6.082
   10   HD11  ILE 835          HD12      ILE 835  46.318 -20.613  -4.682
   11   HD13  ILE 835          HD13      ILE 835  47.746 -19.565  -4.532

  No H/Q in entry =          11
  In of MODEL   32
    1    H    ARG 836           H        ARG 836  47.097 -20.781  -8.948
    2    HA   ARG 836           HA       ARG 836  48.681 -18.423  -9.586
    3    HB2  ARG 836           HB2      ARG 836  50.559 -19.909  -9.861
    4    HB3  ARG 836           HB3      ARG 836  49.831 -20.165  -8.288
    5    HG2  ARG 836           HG2      ARG 836  48.736 -22.135  -9.106
    6    HG3  ARG 836           HG3      ARG 836  49.470 -21.897 -10.703
    7    HD2  ARG 836           HD2      ARG 836  51.628 -21.910  -9.643
    8    HD3  ARG 836           HD3      ARG 836  50.829 -22.244  -8.100
    9    HE   ARG 836           HE       ARG 836  50.576 -24.038 -10.427
   10   HH11  ARG 836          HH11      ARG 836  51.298 -23.650  -6.986
   11   HH12  ARG 836          HH12      ARG 836  51.489 -25.302  -6.678
   12   HH21  ARG 836          HH21      ARG 836  50.851 -26.293 -10.050
   13   HH22  ARG 836          HH22      ARG 836  51.223 -26.875  -8.497

  No H/Q in entry =          13
  In of MODEL   32
    1    HA   PRO 837           HA       PRO 837  47.350 -19.044 -13.754
    2    HB2  PRO 837           HB2      PRO 837  49.455 -18.074 -15.150
    3    HB3  PRO 837           HB3      PRO 837  48.351 -17.031 -14.245
    4    HG2  PRO 837           HG2      PRO 837  51.049 -18.064 -13.459
    5    HG3  PRO 837           HG3      PRO 837  50.380 -16.431 -13.291
    6    HD2  PRO 837           HD2      PRO 837  50.457 -18.160 -11.233
    7    HD3  PRO 837           HD3      PRO 837  49.147 -16.979 -11.437

  No H/Q in entry =           7
  In of MODEL   32
    1    H    CYS 838           H        CYS 838  47.878 -20.175 -15.784
    2    HA   CYS 838           HA       CYS 838  49.950 -22.066 -15.357
    3    HB2  CYS 838           HB2      CYS 838  47.218 -22.607 -16.347
    4    HB3  CYS 838           HB3      CYS 838  48.513 -23.615 -16.975

  No H/Q in entry =           4
  In of MODEL   32
    1    H    ALA 839           H        ALA 839  50.262 -23.267 -17.826
    2    HA   ALA 839           HA       ALA 839  51.697 -21.294 -19.242
    3    HB3  ALA 839           HB1      ALA 839  52.295 -23.090 -20.740
    4    HB2  ALA 839           HB2      ALA 839  50.993 -24.087 -20.087
    5    HB1  ALA 839           HB3      ALA 839  52.357 -23.641 -19.062

  No H/Q in entry =           5
  In of MODEL   32
    1    H    ALA 840           H        ALA 840  48.512 -21.550 -19.248
    2    HA   ALA 840           HA       ALA 840  47.969 -21.406 -22.067
    3    HB1  ALA 840           HB1      ALA 840  46.152 -20.984 -19.704
    4    HB2  ALA 840           HB2      ALA 840  46.402 -22.508 -20.559
    5    HB3  ALA 840           HB3      ALA 840  45.645 -21.145 -21.386

  No H/Q in entry =           5
  In of MODEL   32
    1    H    GLU 841           H        GLU 841  49.450 -19.324 -20.226
    2    HA   GLU 841           HA       GLU 841  48.018 -16.969 -21.230
    3    HB2  GLU 841           HB2      GLU 841  49.412 -15.662 -19.682
    4    HB3  GLU 841           HB3      GLU 841  48.487 -16.898 -18.843
    5    HG2  GLU 841           HG2      GLU 841  50.372 -18.234 -18.487
    6    HG3  GLU 841           HG3      GLU 841  51.317 -17.365 -19.693

  No H/Q in entry =           6
  In of MODEL   32
    1    H    THR 842           H        THR 842  50.496 -19.014 -21.982
    2    HA   THR 842           HA       THR 842  52.017 -16.927 -23.335
    3    HB   THR 842           HB       THR 842  53.926 -18.660 -23.183
    4    HG1  THR 842           HG1      THR 842  52.606 -20.338 -22.381
    5   HG22  THR 842          HG21      THR 842  52.993 -17.240 -20.670
    6   HG21  THR 842          HG22      THR 842  53.902 -16.502 -21.977
    7   HG23  THR 842          HG23      THR 842  54.638 -17.774 -21.006

  No H/Q in entry =           7
  In of MODEL   32
    1    H    GLN 843           H        GLN 843  50.896 -17.083 -25.246
    2    HA   GLN 843           HA       GLN 843  51.896 -19.144 -26.887
    3    HB2  GLN 843           HB2      GLN 843  49.663 -19.602 -28.008
    4    HB3  GLN 843           HB3      GLN 843  49.866 -20.314 -26.425
    5    HG2  GLN 843           HG2      GLN 843  48.404 -17.719 -26.786
    6    HG3  GLN 843           HG3      GLN 843  47.603 -19.261 -27.064
    7   HE21  GLN 843          HE21      GLN 843  47.035 -17.230 -25.105
    8   HE22  GLN 843          HE22      GLN 843  47.134 -18.006 -23.561

  No H/Q in entry =           8
  In of MODEL   33
    1    H1   GLY 689           H1       GLY 689  50.491  -5.647 -20.598
    2    H2   GLY 689           H3       GLY 689  51.159  -4.993 -19.194
    3    H3   GLY 689           H2       GLY 689  50.625  -6.590 -19.206
    4    HA2  GLY 689           HA2      GLY 689  49.032  -5.169 -18.076
    5    HA3  GLY 689           HA3      GLY 689  48.358  -5.879 -19.536

  No H/Q in entry =           5
  In of MODEL   33
    1    H    SER 690           H        SER 690  50.532  -3.085 -19.045
    2    HA   SER 690           HA       SER 690  48.541  -1.259 -19.914
    3    HB2  SER 690           HB2      SER 690  51.503  -0.902 -19.412
    4    HB3  SER 690           HB3      SER 690  50.343   0.407 -19.673
    5    HG   SER 690           HG       SER 690  49.343  -0.078 -17.827

  No H/Q in entry =           5
  In of MODEL   33
    1    H    HIS 691           H        HIS 691  47.955  -1.766 -21.952
    2    HA   HIS 691           HA       HIS 691  49.998  -1.349 -24.032
    3    HB2  HIS 691           HB2      HIS 691  48.910  -3.657 -23.960
    4    HB3  HIS 691           HB3      HIS 691  47.395  -2.871 -24.369
    5    HD1  HIS 691           HD1      HIS 691  46.976  -2.457 -26.862
    6    HD2  HIS 691           HD2      HIS 691  50.901  -3.489 -26.016
    7    HE1  HIS 691           HE1      HIS 691  48.068  -2.798 -29.071
    8    HE2  HIS 691           HE2      HIS 691  50.481  -3.220 -28.535

  No H/Q in entry =           8
  In of MODEL   33
    1    H    MET 692           H        MET 692  46.456  -1.132 -23.546
    2    HA   MET 692           HA       MET 692  46.488   1.322 -25.098
    3    HB2  MET 692           HB2      MET 692  44.017   1.257 -25.047
    4    HB3  MET 692           HB3      MET 692  44.705  -0.194 -25.736
    5    HG2  MET 692           HG2      MET 692  44.275  -1.366 -23.627
    6    HG3  MET 692           HG3      MET 692  43.560   0.111 -22.972
    7    HE1  MET 692           HE1      MET 692  42.100  -2.753 -23.090
    8    HE3  MET 692           HE2      MET 692  40.477  -2.268 -23.579
    9    HE2  MET 692           HE3      MET 692  41.361  -1.315 -22.388

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ASN 693           H        ASN 693  46.921   0.568 -21.973
    2    HA   ASN 693           HA       ASN 693  45.916   3.201 -21.172
    3    HB2  ASN 693           HB2      ASN 693  45.906   2.468 -18.818
    4    HB3  ASN 693           HB3      ASN 693  44.899   1.411 -19.784
    5   HD21  ASN 693          HD21      ASN 693  45.426  -0.734 -19.908
    6   HD22  ASN 693          HD22      ASN 693  46.658  -1.469 -18.978

  No H/Q in entry =           6
  In of MODEL   33
    1    HA   PRO 694           HA       PRO 694  50.159   4.413 -20.710
    2    HB2  PRO 694           HB2      PRO 694  49.839   6.535 -19.063
    3    HB3  PRO 694           HB3      PRO 694  49.381   6.605 -20.767
    4    HG2  PRO 694           HG2      PRO 694  47.669   6.168 -18.358
    5    HG3  PRO 694           HG3      PRO 694  47.350   7.175 -19.779
    6    HD2  PRO 694           HD2      PRO 694  46.263   4.707 -19.454
    7    HD3  PRO 694           HD3      PRO 694  46.659   5.386 -21.046

  No H/Q in entry =           7
  In of MODEL   33
    1    H    LEU 695           H        LEU 695  51.771   4.834 -18.879
    2    HA   LEU 695           HA       LEU 695  50.962   3.649 -16.400
    3    HB2  LEU 695           HB2      LEU 695  52.831   2.020 -16.386
    4    HB3  LEU 695           HB3      LEU 695  51.608   1.665 -17.577
    5    HG   LEU 695           HG       LEU 695  54.323   2.878 -18.208
    6   HD11  LEU 695          HD11      LEU 695  53.332   0.044 -18.464
    7   HD13  LEU 695          HD12      LEU 695  54.540   0.634 -17.320
    8   HD12  LEU 695          HD13      LEU 695  54.881   0.648 -19.050
    9   HD21  LEU 695          HD21      LEU 695  52.593   3.363 -19.920
   10   HD23  LEU 695          HD22      LEU 695  52.253   1.637 -20.045
   11   HD22  LEU 695          HD23      LEU 695  53.831   2.262 -20.523

  No H/Q in entry =          11
  In of MODEL   33
    1    H    THR 696           H        THR 696  52.046   4.337 -14.665
    2    HA   THR 696           HA       THR 696  53.320   6.778 -14.646
    3    HB   THR 696           HB       THR 696  53.647   4.600 -12.587
    4    HG1  THR 696           HG1      THR 696  51.605   5.244 -11.842
    5   HG21  THR 696          HG21      THR 696  54.854   6.737 -12.184
    6   HG23  THR 696          HG22      THR 696  53.568   6.474 -11.010
    7   HG22  THR 696          HG23      THR 696  53.327   7.605 -12.338

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLN 697           H        GLN 697  54.717   3.539 -14.453
    2    HA   GLN 697           HA       GLN 697  57.388   4.628 -14.932
    3    HB2  GLN 697           HB2      GLN 697  58.220   2.879 -13.525
    4    HB3  GLN 697           HB3      GLN 697  57.276   4.072 -12.648
    5    HG2  GLN 697           HG2      GLN 697  55.391   2.498 -12.591
    6    HG3  GLN 697           HG3      GLN 697  56.379   1.305 -13.447
    7   HE21  GLN 697          HE21      GLN 697  58.793   2.180 -12.154
    8   HE22  GLN 697          HE22      GLN 697  58.749   1.614 -10.559

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ALA 698           H        ALA 698  58.817   2.825 -15.742
    2    HA   ALA 698           HA       ALA 698  57.590   1.588 -17.972
    3    HB1  ALA 698           HB1      ALA 698  59.799   0.549 -18.321
    4    HB3  ALA 698           HB2      ALA 698  60.310   1.121 -16.732
    5    HB2  ALA 698           HB3      ALA 698  59.932   2.275 -18.003

  No H/Q in entry =           5
  In of MODEL   33
    1    H    VAL 699           H        VAL 699  57.391  -0.665 -18.371
    2    HA   VAL 699           HA       VAL 699  55.958  -2.084 -16.493
    3    HB   VAL 699           HB       VAL 699  57.488  -3.231 -18.850
    4   HG12  VAL 699          HG11      VAL 699  55.866  -5.088 -18.763
    5   HG11  VAL 699          HG12      VAL 699  55.180  -4.404 -17.290
    6   HG13  VAL 699          HG13      VAL 699  56.840  -4.995 -17.293
    7   HG23  VAL 699          HG21      VAL 699  54.625  -2.295 -18.631
    8   HG22  VAL 699          HG22      VAL 699  55.344  -3.066 -20.041
    9   HG21  VAL 699          HG23      VAL 699  55.915  -1.481 -19.513

  No H/Q in entry =           9
  In of MODEL   33
    1    HA   PRO 700           HA       PRO 700  59.396  -3.620 -14.011
    2    HB2  PRO 700           HB2      PRO 700  57.418  -4.508 -12.112
    3    HB3  PRO 700           HB3      PRO 700  58.581  -3.200 -11.940
    4    HG2  PRO 700           HG2      PRO 700  55.876  -2.807 -12.127
    5    HG3  PRO 700           HG3      PRO 700  57.088  -1.605 -12.600
    6    HD2  PRO 700           HD2      PRO 700  55.498  -3.470 -14.311
    7    HD3  PRO 700           HD3      PRO 700  55.980  -1.777 -14.589

  No H/Q in entry =           7
  In of MODEL   33
    1    H    LYS 701           H        LYS 701  60.206  -5.633 -14.168
    2    HA   LYS 701           HA       LYS 701  58.359  -7.704 -14.945
    3    HB2  LYS 701           HB2      LYS 701  60.480  -9.122 -15.377
    4    HB3  LYS 701           HB3      LYS 701  60.103  -7.818 -16.472
    5    HG2  LYS 701           HG2      LYS 701  62.436  -7.844 -16.125
    6    HG3  LYS 701           HG3      LYS 701  61.806  -6.432 -15.290
    7    HD2  LYS 701           HD2      LYS 701  61.999  -7.567 -13.159
    8    HD3  LYS 701           HD3      LYS 701  62.480  -9.061 -13.962
    9    HE2  LYS 701           HE2      LYS 701  64.421  -7.904 -13.047
   10    HE3  LYS 701           HE3      LYS 701  64.496  -7.977 -14.803
   11    HZ1  LYS 701           HZ1      LYS 701  63.687  -5.672 -14.866
   12    HZ3  LYS 701           HZ2      LYS 701  65.126  -5.795 -14.015
   13    HZ2  LYS 701           HZ3      LYS 701  63.678  -5.623 -13.187

  No H/Q in entry =          13
  In of MODEL   33
    1    H    CYS 702           H        CYS 702  57.843  -7.067 -12.596
    2    HA   CYS 702           HA       CYS 702  58.875  -9.135 -10.741
    3    HB2  CYS 702           HB2      CYS 702  57.054  -6.801 -10.060
    4    HB3  CYS 702           HB3      CYS 702  58.045  -7.771  -8.990

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLN 703           H        GLN 703  57.049 -10.094  -9.394
    2    HA   GLN 703           HA       GLN 703  54.921 -10.739 -11.229
    3    HB2  GLN 703           HB2      GLN 703  56.060 -11.976  -8.828
    4    HB3  GLN 703           HB3      GLN 703  54.344 -12.244  -9.138
    5    HG2  GLN 703           HG2      GLN 703  56.551 -12.708 -11.104
    6    HG3  GLN 703           HG3      GLN 703  55.753 -13.972 -10.149
    7   HE21  GLN 703          HE21      GLN 703  55.817 -13.615 -13.045
    8   HE22  GLN 703          HE22      GLN 703  54.180 -13.501 -13.565

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ARG 704           H        ARG 704  52.841 -11.212 -10.179
    2    HA   ARG 704           HA       ARG 704  51.520  -8.768  -9.827
    3    HB2  ARG 704           HB2      ARG 704  50.659 -11.595  -9.303
    4    HB3  ARG 704           HB3      ARG 704  49.554 -10.222  -9.273
    5    HG2  ARG 704           HG2      ARG 704  49.824  -9.814 -11.549
    6    HG3  ARG 704           HG3      ARG 704  51.294 -10.796 -11.625
    7    HD2  ARG 704           HD2      ARG 704  49.999 -12.800 -11.303
    8    HD3  ARG 704           HD3      ARG 704  48.529 -11.858 -11.077
    9    HE   ARG 704           HE       ARG 704  48.529 -11.319 -13.348
   10   HH11  ARG 704          HH11      ARG 704  51.253 -13.520 -12.608
   11   HH12  ARG 704          HH12      ARG 704  51.366 -14.084 -14.205
   12   HH21  ARG 704          HH21      ARG 704  48.738 -12.118 -15.523
   13   HH22  ARG 704          HH22      ARG 704  49.924 -13.281 -15.889

  No H/Q in entry =          13
  In of MODEL   33
    1    H    TRP 705           H        TRP 705  52.887 -10.873  -7.489
    2    HA   TRP 705           HA       TRP 705  51.567  -9.523  -5.245
    3    HB2  TRP 705           HB2      TRP 705  52.699 -11.368  -3.930
    4    HB3  TRP 705           HB3      TRP 705  51.448 -11.884  -5.048
    5    HD1  TRP 705           HD1      TRP 705  55.144 -12.201  -4.335
    6    HE1  TRP 705           HE1      TRP 705  56.139 -14.006  -5.869
    7    HE3  TRP 705           HE3      TRP 705  51.172 -12.932  -7.454
    8    HZ2  TRP 705           HZ2      TRP 705  55.359 -15.549  -8.080
    9    HZ3  TRP 705           HZ3      TRP 705  51.389 -14.572  -9.266
   10    HH2  TRP 705           HH2      TRP 705  53.436 -15.865  -9.562

  No H/Q in entry =          10
  In of MODEL   33
    1    H    GLU 706           H        GLU 706  54.033  -8.790  -7.130
    2    HA   GLU 706           HA       GLU 706  55.723  -7.802  -4.953
    3    HB2  GLU 706           HB2      GLU 706  56.647  -8.770  -7.671
    4    HB3  GLU 706           HB3      GLU 706  57.670  -8.107  -6.381
    5    HG2  GLU 706           HG2      GLU 706  57.201 -10.034  -5.033
    6    HG3  GLU 706           HG3      GLU 706  56.083 -10.653  -6.251

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LYS 707           H        LYS 707  56.747  -5.840  -5.423
    2    HA   LYS 707           HA       LYS 707  55.623  -4.243  -7.629
    3    HB2  LYS 707           HB2      LYS 707  56.193  -3.308  -4.807
    4    HB3  LYS 707           HB3      LYS 707  55.592  -2.305  -6.114
    5    HG2  LYS 707           HG2      LYS 707  54.140  -4.632  -4.875
    6    HG3  LYS 707           HG3      LYS 707  53.858  -2.937  -4.494
    7    HD2  LYS 707           HD2      LYS 707  53.514  -4.138  -7.249
    8    HD3  LYS 707           HD3      LYS 707  52.196  -3.920  -6.101
    9    HE2  LYS 707           HE2      LYS 707  52.570  -1.506  -6.131
   10    HE3  LYS 707           HE3      LYS 707  53.916  -1.711  -7.247
   11    HZ3  LYS 707           HZ1      LYS 707  52.359  -2.608  -8.888
   12    HZ2  LYS 707           HZ2      LYS 707  51.838  -1.087  -8.402
   13    HZ1  LYS 707           HZ3      LYS 707  51.095  -2.452  -7.814

  No H/Q in entry =          13
  In of MODEL   33
    1    H    LEU 708           H        LEU 708  57.072  -2.367  -8.090
    2    HA   LEU 708           HA       LEU 708  59.871  -3.145  -7.677
    3    HB2  LEU 708           HB2      LEU 708  59.122  -3.184  -9.985
    4    HB3  LEU 708           HB3      LEU 708  58.595  -1.515  -9.863
    5    HG   LEU 708           HG       LEU 708  61.007  -0.915  -9.400
    6   HD11  LEU 708          HD11      LEU 708  61.821  -3.102  -8.764
    7   HD13  LEU 708          HD12      LEU 708  62.722  -2.468 -10.139
    8   HD12  LEU 708          HD13      LEU 708  61.498  -3.711 -10.388
    9   HD22  LEU 708          HD21      LEU 708  61.643  -0.986 -11.741
   10   HD21  LEU 708          HD22      LEU 708  59.962  -0.492 -11.543
   11   HD23  LEU 708          HD23      LEU 708  60.350  -2.134 -12.076

  No H/Q in entry =          11
  In of MODEL   33
    1    H    GLN 709           H        GLN 709  60.821  -1.922  -6.192
    2    HA   GLN 709           HA       GLN 709  60.687   0.961  -6.442
    3    HB2  GLN 709           HB2      GLN 709  60.079   1.429  -4.207
    4    HB3  GLN 709           HB3      GLN 709  58.946   0.171  -4.664
    5    HG2  GLN 709           HG2      GLN 709  60.441  -1.486  -3.551
    6    HG3  GLN 709           HG3      GLN 709  61.430  -0.129  -3.004
    7   HE21  GLN 709          HE21      GLN 709  61.077  -0.465  -0.883
    8   HE22  GLN 709          HE22      GLN 709  59.552  -0.251  -0.110

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ASN 710           H        ASN 710  62.626   1.870  -5.703
    2    HA   ASN 710           HA       ASN 710  64.882   1.954  -5.132
    3    HB2  ASN 710           HB2      ASN 710  63.807   0.953  -3.016
    4    HB3  ASN 710           HB3      ASN 710  64.336  -0.610  -3.596
    5   HD21  ASN 710          HD21      ASN 710  65.229   2.321  -2.142
    6   HD22  ASN 710          HD22      ASN 710  66.868   1.929  -1.773

  No H/Q in entry =           6
  In of MODEL   33
    1    H    SER 711           H        SER 711  63.784   0.454  -7.343
    2    HA   SER 711           HA       SER 711  64.242  -0.795  -9.063
    3    HB2  SER 711           HB2      SER 711  66.530  -0.890  -9.893
    4    HB3  SER 711           HB3      SER 711  66.180   0.670  -9.147
    5    HG   SER 711           HG       SER 711  67.170  -0.808  -7.236

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ARG 712           H        ARG 712  63.908  -2.105  -6.379
    2    HA   ARG 712           HA       ARG 712  64.887  -4.748  -7.198
    3    HB2  ARG 712           HB2      ARG 712  64.799  -5.441  -4.859
    4    HB3  ARG 712           HB3      ARG 712  65.852  -4.044  -5.035
    5    HG2  ARG 712           HG2      ARG 712  64.334  -2.618  -4.016
    6    HG3  ARG 712           HG3      ARG 712  62.990  -3.729  -4.251
    7    HD2  ARG 712           HD2      ARG 712  63.635  -3.691  -1.925
    8    HD3  ARG 712           HD3      ARG 712  64.001  -5.262  -2.623
    9    HE   ARG 712           HE       ARG 712  66.312  -3.859  -2.839
   10   HH11  ARG 712          HH11      ARG 712  64.117  -4.624  -0.129
   11   HH12  ARG 712          HH12      ARG 712  65.369  -4.710   1.015
   12   HH21  ARG 712          HH21      ARG 712  68.020  -3.962  -1.191
   13   HH22  ARG 712          HH22      ARG 712  67.595  -4.336   0.419

  No H/Q in entry =          13
  In of MODEL   33
    1    H    CYS 713           H        CYS 713  63.395  -6.483  -6.345
    2    HA   CYS 713           HA       CYS 713  60.641  -5.693  -6.903
    3    HB2  CYS 713           HB2      CYS 713  61.845  -8.452  -6.637
    4    HB3  CYS 713           HB3      CYS 713  60.283  -8.043  -7.338

  No H/Q in entry =           4
  In of MODEL   33
    1    H    VAL 714           H        VAL 714  59.447  -5.335  -5.150
    2    HA   VAL 714           HA       VAL 714  60.193  -6.712  -2.673
    3    HB   VAL 714           HB       VAL 714  59.025  -4.905  -1.423
    4   HG13  VAL 714          HG11      VAL 714  60.695  -3.156  -1.734
    5   HG12  VAL 714          HG12      VAL 714  61.172  -3.892  -3.263
    6   HG11  VAL 714          HG13      VAL 714  61.434  -4.760  -1.749
    7   HG23  VAL 714          HG21      VAL 714  58.433  -2.811  -2.564
    8   HG22  VAL 714          HG22      VAL 714  57.472  -4.174  -3.143
    9   HG21  VAL 714          HG23      VAL 714  58.809  -3.560  -4.115

  No H/Q in entry =           9
  In of MODEL   33
    1    H    CYS 715           H        CYS 715  58.524  -7.434  -1.318
    2    HA   CYS 715           HA       CYS 715  56.276  -8.361  -2.901
    3    HB2  CYS 715           HB2      CYS 715  57.075  -9.097  -0.073
    4    HB3  CYS 715           HB3      CYS 715  55.929  -9.942  -1.097

  No H/Q in entry =           4
  In of MODEL   33
    1    H    LYS 716           H        LYS 716  54.173  -7.967  -2.316
    2    HA   LYS 716           HA       LYS 716  53.466  -5.598  -0.917
    3    HB2  LYS 716           HB2      LYS 716  51.872  -8.023  -1.769
    4    HB3  LYS 716           HB3      LYS 716  51.144  -6.547  -1.152
    5    HG2  LYS 716           HG2      LYS 716  52.922  -6.584  -3.577
    6    HG3  LYS 716           HG3      LYS 716  51.181  -6.856  -3.668
    7    HD2  LYS 716           HD2      LYS 716  52.111  -4.468  -2.166
    8    HD3  LYS 716           HD3      LYS 716  52.276  -4.428  -3.917
    9    HE2  LYS 716           HE2      LYS 716  50.192  -3.455  -2.967
   10    HE3  LYS 716           HE3      LYS 716  49.915  -4.674  -4.227
   11    HZ1  LYS 716           HZ1      LYS 716  49.462  -6.221  -2.313
   12    HZ3  LYS 716           HZ2      LYS 716  48.378  -4.970  -2.480
   13    HZ2  LYS 716           HZ3      LYS 716  49.584  -4.868  -1.289

  No H/Q in entry =          13
  In of MODEL   33
    1    H    MET 717           H        MET 717  51.632  -5.900   0.994
    2    HA   MET 717           HA       MET 717  52.802  -7.902   2.818
    3    HB2  MET 717           HB2      MET 717  51.376  -5.321   3.604
    4    HB3  MET 717           HB3      MET 717  51.845  -6.567   4.717
    5    HG2  MET 717           HG2      MET 717  53.973  -5.409   3.013
    6    HG3  MET 717           HG3      MET 717  53.309  -4.407   4.295
    7    HE2  MET 717           HE1      MET 717  55.638  -8.362   4.985
    8    HE1  MET 717           HE2      MET 717  55.256  -7.693   3.392
    9    HE3  MET 717           HE3      MET 717  53.992  -8.418   4.382

  No H/Q in entry =           9
  In of MODEL   33
    1    HA   PRO 718           HA       PRO 718  49.174 -10.216   2.282
    2    HB2  PRO 718           HB2      PRO 718  49.077 -11.656   4.604
    3    HB3  PRO 718           HB3      PRO 718  50.172 -12.012   3.265
    4    HG2  PRO 718           HG2      PRO 718  50.707 -10.540   5.808
    5    HG3  PRO 718           HG3      PRO 718  51.726 -11.715   4.961
    6    HD2  PRO 718           HD2      PRO 718  52.144  -9.052   4.828
    7    HD3  PRO 718           HD3      PRO 718  52.515 -10.134   3.467

  No H/Q in entry =           7
  In of MODEL   33
    1    H    TYR 719           H        TYR 719  49.360  -7.957   4.801
    2    HA   TYR 719           HA       TYR 719  46.558  -8.353   5.495
    3    HB2  TYR 719           HB2      TYR 719  47.013  -6.868   7.412
    4    HB3  TYR 719           HB3      TYR 719  48.038  -8.293   7.409
    5    HD1  TYR 719           HD1      TYR 719  47.921  -4.674   7.254
    6    HD2  TYR 719           HD2      TYR 719  50.469  -8.055   6.854
    7    HE1  TYR 719           HE1      TYR 719  49.880  -3.217   7.522
    8    HE2  TYR 719           HE2      TYR 719  52.434  -6.605   7.127
    9    HH   TYR 719           HH       TYR 719  52.235  -3.456   8.261

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLU 720           H        GLU 720  48.534  -6.532   3.501
    2    HA   GLU 720           HA       GLU 720  46.688  -4.292   3.567
    3    HB2  GLU 720           HB2      GLU 720  48.516  -2.947   2.444
    4    HB3  GLU 720           HB3      GLU 720  49.096  -3.834   3.871
    5    HG2  GLU 720           HG2      GLU 720  50.769  -3.927   2.441
    6    HG3  GLU 720           HG3      GLU 720  49.959  -5.487   2.267

  No H/Q in entry =           6
  In of MODEL   33
    1    H    CYS 721           H        CYS 721  47.362  -7.078   2.022
    2    HA   CYS 721           HA       CYS 721  46.233  -6.343  -0.528
    3    HB2  CYS 721           HB2      CYS 721  47.108  -9.022   0.569
    4    HB3  CYS 721           HB3      CYS 721  46.604  -8.716  -1.089

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLY 722           H        GLY 722  44.222  -6.928  -1.169
    2    HA3  GLY 722           HA2      GLY 722  42.496  -8.475   0.563
    3    HA2  GLY 722           HA3      GLY 722  42.061  -6.782   0.347

  No H/Q in entry =           3
  In of MODEL   33
    1    HA   PRO 723           HA       PRO 723  40.144  -7.300  -3.645
    2    HB2  PRO 723           HB2      PRO 723  42.434  -5.759  -4.806
    3    HB3  PRO 723           HB3      PRO 723  40.702  -5.531  -5.066
    4    HG2  PRO 723           HG2      PRO 723  42.001  -3.903  -3.450
    5    HG3  PRO 723           HG3      PRO 723  40.397  -4.506  -3.000
    6    HD2  PRO 723           HD2      PRO 723  43.073  -5.311  -1.961
    7    HD3  PRO 723           HD3      PRO 723  41.517  -5.195  -1.122

  No H/Q in entry =           7
  In of MODEL   33
    1    H    SER 724           H        SER 724  40.491  -9.522  -3.866
    2    HA   SER 724           HA       SER 724  41.795 -10.431  -6.106
    3    HB2  SER 724           HB2      SER 724  43.223 -12.098  -4.758
    4    HB3  SER 724           HB3      SER 724  43.866 -10.473  -4.963
    5    HG   SER 724           HG       SER 724  42.626 -10.210  -2.817

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU 725           H        LEU 725  41.542 -12.923  -5.986
    2    HA   LEU 725           HA       LEU 725  38.719 -13.297  -5.445
    3    HB2  LEU 725           HB2      LEU 725  40.071 -13.963  -7.515
    4    HB3  LEU 725           HB3      LEU 725  40.735 -15.201  -6.498
    5    HG   LEU 725           HG       LEU 725  38.687 -16.308  -6.291
    6   HD12  LEU 725          HD11      LEU 725  36.660 -15.551  -7.484
    7   HD11  LEU 725          HD12      LEU 725  37.505 -14.083  -7.970
    8   HD13  LEU 725          HD13      LEU 725  37.154 -14.380  -6.268
    9   HD22  LEU 725          HD21      LEU 725  38.295 -16.953  -8.619
   10   HD21  LEU 725          HD22      LEU 725  40.025 -16.769  -8.280
   11   HD23  LEU 725          HD23      LEU 725  39.140 -15.495  -9.133

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ASP 726           H        ASP 726  37.884 -14.375  -3.780
    2    HA   ASP 726           HA       ASP 726  39.738 -15.363  -1.822
    3    HB2  ASP 726           HB2      ASP 726  36.743 -14.997  -1.677
    4    HB3  ASP 726           HB3      ASP 726  37.601 -15.936  -0.466

  No H/Q in entry =           4
  In of MODEL   33
    1    H    VAL 727           H        VAL 727  40.270 -17.211  -1.394
    2    HA   VAL 727           HA       VAL 727  39.004 -19.509  -2.684
    3    HB   VAL 727           HB       VAL 727  41.299 -20.373  -3.243
    4   HG11  VAL 727          HG11      VAL 727  40.574 -17.771  -4.605
    5   HG13  VAL 727          HG12      VAL 727  39.951 -19.368  -5.018
    6   HG12  VAL 727          HG13      VAL 727  41.656 -18.996  -5.262
    7   HG23  VAL 727          HG21      VAL 727  42.189 -17.551  -2.621
    8   HG22  VAL 727          HG22      VAL 727  43.208 -18.824  -3.301
    9   HG21  VAL 727          HG23      VAL 727  42.570 -18.980  -1.669

  No H/Q in entry =           9
  In of MODEL   33
    1    H    CYS 728           H        CYS 728  40.222 -21.559  -1.650
    2    HA   CYS 728           HA       CYS 728  40.730 -20.721   1.073
    3    HB2  CYS 728           HB2      CYS 728  38.722 -22.191   0.779
    4    HB3  CYS 728           HB3      CYS 728  39.799 -23.526   0.375

  No H/Q in entry =           4
  In of MODEL   33
    1    H    ALA 729           H        ALA 729  42.385 -21.700   2.260
    2    HA   ALA 729           HA       ALA 729  44.231 -23.259   0.716
    3    HB3  ALA 729           HB1      ALA 729  44.926 -20.923   0.351
    4    HB2  ALA 729           HB2      ALA 729  46.112 -21.826   1.298
    5    HB1  ALA 729           HB3      ALA 729  45.007 -20.706   2.100

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLN 730           H        GLN 730  45.727 -24.277   1.977
    2    HA   GLN 730           HA       GLN 730  44.789 -24.681   4.714
    3    HB2  GLN 730           HB2      GLN 730  44.785 -26.671   3.204
    4    HB3  GLN 730           HB3      GLN 730  46.514 -26.457   3.013
    5    HG2  GLN 730           HG2      GLN 730  46.928 -26.857   5.304
    6    HG3  GLN 730           HG3      GLN 730  45.226 -26.918   5.691
    7   HE21  GLN 730          HE21      GLN 730  47.233 -28.868   6.132
    8   HE22  GLN 730          HE22      GLN 730  46.791 -30.305   5.299

  No H/Q in entry =           8
  In of MODEL   33
    1    H    ASP 731           H        ASP 731  46.037 -24.096   6.262
    2    HA   ASP 731           HA       ASP 731  48.613 -22.876   5.842
    3    HB2  ASP 731           HB2      ASP 731  47.001 -22.214   7.677
    4    HB3  ASP 731           HB3      ASP 731  47.292 -23.771   8.430

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLU 732           H        GLU 732  50.477 -24.046   5.637
    2    HA   GLU 732           HA       GLU 732  50.220 -26.855   6.006
    3    HB2  GLU 732           HB2      GLU 732  52.491 -25.214   4.976
    4    HB3  GLU 732           HB3      GLU 732  52.571 -26.975   5.114
    5    HG2  GLU 732           HG2      GLU 732  50.467 -27.001   3.641
    6    HG3  GLU 732           HG3      GLU 732  50.810 -25.281   3.400

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ARG 733           H        ARG 733  50.978 -24.568   8.310
    2    HA   ARG 733           HA       ARG 733  52.670 -26.480   9.663
    3    HB2  ARG 733           HB2      ARG 733  52.182 -23.552  10.010
    4    HB3  ARG 733           HB3      ARG 733  52.970 -24.522  11.243
    5    HG2  ARG 733           HG2      ARG 733  53.918 -24.214   8.398
    6    HG3  ARG 733           HG3      ARG 733  54.567 -23.313   9.768
    7    HD2  ARG 733           HD2      ARG 733  55.340 -25.355  10.801
    8    HD3  ARG 733           HD3      ARG 733  54.589 -26.334   9.549
    9    HE   ARG 733           HE       ARG 733  56.155 -25.010   8.035
   10   HH11  ARG 733          HH11      ARG 733  56.942 -26.113  11.311
   11   HH12  ARG 733          HH12      ARG 733  58.598 -26.290  11.015
   12   HH21  ARG 733          HH21      ARG 733  58.477 -25.332   7.612
   13   HH22  ARG 733          HH22      ARG 733  59.469 -25.870   8.874

  No H/Q in entry =          13
  In of MODEL   33
    1    H    SER 734           H        SER 734  49.784 -24.509  10.067
    2    HA   SER 734           HA       SER 734  49.138 -25.905  12.510
    3    HB2  SER 734           HB2      SER 734  47.554 -23.910  10.891
    4    HB3  SER 734           HB3      SER 734  47.097 -24.502  12.490
    5    HG   SER 734           HG       SER 734  49.467 -23.063  11.824

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LYS 735           H        LYS 735  48.484 -26.247   9.150
    2    HA   LYS 735           HA       LYS 735  47.457 -27.712   7.884
    3    HB2  LYS 735           HB2      LYS 735  47.152 -29.379  10.384
    4    HB3  LYS 735           HB3      LYS 735  46.774 -29.935   8.761
    5    HG2  LYS 735           HG2      LYS 735  49.473 -29.168   9.835
    6    HG3  LYS 735           HG3      LYS 735  48.914 -30.773   9.347
    7    HD2  LYS 735           HD2      LYS 735  48.571 -29.810   7.037
    8    HD3  LYS 735           HD3      LYS 735  49.445 -28.388   7.600
    9    HE2  LYS 735           HE2      LYS 735  50.987 -29.829   6.480
   10    HE3  LYS 735           HE3      LYS 735  51.335 -29.847   8.212
   11    HZ3  LYS 735           HZ1      LYS 735  51.388 -32.066   7.269
   12    HZ2  LYS 735           HZ2      LYS 735  49.795 -31.893   6.736
   13    HZ1  LYS 735           HZ3      LYS 735  50.129 -31.934   8.386

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ARG 736           H        ARG 736  45.980 -25.678   9.383
    2    HA   ARG 736           HA       ARG 736  43.288 -26.801   9.264
    3    HB2  ARG 736           HB2      ARG 736  42.490 -24.738  10.214
    4    HB3  ARG 736           HB3      ARG 736  43.807 -25.375  11.189
    5    HG2  ARG 736           HG2      ARG 736  45.330 -23.777  10.220
    6    HG3  ARG 736           HG3      ARG 736  44.053 -23.176   9.162
    7    HD2  ARG 736           HD2      ARG 736  44.385 -21.763  11.031
    8    HD3  ARG 736           HD3      ARG 736  42.768 -22.468  11.105
    9    HE   ARG 736           HE       ARG 736  44.275 -24.143  12.620
   10   HH11  ARG 736          HH11      ARG 736  43.799 -20.635  12.748
   11   HH12  ARG 736          HH12      ARG 736  44.030 -20.518  14.421
   12   HH21  ARG 736          HH21      ARG 736  44.622 -23.997  14.881
   13   HH22  ARG 736          HH22      ARG 736  44.549 -22.486  15.677

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ILE 737           H        ILE 737  41.703 -25.972   7.984
    2    HA   ILE 737           HA       ILE 737  42.671 -24.965   5.451
    3    HB   ILE 737           HB       ILE 737  39.928 -25.931   6.341
    4   HG12  ILE 737          HG12      ILE 737  41.679 -27.714   6.396
    5   HG13  ILE 737          HG13      ILE 737  40.395 -28.018   5.231
    6   HG23  ILE 737          HG21      ILE 737  39.852 -24.439   4.457
    7   HG22  ILE 737          HG22      ILE 737  39.457 -26.078   3.946
    8   HG21  ILE 737          HG23      ILE 737  41.051 -25.394   3.608
    9   HD11  ILE 737          HD11      ILE 737  41.852 -27.158   3.463
   10   HD13  ILE 737          HD12      ILE 737  42.510 -28.594   4.269
   11   HD12  ILE 737          HD13      ILE 737  43.153 -26.989   4.650

  No H/Q in entry =          11
  In of MODEL   33
    1    H    LEU 738           H        LEU 738  42.577 -22.757   5.166
    2    HA   LEU 738           HA       LEU 738  40.437 -21.392   6.532
    3    HB2  LEU 738           HB2      LEU 738  41.789 -19.537   7.262
    4    HB3  LEU 738           HB3      LEU 738  42.387 -21.025   7.961
    5    HG   LEU 738           HG       LEU 738  43.683 -19.593   5.631
    6   HD12  LEU 738          HD11      LEU 738  44.414 -19.615   8.555
    7   HD11  LEU 738          HD12      LEU 738  43.752 -18.235   7.675
    8   HD13  LEU 738          HD13      LEU 738  45.349 -18.865   7.263
    9   HD23  LEU 738          HD21      LEU 738  45.570 -21.051   6.162
   10   HD22  LEU 738          HD22      LEU 738  44.085 -21.938   5.750
   11   HD21  LEU 738          HD23      LEU 738  44.580 -21.794   7.439

  No H/Q in entry =          11
  In of MODEL   33
    1    HA   PRO 739           HA       PRO 739  39.744 -19.468   2.712
    2    HB2  PRO 739           HB2      PRO 739  38.319 -17.350   3.586
    3    HB3  PRO 739           HB3      PRO 739  37.672 -19.006   3.620
    4    HG2  PRO 739           HG2      PRO 739  38.916 -17.423   5.841
    5    HG3  PRO 739           HG3      PRO 739  37.428 -18.396   5.860
    6    HD2  PRO 739           HD2      PRO 739  39.820 -19.395   6.772
    7    HD3  PRO 739           HD3      PRO 739  38.588 -20.395   5.957

  No H/Q in entry =           7
  In of MODEL   33
    1    H    LEU 740           H        LEU 740  41.312 -18.490   1.672
    2    HA   LEU 740           HA       LEU 740  42.398 -15.999   2.750
    3    HB2  LEU 740           HB2      LEU 740  43.848 -18.212   1.329
    4    HB3  LEU 740           HB3      LEU 740  44.467 -16.574   1.385
    5    HG   LEU 740           HG       LEU 740  43.982 -18.366   3.766
    6   HD11  LEU 740          HD11      LEU 740  45.920 -18.961   2.386
    7   HD13  LEU 740          HD12      LEU 740  46.388 -18.344   3.969
    8   HD12  LEU 740          HD13      LEU 740  46.521 -17.310   2.544
    9   HD23  LEU 740          HD21      LEU 740  45.107 -16.550   5.033
   10   HD22  LEU 740          HD22      LEU 740  43.549 -16.065   4.388
   11   HD21  LEU 740          HD23      LEU 740  45.028 -15.532   3.592

  No H/Q in entry =          11
  In of MODEL   33
    1    H    THR 741           H        THR 741  43.636 -15.040   0.686
    2    HA   THR 741           HA       THR 741  41.687 -15.135  -1.468
    3    HB   THR 741           HB       THR 741  43.033 -12.567  -0.658
    4    HG1  THR 741           HG1      THR 741  40.585 -13.522   0.490
    5   HG21  THR 741          HG21      THR 741  41.603 -12.699  -2.659
    6   HG23  THR 741          HG22      THR 741  40.967 -11.597  -1.444
    7   HG22  THR 741          HG23      THR 741  40.257 -13.202  -1.636

  No H/Q in entry =           7
  In of MODEL   33
    1    H    VAL 742           H        VAL 742  42.698 -14.798  -3.533
    2    HA   VAL 742           HA       VAL 742  45.020 -16.116  -4.036
    3    HB   VAL 742           HB       VAL 742  43.936 -13.820  -5.604
    4   HG12  VAL 742          HG11      VAL 742  44.907 -14.773  -7.544
    5   HG11  VAL 742          HG12      VAL 742  45.823 -15.919  -6.530
    6   HG13  VAL 742          HG13      VAL 742  46.064 -14.164  -6.377
    7   HG22  VAL 742          HG21      VAL 742  42.280 -15.405  -5.276
    8   HG21  VAL 742          HG22      VAL 742  43.359 -16.727  -5.775
    9   HG23  VAL 742          HG23      VAL 742  42.842 -15.489  -6.949

  No H/Q in entry =           9
  In of MODEL   33
    1    H    CYS 743           H        CYS 743  44.842 -12.552  -3.900
    2    HA   CYS 743           HA       CYS 743  47.579 -12.219  -4.350
    3    HB2  CYS 743           HB2      CYS 743  45.956 -10.412  -4.744
    4    HB3  CYS 743           HB3      CYS 743  45.664 -10.292  -3.009

  No H/Q in entry =           4
  In of MODEL   33
    1    H    LYS 744           H        LYS 744  45.667 -12.327  -1.360
    2    HA   LYS 744           HA       LYS 744  47.694 -11.693   0.466
    3    HB2  LYS 744           HB2      LYS 744  45.361 -13.563   0.843
    4    HB3  LYS 744           HB3      LYS 744  46.362 -12.925   2.133
    5    HG2  LYS 744           HG2      LYS 744  45.582 -10.681   1.646
    6    HG3  LYS 744           HG3      LYS 744  44.607 -11.302   0.305
    7    HD2  LYS 744           HD2      LYS 744  43.396 -12.745   1.902
    8    HD3  LYS 744           HD3      LYS 744  44.322 -12.031   3.220
    9    HE2  LYS 744           HE2      LYS 744  43.372  -9.868   2.775
   10    HE3  LYS 744           HE3      LYS 744  42.570 -10.492   1.329
   11    HZ1  LYS 744           HZ1      LYS 744  42.011 -11.390   4.103
   12    HZ3  LYS 744           HZ2      LYS 744  41.214 -11.898   2.706
   13    HZ2  LYS 744           HZ3      LYS 744  41.085 -10.298   3.220

  No H/Q in entry =          13
  In of MODEL   33
    1    H    MET 745           H        MET 745  46.568 -14.850  -0.699
    2    HA   MET 745           HA       MET 745  48.395 -16.323   0.914
    3    HB2  MET 745           HB2      MET 745  47.401 -18.236   0.081
    4    HB3  MET 745           HB3      MET 745  46.136 -17.079  -0.213
    5    HG2  MET 745           HG2      MET 745  46.139 -18.287  -2.166
    6    HG3  MET 745           HG3      MET 745  47.150 -16.913  -2.579
    7    HE3  MET 745           HE1      MET 745  48.228 -20.022  -0.287
    8    HE2  MET 745           HE2      MET 745  48.852 -21.109  -1.520
    9    HE1  MET 745           HE3      MET 745  47.147 -20.710  -1.490

  No H/Q in entry =           9
  In of MODEL   33
    1    H    HIS 746           H        HIS 746  48.604 -15.042  -2.392
    2    HA   HIS 746           HA       HIS 746  51.046 -16.447  -2.994
    3    HB2  HIS 746           HB2      HIS 746  49.433 -14.426  -4.338
    4    HB3  HIS 746           HB3      HIS 746  51.162 -14.251  -4.634
    5    HD1  HIS 746           HD1      HIS 746  52.256 -16.774  -5.446
    6    HD2  HIS 746           HD2      HIS 746  48.232 -15.978  -6.092
    7    HE1  HIS 746           HE1      HIS 746  51.576 -18.278  -7.314
    8    HE2  HIS 746           HE2      HIS 746  49.091 -17.929  -7.540

  No H/Q in entry =           8
  In of MODEL   33
    1    H    VAL 747           H        VAL 747  50.300 -13.201  -1.877
    2    HA   VAL 747           HA       VAL 747  52.920 -12.247  -1.784
    3    HB   VAL 747           HB       VAL 747  50.370 -11.535  -0.342
    4   HG11  VAL 747          HG11      VAL 747  52.237 -11.049   1.223
    5   HG13  VAL 747          HG12      VAL 747  51.491  -9.581   0.619
    6   HG12  VAL 747          HG13      VAL 747  53.033 -10.121  -0.046
    7   HG22  VAL 747          HG21      VAL 747  50.531  -9.537  -1.686
    8   HG21  VAL 747          HG22      VAL 747  50.625 -10.988  -2.696
    9   HG23  VAL 747          HG23      VAL 747  52.091 -10.089  -2.310

  No H/Q in entry =           9
  In of MODEL   33
    1    H    LEU 748           H        LEU 748  50.924 -13.754   0.661
    2    HA   LEU 748           HA       LEU 748  52.794 -13.957   2.698
    3    HB2  LEU 748           HB2      LEU 748  50.589 -14.197   3.329
    4    HB3  LEU 748           HB3      LEU 748  50.182 -15.162   1.949
    5    HG   LEU 748           HG       LEU 748  51.732 -16.329   4.259
    6   HD13  LEU 748          HD11      LEU 748  49.633 -15.273   5.113
    7   HD12  LEU 748          HD12      LEU 748  49.526 -17.031   5.143
    8   HD11  LEU 748          HD13      LEU 748  48.712 -16.128   3.875
    9   HD23  LEU 748          HD21      LEU 748  49.833 -17.467   2.208
   10   HD22  LEU 748          HD22      LEU 748  50.725 -18.378   3.423
   11   HD21  LEU 748          HD23      LEU 748  51.591 -17.571   2.121

  No H/Q in entry =          11
  In of MODEL   33
    1    H    HIS 749           H        HIS 749  52.079 -16.098   0.006
    2    HA   HIS 749           HA       HIS 749  53.750 -18.259   0.695
    3    HB2  HIS 749           HB2      HIS 749  51.934 -18.145  -1.097
    4    HB3  HIS 749           HB3      HIS 749  53.110 -17.313  -2.095
    5    HD1  HIS 749           HD1      HIS 749  54.438 -18.809  -3.598
    6    HD2  HIS 749           HD2      HIS 749  52.790 -20.816  -0.371
    7    HE1  HIS 749           HE1      HIS 749  54.908 -21.227  -4.018
    8    HE2  HIS 749           HE2      HIS 749  54.038 -22.427  -1.993

  No H/Q in entry =           8
  In of MODEL   33
    1    H    CYS 750           H        CYS 750  54.294 -15.274  -1.081
    2    HA   CYS 750           HA       CYS 750  56.930 -15.963  -1.935
    3    HB2  CYS 750           HB2      CYS 750  55.428 -14.393  -3.161
    4    HB3  CYS 750           HB3      CYS 750  55.612 -13.245  -1.842

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLN 751           H        GLN 751  55.511 -14.272   0.773
    2    HA   GLN 751           HA       GLN 751  57.798 -13.155   1.920
    3    HB2  GLN 751           HB2      GLN 751  55.361 -14.347   3.257
    4    HB3  GLN 751           HB3      GLN 751  56.589 -13.424   4.108
    5    HG2  GLN 751           HG2      GLN 751  54.979 -12.371   1.812
    6    HG3  GLN 751           HG3      GLN 751  54.527 -12.141   3.494
    7   HE21  GLN 751          HE21      GLN 751  55.132 -10.118   1.520
    8   HE22  GLN 751          HE22      GLN 751  56.495  -9.252   2.115

  No H/Q in entry =           8
  In of MODEL   33
    1    H    GLY 752           H        GLY 752  56.651 -16.419   1.797
    2    HA3  GLY 752           HA2      GLY 752  58.451 -18.127   1.888
    3    HA2  GLY 752           HA3      GLY 752  58.990 -17.322   3.356

  No H/Q in entry =           3
  In of MODEL   33
    1    H    ARG 753           H        ARG 753  55.630 -17.976   2.473
    2    HA   ARG 753           HA       ARG 753  55.466 -19.808   4.773
    3    HB2  ARG 753           HB2      ARG 753  53.298 -17.957   3.732
    4    HB3  ARG 753           HB3      ARG 753  53.196 -19.004   5.133
    5    HG2  ARG 753           HG2      ARG 753  55.048 -16.641   4.879
    6    HG3  ARG 753           HG3      ARG 753  53.499 -16.638   5.723
    7    HD2  ARG 753           HD2      ARG 753  54.320 -18.316   7.272
    8    HD3  ARG 753           HD3      ARG 753  55.846 -18.396   6.385
    9    HE   ARG 753           HE       ARG 753  55.727 -15.812   7.035
   10   HH11  ARG 753          HH11      ARG 753  55.292 -18.716   9.001
   11   HH12  ARG 753          HH12      ARG 753  55.862 -18.027  10.436
   12   HH21  ARG 753          HH21      ARG 753  56.560 -14.844   8.960
   13   HH22  ARG 753          HH22      ARG 753  56.646 -15.750  10.407

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ASN 754           H        ASN 754  54.700 -21.804   4.269
    2    HA   ASN 754           HA       ASN 754  53.903 -22.256   1.507
    3    HB2  ASN 754           HB2      ASN 754  54.457 -24.252   3.711
    4    HB3  ASN 754           HB3      ASN 754  54.012 -24.655   2.081
    5   HD21  ASN 754          HD21      ASN 754  56.437 -25.311   3.531
    6   HD22  ASN 754          HD22      ASN 754  57.736 -24.703   2.569

  No H/Q in entry =           6
  In of MODEL   33
    1    H    TYR 755           H        TYR 755  51.913 -22.434   0.917
    2    HA   TYR 755           HA       TYR 755  49.916 -23.452   2.758
    3    HB2  TYR 755           HB2      TYR 755  49.749 -20.838   1.276
    4    HB3  TYR 755           HB3      TYR 755  48.315 -21.788   1.677
    5    HD1  TYR 755           HD1      TYR 755  47.182 -20.932   3.520
    6    HD2  TYR 755           HD2      TYR 755  51.413 -20.703   3.507
    7    HE1  TYR 755           HE1      TYR 755  47.136 -19.878   5.731
    8    HE2  TYR 755           HE2      TYR 755  51.372 -19.670   5.716
    9    HH   TYR 755           HH       TYR 755  48.860 -19.775   7.726

  No H/Q in entry =           9
  In of MODEL   33
    1    H    THR 756           H        THR 756  48.416 -24.627   1.800
    2    HA   THR 756           HA       THR 756  48.900 -25.315  -1.016
    3    HB   THR 756           HB       THR 756  47.561 -26.779   1.237
    4    HG1  THR 756           HG1      THR 756  50.099 -26.375   0.808
    5   HG22  THR 756          HG21      THR 756  47.669 -28.745  -0.236
    6   HG21  THR 756          HG22      THR 756  48.333 -27.708  -1.520
    7   HG23  THR 756          HG23      THR 756  46.695 -27.431  -0.910

  No H/Q in entry =           7
  In of MODEL   33
    1    H    LEU 757           H        LEU 757  47.129 -25.192  -2.481
    2    HA   LEU 757           HA       LEU 757  44.854 -23.654  -1.601
    3    HB2  LEU 757           HB2      LEU 757  45.604 -24.753  -4.309
    4    HB3  LEU 757           HB3      LEU 757  44.080 -23.951  -4.012
    5    HG   LEU 757           HG       LEU 757  45.502 -22.392  -5.047
    6   HD13  LEU 757          HD11      LEU 757  44.149 -21.453  -3.321
    7   HD12  LEU 757          HD12      LEU 757  45.694 -20.604  -3.371
    8   HD11  LEU 757          HD13      LEU 757  45.383 -21.787  -2.111
    9   HD22  LEU 757          HD21      LEU 757  47.668 -23.441  -4.661
   10   HD21  LEU 757          HD22      LEU 757  47.587 -23.022  -2.951
   11   HD23  LEU 757          HD23      LEU 757  47.717 -21.748  -4.163

  No H/Q in entry =          11
  In of MODEL   33
    1    H    THR 758           H        THR 758  42.837 -24.276  -1.268
    2    HA   THR 758           HA       THR 758  42.120 -27.034  -1.805
    3    HB   THR 758           HB       THR 758  40.902 -26.964   0.473
    4    HG1  THR 758           HG1      THR 758  42.853 -24.950   0.887
    5   HG22  THR 758          HG21      THR 758  43.929 -27.043   0.448
    6   HG21  THR 758          HG22      THR 758  42.868 -28.394   0.055
    7   HG23  THR 758          HG23      THR 758  42.899 -27.748   1.693

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLY 759           H        GLY 759  39.646 -27.255  -1.520
    2    HA3  GLY 759           HA2      GLY 759  38.508 -25.067  -3.017
    3    HA2  GLY 759           HA3      GLY 759  37.778 -26.635  -2.748

  No H/Q in entry =           3
  In of MODEL   33
    1    H    ARG 760           H        ARG 760  36.109 -24.709  -2.545
    2    HA   ARG 760           HA       ARG 760  36.074 -23.191  -0.116
    3    HB2  ARG 760           HB2      ARG 760  34.090 -22.191  -0.851
    4    HB3  ARG 760           HB3      ARG 760  34.862 -22.639  -2.359
    5    HG2  ARG 760           HG2      ARG 760  32.670 -24.213  -0.996
    6    HG3  ARG 760           HG3      ARG 760  32.424 -23.108  -2.349
    7    HD2  ARG 760           HD2      ARG 760  33.614 -24.544  -3.823
    8    HD3  ARG 760           HD3      ARG 760  34.278 -25.455  -2.456
    9    HE   ARG 760           HE       ARG 760  31.452 -25.558  -2.563
   10   HH11  ARG 760          HH11      ARG 760  34.335 -26.936  -4.075
   11   HH12  ARG 760          HH12      ARG 760  33.699 -28.509  -4.206
   12   HH21  ARG 760          HH21      ARG 760  30.583 -27.769  -2.720
   13   HH22  ARG 760          HH22      ARG 760  31.547 -28.986  -3.446

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ASP 761           H        ASP 761  35.165 -26.408  -0.782
    2    HA   ASP 761           HA       ASP 761  32.953 -26.559   0.991
    3    HB2  ASP 761           HB2      ASP 761  33.114 -28.143  -0.843
    4    HB3  ASP 761           HB3      ASP 761  34.641 -28.749  -0.217

  No H/Q in entry =           4
  In of MODEL   33
    1    H    SER 762           H        SER 762  36.354 -26.934   1.307
    2    HA   SER 762           HA       SER 762  36.209 -28.309   3.805
    3    HB2  SER 762           HB2      SER 762  38.531 -27.078   2.333
    4    HB3  SER 762           HB3      SER 762  38.672 -28.064   3.795
    5    HG   SER 762           HG       SER 762  38.085 -29.776   2.762

  No H/Q in entry =           5
  In of MODEL   33
    1    H    CYS 763           H        CYS 763  36.275 -24.989   2.832
    2    HA   CYS 763           HA       CYS 763  36.600 -24.155   5.654
    3    HB2  CYS 763           HB2      CYS 763  37.201 -22.000   4.755
    4    HB3  CYS 763           HB3      CYS 763  38.227 -23.245   4.045

  No H/Q in entry =           4
  In of MODEL   33
    1    H    THR 764           H        THR 764  35.537 -21.887   5.830
    2    HA   THR 764           HA       THR 764  32.966 -21.775   4.485
    3    HB   THR 764           HB       THR 764  33.846 -20.578   7.138
    4    HG1  THR 764           HG1      THR 764  31.966 -22.640   6.613
    5   HG21  THR 764          HG21      THR 764  31.142 -20.614   5.781
    6   HG23  THR 764          HG22      THR 764  32.175 -19.203   6.001
    7   HG22  THR 764          HG23      THR 764  31.450 -19.999   7.405

  No H/Q in entry =           7
  In of MODEL   33
    1    H    LEU 765           H        LEU 765  33.327 -20.468   2.816
    2    HA   LEU 765           HA       LEU 765  35.540 -18.652   2.832
    3    HB2  LEU 765           HB2      LEU 765  34.478 -20.167   0.900
    4    HB3  LEU 765           HB3      LEU 765  33.509 -18.716   0.689
    5    HG   LEU 765           HG       LEU 765  35.500 -17.400   0.197
    6   HD13  LEU 765          HD11      LEU 765  37.104 -18.580   1.609
    7   HD12  LEU 765          HD12      LEU 765  37.680 -18.569  -0.060
    8   HD11  LEU 765          HD13      LEU 765  36.928 -20.017   0.616
    9   HD23  LEU 765          HD21      LEU 765  35.410 -19.967  -1.381
   10   HD22  LEU 765          HD22      LEU 765  36.133 -18.462  -1.913
   11   HD21  LEU 765          HD23      LEU 765  34.383 -18.558  -1.663

  No H/Q in entry =          11
  In of MODEL   33
    1    HA   PRO 766           HA       PRO 766  33.358 -15.081   4.312
    2    HB2  PRO 766           HB2      PRO 766  34.687 -13.196   2.712
    3    HB3  PRO 766           HB3      PRO 766  35.152 -13.690   4.334
    4    HG2  PRO 766           HG2      PRO 766  36.271 -14.485   1.724
    5    HG3  PRO 766           HG3      PRO 766  37.039 -14.468   3.315
    6    HD2  PRO 766           HD2      PRO 766  36.251 -16.729   2.020
    7    HD3  PRO 766           HD3      PRO 766  36.369 -16.628   3.778

  No H/Q in entry =           7
  In of MODEL   33
    1    H    ALA 767           H        ALA 767  33.964 -15.272   0.860
    2    HA   ALA 767           HA       ALA 767  31.509 -13.784   0.363
    3    HB3  ALA 767           HB1      ALA 767  32.206 -13.674  -1.937
    4    HB1  ALA 767           HB2      ALA 767  33.577 -14.750  -1.587
    5    HB2  ALA 767           HB3      ALA 767  33.519 -13.132  -0.886

  No H/Q in entry =           5
  In of MODEL   33
    1    H    SER 768           H        SER 768  30.083 -15.053   0.979
    2    HA   SER 768           HA       SER 768  29.333 -17.092  -0.919
    3    HB2  SER 768           HB2      SER 768  29.842 -17.773   1.972
    4    HB3  SER 768           HB3      SER 768  28.907 -18.760   0.848
    5    HG   SER 768           HG       SER 768  31.441 -17.911   0.069

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA 769           H        ALA 769  28.407 -14.783   1.549
    2    HA   ALA 769           HA       ALA 769  25.724 -15.854   1.526
    3    HB1  ALA 769           HB1      ALA 769  26.883 -13.597   3.154
    4    HB3  ALA 769           HB2      ALA 769  26.595 -15.254   3.715
    5    HB2  ALA 769           HB3      ALA 769  25.240 -14.223   3.228

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLU 770           H        GLU 770  24.010 -14.299   1.414
    2    HA   GLU 770           HA       GLU 770  24.268 -12.811  -1.020
    3    HB2  GLU 770           HB2      GLU 770  21.768 -12.657  -0.851
    4    HB3  GLU 770           HB3      GLU 770  22.397 -14.292  -0.943
    5    HG2  GLU 770           HG2      GLU 770  21.778 -13.012   1.680
    6    HG3  GLU 770           HG3      GLU 770  20.493 -13.823   0.753

  No H/Q in entry =           6
  In of MODEL   33
    1    H    LYS 771           H        LYS 771  24.624 -10.738  -1.071
    2    HA   LYS 771           HA       LYS 771  23.732  -9.124   1.194
    3    HB2  LYS 771           HB2      LYS 771  26.331  -8.778  -0.332
    4    HB3  LYS 771           HB3      LYS 771  25.759  -7.776   0.992
    5    HG2  LYS 771           HG2      LYS 771  26.463 -10.697   1.188
    6    HG3  LYS 771           HG3      LYS 771  27.470  -9.352   1.724
    7    HD2  LYS 771           HD2      LYS 771  25.966  -8.786   3.455
    8    HD3  LYS 771           HD3      LYS 771  24.676  -9.769   2.770
    9    HE2  LYS 771           HE2      LYS 771  25.884 -11.745   3.181
   10    HE3  LYS 771           HE3      LYS 771  27.261 -10.852   3.839
   11    HZ1  LYS 771           HZ1      LYS 771  25.778 -10.036   5.608
   12    HZ3  LYS 771           HZ2      LYS 771  25.906 -11.709   5.637
   13    HZ2  LYS 771           HZ3      LYS 771  24.518 -10.988   5.000

  No H/Q in entry =          13
  In of MODEL   33
    1    H    ALA 772           H        ALA 772  22.449  -7.544   0.596
    2    HA   ALA 772           HA       ALA 772  21.926  -7.000  -2.195
    3    HB2  ALA 772           HB1      ALA 772  20.303  -5.446  -1.342
    4    HB3  ALA 772           HB2      ALA 772  20.883  -5.680   0.311
    5    HB1  ALA 772           HB3      ALA 772  20.102  -7.016  -0.562

  No H/Q in entry =           5
  In of MODEL   33
    1    H    CYS 773           H        CYS 773  23.402  -5.988  -3.169
    2    HA   CYS 773           HA       CYS 773  24.048  -3.317  -2.782
    3    HB2  CYS 773           HB2      CYS 773  26.495  -3.680  -2.360
    4    HB3  CYS 773           HB3      CYS 773  25.465  -3.904  -0.935

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLY 774           H        GLY 774  25.887  -6.177  -3.772
    2    HA3  GLY 774           HA2      GLY 774  26.075  -7.009  -5.955
    3    HA2  GLY 774           HA3      GLY 774  25.478  -5.473  -6.575

  No H/Q in entry =           3
  In of MODEL   33
    1    H    ALA 775           H        ALA 775  27.496  -4.089  -4.724
    2    HA   ALA 775           HA       ALA 775  29.832  -4.765  -6.337
    3    HB2  ALA 775           HB1      ALA 775  28.769  -2.736  -7.204
    4    HB3  ALA 775           HB2      ALA 775  30.378  -2.413  -6.551
    5    HB1  ALA 775           HB3      ALA 775  28.945  -1.991  -5.615

  No H/Q in entry =           5
  In of MODEL   33
    1    H    CYS 776           H        CYS 776  31.044  -5.746  -4.950
    2    HA   CYS 776           HA       CYS 776  32.263  -4.158  -2.900
    3    HB2  CYS 776           HB2      CYS 776  31.131  -6.927  -2.190
    4    HB3  CYS 776           HB3      CYS 776  32.275  -6.033  -1.203

  No H/Q in entry =           4
  In of MODEL   33
    1    HA   PRO 777           HA       PRO 777  35.349  -7.386  -4.470
    2    HB2  PRO 777           HB2      PRO 777  34.024  -9.222  -6.312
    3    HB3  PRO 777           HB3      PRO 777  34.941  -9.607  -4.859
    4    HG2  PRO 777           HG2      PRO 777  32.287  -9.991  -4.997
    5    HG3  PRO 777           HG3      PRO 777  33.080  -9.483  -3.490
    6    HD2  PRO 777           HD2      PRO 777  31.686  -7.796  -5.543
    7    HD3  PRO 777           HD3      PRO 777  31.446  -7.815  -3.785

  No H/Q in entry =           7
  In of MODEL   33
    1    H    LEU 778           H        LEU 778  36.412  -7.797  -6.678
    2    HA   LEU 778           HA       LEU 778  36.285  -5.399  -8.201
    3    HB2  LEU 778           HB2      LEU 778  37.522  -7.720  -9.531
    4    HB3  LEU 778           HB3      LEU 778  38.152  -6.118  -9.255
    5    HG   LEU 778           HG       LEU 778  38.119  -8.384  -7.281
    6   HD12  LEU 778          HD11      LEU 778  40.409  -7.163  -8.804
    7   HD11  LEU 778          HD12      LEU 778  39.670  -8.738  -9.088
    8   HD13  LEU 778          HD13      LEU 778  40.526  -8.433  -7.579
    9   HD22  LEU 778          HD21      LEU 778  39.498  -6.996  -5.873
   10   HD21  LEU 778          HD22      LEU 778  37.920  -6.268  -6.139
   11   HD23  LEU 778          HD23      LEU 778  39.339  -5.630  -6.991

  No H/Q in entry =          11
  In of MODEL   33
    1    H    TRP 779           H        TRP 779  34.783  -8.424  -8.515
    2    HA   TRP 779           HA       TRP 779  33.914  -7.980 -11.278
    3    HB2  TRP 779           HB2      TRP 779  33.322 -10.463 -11.069
    4    HB3  TRP 779           HB3      TRP 779  35.045 -10.068 -11.101
    5    HD1  TRP 779           HD1      TRP 779  32.314 -11.466  -8.844
    6    HE1  TRP 779           HE1      TRP 779  33.381 -12.362  -6.686
    7    HE3  TRP 779           HE3      TRP 779  37.107  -9.854  -9.542
    8    HZ2  TRP 779           HZ2      TRP 779  35.931 -12.345  -5.449
    9    HZ3  TRP 779           HZ3      TRP 779  38.766 -10.349  -7.843
   10    HH2  TRP 779           HH2      TRP 779  38.196 -11.549  -5.852

  No H/Q in entry =          10
  In of MODEL   33
    1    H    GLY 780           H        GLY 780  32.860  -7.118  -8.422
    2    HA3  GLY 780           HA2      GLY 780  30.764  -6.613  -7.620
    3    HA2  GLY 780           HA3      GLY 780  30.080  -7.307  -9.090

  No H/Q in entry =           3
  In of MODEL   33
    1    H    LYS 781           H        LYS 781  28.513  -8.169  -7.490
    2    HA   LYS 781           HA       LYS 781  29.300 -10.863  -6.839
    3    HB2  LYS 781           HB2      LYS 781  29.873  -9.755  -4.749
    4    HB3  LYS 781           HB3      LYS 781  28.287  -8.989  -4.693
    5    HG2  LYS 781           HG2      LYS 781  28.270 -10.810  -3.143
    6    HG3  LYS 781           HG3      LYS 781  27.274 -11.264  -4.523
    7    HD2  LYS 781           HD2      LYS 781  29.318 -12.461  -5.438
    8    HD3  LYS 781           HD3      LYS 781  30.060 -12.205  -3.860
    9    HE2  LYS 781           HE2      LYS 781  27.520 -13.734  -4.443
   10    HE3  LYS 781           HE3      LYS 781  29.078 -14.401  -3.970
   11    HZ3  LYS 781           HZ1      LYS 781  28.838 -13.434  -1.788
   12    HZ2  LYS 781           HZ2      LYS 781  27.366 -14.228  -2.169
   13    HZ1  LYS 781           HZ3      LYS 781  27.468 -12.589  -2.250

  No H/Q in entry =          13
  In of MODEL   33
    1    H    CYS 782           H        CYS 782  27.764 -12.048  -7.587
    2    HA   CYS 782           HA       CYS 782  24.976 -11.137  -7.413
    3    HB2  CYS 782           HB2      CYS 782  25.777 -11.453  -9.756
    4    HB3  CYS 782           HB3      CYS 782  26.213 -13.115  -9.372

  No H/Q in entry =           4
  In of MODEL   33
    1    H    ASP 783           H        ASP 783  23.561 -12.681  -6.399
    2    HA   ASP 783           HA       ASP 783  24.943 -15.063  -5.443
    3    HB2  ASP 783           HB2      ASP 783  25.063 -13.088  -3.777
    4    HB3  ASP 783           HB3      ASP 783  23.354 -13.410  -3.502

  No H/Q in entry =           4
  In of MODEL   33
    1    H    ALA 784           H        ALA 784  21.839 -13.506  -4.637
    2    HA   ALA 784           HA       ALA 784  20.512 -15.921  -5.615
    3    HB2  ALA 784           HB1      ALA 784  18.797 -15.496  -3.906
    4    HB1  ALA 784           HB2      ALA 784  19.710 -14.099  -3.337
    5    HB3  ALA 784           HB3      ALA 784  20.386 -15.723  -3.177

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLU 785           H        GLU 785  18.387 -15.538  -6.483
    2    HA   GLU 785           HA       GLU 785  18.437 -13.386  -8.304
    3    HB2  GLU 785           HB2      GLU 785  16.167 -15.282  -7.676
    4    HB3  GLU 785           HB3      GLU 785  16.261 -14.225  -9.079
    5    HG2  GLU 785           HG2      GLU 785  18.272 -15.392  -9.827
    6    HG3  GLU 785           HG3      GLU 785  18.171 -16.456  -8.430

  No H/Q in entry =           6
  In of MODEL   33
    1    H    SER 786           H        SER 786  16.494 -13.934  -5.383
    2    HA   SER 786           HA       SER 786  15.442 -11.245  -5.684
    3    HB2  SER 786           HB2      SER 786  14.722 -13.398  -3.684
    4    HB3  SER 786           HB3      SER 786  13.942 -11.818  -3.807
    5    HG   SER 786           HG       SER 786  12.676 -12.909  -5.079

  No H/Q in entry =           5
  In of MODEL   33
    1    H    SER 787           H        SER 787  17.537 -10.303  -5.339
    2    HA   SER 787           HA       SER 787  17.838  -9.139  -2.839
    3    HB2  SER 787           HB2      SER 787  20.125 -10.056  -2.266
    4    HB3  SER 787           HB3      SER 787  18.849 -11.257  -2.092
    5    HG   SER 787           HG       SER 787  19.709 -11.506  -4.569

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LYS 788           H        LYS 788  19.506  -7.422  -3.035
    2    HA   LYS 788           HA       LYS 788  19.983  -6.841  -5.798
    3    HB2  LYS 788           HB2      LYS 788  19.422  -4.917  -4.391
    4    HB3  LYS 788           HB3      LYS 788  20.793  -5.261  -3.354
    5    HG2  LYS 788           HG2      LYS 788  21.336  -3.407  -4.810
    6    HG3  LYS 788           HG3      LYS 788  22.340  -4.799  -5.194
    7    HD2  LYS 788           HD2      LYS 788  20.620  -5.292  -7.044
    8    HD3  LYS 788           HD3      LYS 788  20.027  -3.657  -6.751
    9    HE2  LYS 788           HE2      LYS 788  22.460  -2.899  -7.078
   10    HE3  LYS 788           HE3      LYS 788  22.739  -4.529  -7.686
   11    HZ3  LYS 788           HZ1      LYS 788  22.316  -2.960  -9.460
   12    HZ2  LYS 788           HZ2      LYS 788  20.798  -2.614  -8.846
   13    HZ1  LYS 788           HZ3      LYS 788  21.133  -4.160  -9.428

  No H/Q in entry =          13
  In of MODEL   33
    1    H    CYS 789           H        CYS 789  21.470  -7.720  -6.750
    2    HA   CYS 789           HA       CYS 789  24.166  -7.589  -5.921
    3    HB2  CYS 789           HB2      CYS 789  24.561 -10.028  -5.862
    4    HB3  CYS 789           HB3      CYS 789  23.461  -9.509  -4.606

  No H/Q in entry =           4
  In of MODEL   33
    1    H    VAL 790           H        VAL 790  25.482  -7.657  -7.715
    2    HA   VAL 790           HA       VAL 790  24.340  -8.609 -10.145
    3    HB   VAL 790           HB       VAL 790  25.052  -6.691 -11.494
    4   HG13  VAL 790          HG11      VAL 790  22.789  -6.761 -10.875
    5   HG12  VAL 790          HG12      VAL 790  23.332  -5.076 -10.865
    6   HG11  VAL 790          HG13      VAL 790  23.113  -5.949  -9.346
    7   HG23  VAL 790          HG21      VAL 790  25.630  -4.523 -10.458
    8   HG22  VAL 790          HG22      VAL 790  26.816  -5.792 -10.173
    9   HG21  VAL 790          HG23      VAL 790  25.705  -5.327  -8.877

  No H/Q in entry =           9
  In of MODEL   33
    1    H    CYS 791           H        CYS 791  25.941  -9.359 -11.506
    2    HA   CYS 791           HA       CYS 791  28.665  -9.110 -10.462
    3    HB2  CYS 791           HB2      CYS 791  29.172 -11.209 -11.715
    4    HB3  CYS 791           HB3      CYS 791  27.993 -11.428 -10.430

  No H/Q in entry =           4
  In of MODEL   33
    1    H    ARG 792           H        ARG 792  30.276  -8.531 -11.859
    2    HA   ARG 792           HA       ARG 792  29.386  -7.091 -14.192
    3    HB2  ARG 792           HB2      ARG 792  32.242  -7.670 -13.333
    4    HB3  ARG 792           HB3      ARG 792  31.707  -6.417 -14.432
    5    HG2  ARG 792           HG2      ARG 792  31.200  -6.506 -11.464
    6    HG3  ARG 792           HG3      ARG 792  32.415  -5.528 -12.273
    7    HD2  ARG 792           HD2      ARG 792  30.540  -4.399 -13.504
    8    HD3  ARG 792           HD3      ARG 792  29.422  -5.282 -12.460
    9    HE   ARG 792           HE       ARG 792  31.336  -4.004 -10.878
   10   HH11  ARG 792          HH11      ARG 792  28.569  -3.127 -12.884
   11   HH12  ARG 792          HH12      ARG 792  28.240  -1.673 -12.081
   12   HH21  ARG 792          HH21      ARG 792  30.912  -1.993  -9.751
   13   HH22  ARG 792          HH22      ARG 792  29.623  -1.010 -10.250

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLU 793           H        GLU 793  30.284  -7.789 -16.366
    2    HA   GLU 793           HA       GLU 793  30.845 -10.618 -16.360
    3    HB2  GLU 793           HB2      GLU 793  30.387  -8.690 -18.617
    4    HB3  GLU 793           HB3      GLU 793  30.925 -10.342 -18.884
    5    HG2  GLU 793           HG2      GLU 793  28.923 -11.106 -17.610
    6    HG3  GLU 793           HG3      GLU 793  28.358  -9.438 -17.634

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ALA 794           H        ALA 794  32.627 -11.444 -17.737
    2    HA   ALA 794           HA       ALA 794  35.083 -10.686 -16.579
    3    HB3  ALA 794           HB1      ALA 794  34.069 -12.699 -18.435
    4    HB2  ALA 794           HB2      ALA 794  35.404 -12.814 -17.260
    5    HB1  ALA 794           HB3      ALA 794  35.672 -12.132 -18.854

  No H/Q in entry =           5
  In of MODEL   33
    1    H    SER 795           H        SER 795  33.495  -9.893 -19.592
    2    HA   SER 795           HA       SER 795  35.732  -8.688 -20.763
    3    HB2  SER 795           HB2      SER 795  33.831  -7.854 -22.335
    4    HB3  SER 795           HB3      SER 795  34.219  -9.576 -22.267
    5    HG   SER 795           HG       SER 795  31.905  -8.747 -22.002

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLU 796           H        GLU 796  33.612  -7.617 -18.332
    2    HA   GLU 796           HA       GLU 796  33.846  -4.788 -19.112
    3    HB2  GLU 796           HB2      GLU 796  31.598  -5.888 -18.561
    4    HB3  GLU 796           HB3      GLU 796  32.159  -5.962 -16.901
    5    HG2  GLU 796           HG2      GLU 796  32.463  -3.461 -17.017
    6    HG3  GLU 796           HG3      GLU 796  31.617  -3.522 -18.557

  No H/Q in entry =           6
  In of MODEL   33
    1    H    CYS 797           H        CYS 797  35.540  -6.965 -17.442
    2    HA   CYS 797           HA       CYS 797  35.943  -5.646 -14.946
    3    HB2  CYS 797           HB2      CYS 797  37.432  -7.886 -16.290
    4    HB3  CYS 797           HB3      CYS 797  37.731  -7.338 -14.643

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLU 798           H        GLU 798  37.392  -4.176 -14.397
    2    HA   GLU 798           HA       GLU 798  39.473  -3.428 -16.349
    3    HB2  GLU 798           HB2      GLU 798  37.593  -1.805 -16.208
    4    HB3  GLU 798           HB3      GLU 798  37.929  -1.608 -14.499
    5    HG2  GLU 798           HG2      GLU 798  38.815   0.242 -15.804
    6    HG3  GLU 798           HG3      GLU 798  40.098  -0.659 -15.001

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU 799           H        GLU 799  38.766  -4.309 -13.085
    2    HA   GLU 799           HA       GLU 799  41.121  -3.114 -11.959
    3    HB2  GLU 799           HB2      GLU 799  39.136  -3.489 -10.559
    4    HB3  GLU 799           HB3      GLU 799  39.246  -5.214 -10.854
    5    HG2  GLU 799           HG2      GLU 799  40.073  -4.590  -8.622
    6    HG3  GLU 799           HG3      GLU 799  41.333  -5.322  -9.610

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLU 800           H        GLU 800  43.010  -4.165 -11.335
    2    HA   GLU 800           HA       GLU 800  43.489  -6.565 -12.881
    3    HB2  GLU 800           HB2      GLU 800  45.424  -4.416 -12.089
    4    HB3  GLU 800           HB3      GLU 800  45.944  -6.014 -12.585
    5    HG2  GLU 800           HG2      GLU 800  44.572  -5.533 -14.712
    6    HG3  GLU 800           HG3      GLU 800  44.676  -3.848 -14.186

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLY 801           H        GLY 801  42.627  -7.715 -11.317
    2    HA3  GLY 801           HA2      GLY 801  44.027  -8.130  -8.837
    3    HA2  GLY 801           HA3      GLY 801  42.868  -9.230  -9.587

  No H/Q in entry =           3
  In of MODEL   33
    1    H    PHE 802           H        PHE 802  44.066 -10.977  -9.305
    2    HA   PHE 802           HA       PHE 802  46.624 -11.103 -10.699
    3    HB2  PHE 802           HB2      PHE 802  45.224 -12.974  -8.822
    4    HB3  PHE 802           HB3      PHE 802  46.547 -13.546  -9.820
    5    HD1  PHE 802           HD1      PHE 802  46.608 -10.110  -8.509
    6    HD2  PHE 802           HD2      PHE 802  47.835 -14.127  -7.860
    7    HE1  PHE 802           HE1      PHE 802  48.193  -9.363  -6.835
    8    HE2  PHE 802           HE2      PHE 802  49.387 -13.412  -6.220
    9    HZ   PHE 802           HZ       PHE 802  49.610 -10.997  -5.658

  No H/Q in entry =           9
  In of MODEL   33
    1    H    SER 803           H        SER 803  46.825 -13.507 -11.689
    2    HA   SER 803           HA       SER 803  44.556 -13.923 -13.442
    3    HB2  SER 803           HB2      SER 803  47.501 -14.189 -14.084
    4    HB3  SER 803           HB3      SER 803  46.167 -14.561 -15.177
    5    HG   SER 803           HG       SER 803  46.095 -12.040 -14.063

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ILE 804           H        ILE 804  43.957 -16.027 -13.470
    2    HA   ILE 804           HA       ILE 804  45.587 -17.836 -11.858
    3    HB   ILE 804           HB       ILE 804  43.692 -18.713 -10.661
    4   HG12  ILE 804          HG12      ILE 804  41.958 -18.370 -12.447
    5   HG13  ILE 804          HG13      ILE 804  41.414 -17.946 -10.833
    6   HG22  ILE 804          HG21      ILE 804  43.674 -15.702 -10.536
    7   HG21  ILE 804          HG22      ILE 804  44.753 -16.778  -9.644
    8   HG23  ILE 804          HG23      ILE 804  43.022 -16.764  -9.287
    9   HD12  ILE 804          HD11      ILE 804  42.214 -16.064 -13.041
   10   HD11  ILE 804          HD12      ILE 804  41.850 -15.585 -11.391
   11   HD13  ILE 804          HD13      ILE 804  40.598 -16.333 -12.383

  No H/Q in entry =          11
  In of MODEL   33
    1    H    CYS 805           H        CYS 805  44.758 -20.120 -12.047
    2    HA   CYS 805           HA       CYS 805  44.249 -20.658 -14.880
    3    HB2  CYS 805           HB2      CYS 805  46.365 -21.566 -13.993
    4    HB3  CYS 805           HB3      CYS 805  45.472 -22.380 -12.707

  No H/Q in entry =           4
  In of MODEL   33
    1    H    VAL 806           H        VAL 806  42.350 -21.352 -15.372
    2    HA   VAL 806           HA       VAL 806  40.772 -22.669 -13.288
    3    HB   VAL 806           HB       VAL 806  39.681 -20.842 -15.406
    4   HG13  VAL 806          HG11      VAL 806  38.064 -22.396 -14.695
    5   HG12  VAL 806          HG12      VAL 806  37.685 -20.824 -13.954
    6   HG11  VAL 806          HG13      VAL 806  38.435 -22.104 -13.000
    7   HG22  VAL 806          HG21      VAL 806  40.987 -19.463 -13.970
    8   HG21  VAL 806          HG22      VAL 806  40.241 -20.166 -12.532
    9   HG23  VAL 806          HG23      VAL 806  39.279 -19.178 -13.640

  No H/Q in entry =           9
  In of MODEL   33
    1    H    GLU 807           H        GLU 807  39.990 -24.552 -13.908
    2    HA   GLU 807           HA       GLU 807  40.361 -25.449 -16.603
    3    HB2  GLU 807           HB2      GLU 807  40.815 -26.951 -14.714
    4    HB3  GLU 807           HB3      GLU 807  39.163 -26.781 -14.160
    5    HG2  GLU 807           HG2      GLU 807  38.392 -27.839 -16.242
    6    HG3  GLU 807           HG3      GLU 807  40.076 -28.062 -16.720

  No H/Q in entry =           6
  In of MODEL   33
    1    H    VAL 808           H        VAL 808  38.966 -25.115 -18.028
    2    HA   VAL 808           HA       VAL 808  36.134 -24.941 -17.457
    3    HB   VAL 808           HB       VAL 808  36.976 -22.602 -17.418
    4   HG13  VAL 808          HG11      VAL 808  37.936 -21.544 -19.390
    5   HG12  VAL 808          HG12      VAL 808  38.016 -23.123 -20.178
    6   HG11  VAL 808          HG13      VAL 808  38.968 -22.814 -18.728
    7   HG21  VAL 808          HG21      VAL 808  35.410 -23.217 -19.903
    8   HG23  VAL 808          HG22      VAL 808  35.607 -21.623 -19.173
    9   HG22  VAL 808          HG23      VAL 808  34.748 -22.890 -18.290

  No H/Q in entry =           9
  In of MODEL   33
    1    H    ASN 809           H        ASN 809  35.088 -26.091 -18.946
    2    HA   ASN 809           HA       ASN 809  34.613 -27.153 -20.919
    3    HB2  ASN 809           HB2      ASN 809  36.697 -25.209 -21.813
    4    HB3  ASN 809           HB3      ASN 809  35.959 -26.333 -22.952
    5   HD21  ASN 809          HD21      ASN 809  35.839 -23.256 -22.152
    6   HD22  ASN 809          HD22      ASN 809  34.148 -22.955 -22.253

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLY 810           H        GLY 810  36.669 -28.020 -19.015
    2    HA3  GLY 810           HA2      GLY 810  37.674 -30.098 -18.869
    3    HA2  GLY 810           HA3      GLY 810  37.669 -30.171 -20.655

  No H/Q in entry =           3
  In of MODEL   33
    1    H    LYS 811           H        LYS 811  38.854 -27.379 -20.462
    2    HA   LYS 811           HA       LYS 811  41.631 -28.337 -20.223
    3    HB2  LYS 811           HB2      LYS 811  42.134 -26.546 -21.841
    4    HB3  LYS 811           HB3      LYS 811  41.053 -27.779 -22.482
    5    HG2  LYS 811           HG2      LYS 811  39.131 -26.297 -22.013
    6    HG3  LYS 811           HG3      LYS 811  40.254 -25.053 -21.472
    7    HD2  LYS 811           HD2      LYS 811  40.138 -26.294 -24.181
    8    HD3  LYS 811           HD3      LYS 811  39.493 -24.705 -23.765
    9    HE2  LYS 811           HE2      LYS 811  41.768 -24.002 -23.064
   10    HE3  LYS 811           HE3      LYS 811  42.387 -25.557 -23.598
   11    HZ1  LYS 811           HZ1      LYS 811  41.694 -25.026 -25.845
   12    HZ3  LYS 811           HZ2      LYS 811  42.766 -23.883 -25.222
   13    HZ2  LYS 811           HZ3      LYS 811  41.120 -23.512 -25.329

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLU 812           H        GLU 812  43.191 -26.541 -19.646
    2    HA   GLU 812           HA       GLU 812  41.913 -24.851 -17.661
    3    HB2  GLU 812           HB2      GLU 812  44.796 -25.654 -17.958
    4    HB3  GLU 812           HB3      GLU 812  44.179 -24.566 -16.724
    5    HG2  GLU 812           HG2      GLU 812  42.753 -26.385 -15.876
    6    HG3  GLU 812           HG3      GLU 812  43.475 -27.467 -17.068

  No H/Q in entry =           6
  In of MODEL   33
    1    H    GLN 813           H        GLN 813  41.776 -22.824 -17.899
    2    HA   GLN 813           HA       GLN 813  43.360 -21.500 -19.975
    3    HB2  GLN 813           HB2      GLN 813  41.119 -21.738 -20.765
    4    HB3  GLN 813           HB3      GLN 813  40.462 -21.239 -19.219
    5    HG2  GLN 813           HG2      GLN 813  41.273 -18.983 -19.591
    6    HG3  GLN 813           HG3      GLN 813  41.966 -19.469 -21.138
    7   HE21  GLN 813          HE21      GLN 813  39.823 -17.562 -20.397
    8   HE22  GLN 813          HE22      GLN 813  38.463 -18.012 -21.347

  No H/Q in entry =           8
  In of MODEL   33
    1    H    THR 814           H        THR 814  44.084 -19.449 -19.446
    2    HA   THR 814           HA       THR 814  44.098 -18.819 -16.614
    3    HB   THR 814           HB       THR 814  45.547 -17.603 -18.938
    4    HG1  THR 814           HG1      THR 814  45.843 -19.900 -17.985
    5   HG21  THR 814          HG21      THR 814  45.390 -16.079 -16.997
    6   HG23  THR 814          HG22      THR 814  47.045 -16.637 -17.244
    7   HG22  THR 814          HG23      THR 814  46.059 -17.353 -15.969

  No H/Q in entry =           7
  In of MODEL   33
    1    H    MET 815           H        MET 815  42.743 -17.360 -15.872
    2    HA   MET 815           HA       MET 815  41.629 -15.392 -17.758
    3    HB2  MET 815           HB2      MET 815  40.135 -16.279 -15.305
    4    HB3  MET 815           HB3      MET 815  39.521 -15.482 -16.741
    5    HG2  MET 815           HG2      MET 815  40.097 -17.712 -17.950
    6    HG3  MET 815           HG3      MET 815  40.269 -18.300 -16.303
    7    HE1  MET 815           HE1      MET 815  38.604 -20.172 -16.906
    8    HE3  MET 815           HE2      MET 815  38.267 -19.480 -18.489
    9    HE2  MET 815           HE3      MET 815  36.933 -19.896 -17.410

  No H/Q in entry =           9
  In of MODEL   33
    1    H    SER 816           H        SER 816  41.022 -13.420 -16.665
    2    HA   SER 816           HA       SER 816  42.893 -12.605 -14.690
    3    HB2  SER 816           HB2      SER 816  40.315 -11.376 -15.609
    4    HB3  SER 816           HB3      SER 816  41.620 -10.516 -14.760
    5    HG   SER 816           HG       SER 816  41.524 -11.593 -17.357

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLU 817           H        GLU 817  42.363 -12.043 -12.566
    2    HA   GLU 817           HA       GLU 817  40.963 -13.868 -11.074
    3    HB2  GLU 817           HB2      GLU 817  42.765 -12.171 -10.477
    4    HB3  GLU 817           HB3      GLU 817  41.442 -11.046 -10.311
    5    HG2  GLU 817           HG2      GLU 817  40.452 -12.323  -8.568
    6    HG3  GLU 817           HG3      GLU 817  41.616 -13.612  -8.854

  No H/Q in entry =           6
  In of MODEL   33
    1    H    CYS 818           H        CYS 818  39.874 -10.959 -12.567
    2    HA   CYS 818           HA       CYS 818  37.465 -10.857 -11.020
    3    HB2  CYS 818           HB2      CYS 818  37.088  -8.864 -12.665
    4    HB3  CYS 818           HB3      CYS 818  38.300  -8.724 -11.389

  No H/Q in entry =           4
  In of MODEL   33
    1    H    GLU 819           H        GLU 819  38.600 -11.781 -14.121
    2    HA   GLU 819           HA       GLU 819  36.210 -12.189 -15.501
    3    HB2  GLU 819           HB2      GLU 819  38.933 -13.103 -15.539
    4    HB3  GLU 819           HB3      GLU 819  37.905 -14.151 -16.433
    5    HG2  GLU 819           HG2      GLU 819  37.267 -12.058 -17.680
    6    HG3  GLU 819           HG3      GLU 819  38.629 -11.269 -16.851

  No H/Q in entry =           6
  In of MODEL   33
    1    H    ALA 820           H        ALA 820  38.292 -14.589 -13.921
    2    HA   ALA 820           HA       ALA 820  36.605 -16.770 -14.038
    3    HB3  ALA 820           HB1      ALA 820  38.640 -16.151 -11.929
    4    HB1  ALA 820           HB2      ALA 820  38.944 -16.922 -13.495
    5    HB2  ALA 820           HB3      ALA 820  37.970 -17.745 -12.277

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLY 821           H        GLY 821  37.031 -14.316 -11.505
    2    HA3  GLY 821           HA2      GLY 821  35.358 -15.386  -9.525
    3    HA2  GLY 821           HA3      GLY 821  35.797 -13.689  -9.685

  No H/Q in entry =           3
  In of MODEL   33
    1    H    ALA 822           H        ALA 822  34.667 -13.032 -12.086
    2    HA   ALA 822           HA       ALA 822  31.983 -12.566 -11.406
    3    HB2  ALA 822           HB1      ALA 822  33.309 -11.128 -12.917
    4    HB3  ALA 822           HB2      ALA 822  31.759 -11.635 -13.583
    5    HB1  ALA 822           HB3      ALA 822  33.248 -12.413 -14.132

  No H/Q in entry =           5
  In of MODEL   33
    1    H    LEU 823           H        LEU 823  33.562 -14.856 -13.492
    2    HA   LEU 823           HA       LEU 823  31.263 -15.972 -14.586
    3    HB2  LEU 823           HB2      LEU 823  34.019 -17.110 -14.215
    4    HB3  LEU 823           HB3      LEU 823  32.754 -17.945 -15.099
    5    HG   LEU 823           HG       LEU 823  33.820 -15.212 -15.823
    6   HD13  LEU 823          HD11      LEU 823  34.911 -16.286 -17.684
    7   HD12  LEU 823          HD12      LEU 823  34.381 -17.872 -17.115
    8   HD11  LEU 823          HD13      LEU 823  35.520 -16.909 -16.158
    9   HD21  LEU 823          HD21      LEU 823  31.903 -17.075 -17.224
   10   HD23  LEU 823          HD22      LEU 823  32.610 -15.628 -17.944
   11   HD22  LEU 823          HD23      LEU 823  31.543 -15.484 -16.552

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ARG 824           H        ARG 824  33.070 -16.875 -11.662
    2    HA   ARG 824           HA       ARG 824  31.387 -19.074 -10.988
    3    HB2  ARG 824           HB2      ARG 824  32.812 -17.272  -9.000
    4    HB3  ARG 824           HB3      ARG 824  32.212 -18.893  -8.686
    5    HG2  ARG 824           HG2      ARG 824  33.906 -19.701 -10.385
    6    HG3  ARG 824           HG3      ARG 824  34.586 -18.069 -10.346
    7    HD2  ARG 824           HD2      ARG 824  34.368 -20.078  -8.117
    8    HD3  ARG 824           HD3      ARG 824  35.832 -19.502  -8.882
    9    HE   ARG 824           HE       ARG 824  34.394 -17.352  -7.683
   10   HH11  ARG 824          HH11      ARG 824  36.577 -20.050  -6.829
   11   HH12  ARG 824          HH12      ARG 824  37.139 -19.283  -5.409
   12   HH21  ARG 824          HH21      ARG 824  35.154 -16.388  -5.695
   13   HH22  ARG 824          HH22      ARG 824  36.318 -17.156  -4.746

  No H/Q in entry =          13
  In of MODEL   33
    1    H    CYS 825           H        CYS 825  31.251 -15.665 -10.309
    2    HA   CYS 825           HA       CYS 825  29.036 -15.676  -8.605
    3    HB2  CYS 825           HB2      CYS 825  30.366 -13.591 -10.248
    4    HB3  CYS 825           HB3      CYS 825  28.910 -13.179  -9.380

  No H/Q in entry =           4
  In of MODEL   33
    1    H    ARG 826           H        ARG 826  29.152 -15.542 -12.144
    2    HA   ARG 826           HA       ARG 826  26.327 -14.963 -12.222
    3    HB2  ARG 826           HB2      ARG 826  26.490 -15.118 -14.633
    4    HB3  ARG 826           HB3      ARG 826  27.678 -13.988 -13.976
    5    HG2  ARG 826           HG2      ARG 826  29.404 -15.584 -14.355
    6    HG3  ARG 826           HG3      ARG 826  28.231 -16.813 -14.848
    7    HD2  ARG 826           HD2      ARG 826  28.754 -14.189 -16.254
    8    HD3  ARG 826           HD3      ARG 826  29.290 -15.781 -16.798
    9    HE   ARG 826           HE       ARG 826  26.672 -16.165 -16.610
   10   HH11  ARG 826          HH11      ARG 826  28.492 -13.599 -18.228
   11   HH12  ARG 826          HH12      ARG 826  27.250 -13.258 -19.341
   12   HH21  ARG 826          HH21      ARG 826  24.995 -15.670 -18.137
   13   HH22  ARG 826          HH22      ARG 826  25.235 -14.461 -19.311

  No H/Q in entry =          13
  In of MODEL   33
    1    H    GLY 827           H        GLY 827  28.122 -17.754 -11.883
    2    HA3  GLY 827           HA2      GLY 827  27.024 -19.820 -11.479
    3    HA2  GLY 827           HA3      GLY 827  25.718 -19.290 -12.528

  No H/Q in entry =           3
  In of MODEL   33
    1    H    GLN 828           H        GLN 828  28.675 -18.570 -13.944
    2    HA   GLN 828           HA       GLN 828  28.413 -20.561 -15.941
    3    HB2  GLN 828           HB2      GLN 828  29.541 -18.385 -16.366
    4    HB3  GLN 828           HB3      GLN 828  30.829 -18.854 -15.264
    5    HG2  GLN 828           HG2      GLN 828  31.521 -19.173 -17.610
    6    HG3  GLN 828           HG3      GLN 828  31.443 -20.688 -16.729
    7   HE21  GLN 828          HE21      GLN 828  29.906 -18.756 -19.181
    8   HE22  GLN 828          HE22      GLN 828  28.982 -20.062 -19.848

  No H/Q in entry =           8
  In of MODEL   33
    1    H    SER 829           H        SER 829  29.778 -22.424 -16.277
    2    HA   SER 829           HA       SER 829  30.649 -23.531 -13.739
    3    HB2  SER 829           HB2      SER 829  30.336 -24.875 -16.424
    4    HB3  SER 829           HB3      SER 829  30.532 -25.671 -14.855
    5    HG   SER 829           HG       SER 829  28.568 -23.934 -14.669

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ILE 830           H        ILE 830  32.621 -23.110 -13.196
    2    HA   ILE 830           HA       ILE 830  34.785 -23.671 -15.019
    3    HB   ILE 830           HB       ILE 830  36.034 -21.674 -14.473
    4   HG12  ILE 830          HG12      ILE 830  35.015 -21.237 -12.214
    5   HG13  ILE 830          HG13      ILE 830  35.243 -19.777 -13.149
    6   HG22  ILE 830          HG21      ILE 830  34.767 -19.924 -15.673
    7   HG21  ILE 830          HG22      ILE 830  33.347 -20.981 -15.566
    8   HG23  ILE 830          HG23      ILE 830  34.766 -21.504 -16.469
    9   HD11  ILE 830          HD11      ILE 830  32.824 -19.937 -13.793
   10   HD13  ILE 830          HD12      ILE 830  33.133 -19.611 -12.105
   11   HD12  ILE 830          HD13      ILE 830  32.666 -21.240 -12.615

  No H/Q in entry =          11
  In of MODEL   33
    1    H    SER 831           H        SER 831  36.611 -24.377 -13.925
    2    HA   SER 831           HA       SER 831  36.217 -24.763 -11.062
    3    HB2  SER 831           HB2      SER 831  37.515 -26.504 -13.126
    4    HB3  SER 831           HB3      SER 831  37.451 -26.844 -11.398
    5    HG   SER 831           HG       SER 831  35.156 -26.850 -11.598

  No H/Q in entry =           5
  In of MODEL   33
    1    H    VAL 832           H        VAL 832  37.534 -23.151 -10.236
    2    HA   VAL 832           HA       VAL 832  40.025 -22.401 -11.375
    3    HB   VAL 832           HB       VAL 832  39.059 -22.019  -8.522
    4   HG12  VAL 832          HG11      VAL 832  41.232 -20.568 -10.053
    5   HG11  VAL 832          HG12      VAL 832  41.479 -21.700  -8.725
    6   HG13  VAL 832          HG13      VAL 832  40.679 -20.155  -8.428
    7   HG21  VAL 832          HG21      VAL 832  38.833 -20.171 -10.900
    8   HG23  VAL 832          HG22      VAL 832  38.385 -19.762  -9.246
    9   HG22  VAL 832          HG23      VAL 832  37.511 -21.028 -10.108

  No H/Q in entry =           9
  In of MODEL   33
    1    H    THR 833           H        THR 833  41.713 -23.751 -11.536
    2    HA   THR 833           HA       THR 833  41.902 -25.972  -9.720
    3    HB   THR 833           HB       THR 833  43.825 -26.617 -11.253
    4    HG1  THR 833           HG1      THR 833  43.888 -25.506 -13.230
    5   HG21  THR 833          HG21      THR 833  41.094 -26.191 -12.464
    6   HG23  THR 833          HG22      THR 833  41.578 -27.566 -11.475
    7   HG22  THR 833          HG23      THR 833  42.314 -27.315 -13.059

  No H/Q in entry =           7
  In of MODEL   33
    1    H    SER 834           H        SER 834  43.629 -23.026 -10.435
    2    HA   SER 834           HA       SER 834  44.917 -23.134  -7.892
    3    HB2  SER 834           HB2      SER 834  46.470 -24.497  -9.277
    4    HB3  SER 834           HB3      SER 834  46.613 -23.155 -10.410
    5    HG   SER 834           HG       SER 834  47.935 -23.588  -8.138

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ILE 835           H        ILE 835  45.944 -21.057  -7.442
    2    HA   ILE 835           HA       ILE 835  44.536 -19.039  -8.944
    3    HB   ILE 835           HB       ILE 835  44.630 -17.558  -7.170
    4   HG12  ILE 835          HG12      ILE 835  47.042 -17.635  -6.650
    5   HG13  ILE 835          HG13      ILE 835  46.063 -17.689  -5.191
    6   HG22  ILE 835          HG21      ILE 835  44.478 -20.282  -5.929
    7   HG21  ILE 835          HG22      ILE 835  43.166 -19.382  -6.692
    8   HG23  ILE 835          HG23      ILE 835  43.893 -18.791  -5.194
    9   HD12  ILE 835          HD11      ILE 835  47.521 -19.923  -6.516
   10   HD11  ILE 835          HD12      ILE 835  46.411 -20.060  -5.125
   11   HD13  ILE 835          HD13      ILE 835  47.888 -19.081  -4.984

  No H/Q in entry =          11
  In of MODEL   33
    1    H    ARG 836           H        ARG 836  47.247 -20.436  -9.421
    2    HA   ARG 836           HA       ARG 836  48.593 -18.005 -10.248
    3    HB2  ARG 836           HB2      ARG 836  50.647 -19.465 -10.649
    4    HB3  ARG 836           HB3      ARG 836  50.148 -19.379  -8.976
    5    HG2  ARG 836           HG2      ARG 836  50.787 -21.622  -9.376
    6    HG3  ARG 836           HG3      ARG 836  49.023 -21.606  -9.320
    7    HD2  ARG 836           HD2      ARG 836  48.998 -21.492 -11.767
    8    HD3  ARG 836           HD3      ARG 836  50.754 -21.684 -11.784
    9    HE   ARG 836           HE       ARG 836  50.044 -23.840 -10.436
   10   HH11  ARG 836          HH11      ARG 836  48.773 -22.508 -13.458
   11   HH12  ARG 836          HH12      ARG 836  48.126 -24.011 -13.979
   12   HH21  ARG 836          HH21      ARG 836  49.144 -25.870 -11.176
   13   HH22  ARG 836          HH22      ARG 836  48.304 -25.927 -12.656

  No H/Q in entry =          13
  In of MODEL   33
    1    HA   PRO 837           HA       PRO 837  47.147 -18.677 -14.344
    2    HB2  PRO 837           HB2      PRO 837  49.727 -17.932 -15.532
    3    HB3  PRO 837           HB3      PRO 837  48.194 -17.065 -15.569
    4    HG2  PRO 837           HG2      PRO 837  50.290 -16.170 -14.135
    5    HG3  PRO 837           HG3      PRO 837  48.614 -15.952 -13.597
    6    HD2  PRO 837           HD2      PRO 837  50.642 -17.967 -12.718
    7    HD3  PRO 837           HD3      PRO 837  49.508 -17.007 -11.746

  No H/Q in entry =           7
  In of MODEL   33
    1    H    CYS 838           H        CYS 838  47.550 -19.829 -16.483
    2    HA   CYS 838           HA       CYS 838  49.450 -21.977 -16.090
    3    HB2  CYS 838           HB2      CYS 838  47.995 -23.362 -17.689
    4    HB3  CYS 838           HB3      CYS 838  47.266 -23.065 -16.131

  No H/Q in entry =           4
  In of MODEL   33
    1    H    ALA 839           H        ALA 839  49.961 -22.940 -18.467
    2    HA   ALA 839           HA       ALA 839  51.000 -20.673 -19.973
    3    HB3  ALA 839           HB1      ALA 839  52.307 -22.391 -21.148
    4    HB1  ALA 839           HB2      ALA 839  51.428 -23.644 -20.273
    5    HB2  ALA 839           HB3      ALA 839  52.492 -22.542 -19.398

  No H/Q in entry =           5
  In of MODEL   33
    1    H    ALA 840           H        ALA 840  48.201 -21.217 -19.964
    2    HA   ALA 840           HA       ALA 840  47.395 -22.554 -22.352
    3    HB1  ALA 840           HB1      ALA 840  45.170 -21.804 -21.791
    4    HB3  ALA 840           HB2      ALA 840  45.842 -20.574 -20.723
    5    HB2  ALA 840           HB3      ALA 840  46.000 -22.264 -20.288

  No H/Q in entry =           5
  In of MODEL   33
    1    H    GLU 841           H        GLU 841  47.936 -19.296 -21.392
    2    HA   GLU 841           HA       GLU 841  47.917 -17.313 -22.355
    3    HB2  GLU 841           HB2      GLU 841  49.334 -18.857 -24.494
    4    HB3  GLU 841           HB3      GLU 841  49.277 -17.099 -24.420
    5    HG2  GLU 841           HG2      GLU 841  50.452 -18.947 -22.352
    6    HG3  GLU 841           HG3      GLU 841  51.309 -17.861 -23.448

  No H/Q in entry =           6
  In of MODEL   33
    1    H    THR 842           H        THR 842  45.948 -16.802 -22.464
    2    HA   THR 842           HA       THR 842  44.150 -17.497 -24.534
    3    HB   THR 842           HB       THR 842  44.009 -15.150 -22.646
    4    HG1  THR 842           HG1      THR 842  43.420 -16.581 -21.092
    5   HG21  THR 842          HG21      THR 842  41.844 -16.762 -24.025
    6   HG23  THR 842          HG22      THR 842  42.329 -15.121 -24.441
    7   HG22  THR 842          HG23      THR 842  41.564 -15.445 -22.887

  No H/Q in entry =           7
  In of MODEL   33
    1    H    GLN 843           H        GLN 843  44.211 -16.817 -26.524
    2    HA   GLN 843           HA       GLN 843  44.480 -15.666 -28.420
    3    HB2  GLN 843           HB2      GLN 843  44.349 -13.250 -26.607
    4    HB3  GLN 843           HB3      GLN 843  44.366 -13.152 -28.362
    5    HG2  GLN 843           HG2      GLN 843  42.255 -14.457 -26.657
    6    HG3  GLN 843           HG3      GLN 843  42.125 -12.906 -27.486
    7   HE21  GLN 843          HE21      GLN 843  40.514 -15.296 -27.732
    8   HE22  GLN 843          HE22      GLN 843  40.567 -15.764 -29.385

  No H/Q in entry =           8
  In of MODEL   34
    1    H1   GLY 689           H2       GLY 689  53.004  10.773 -29.209
    2    H2   GLY 689           H1       GLY 689  54.039  10.599 -27.901
    3    H3   GLY 689           H3       GLY 689  53.222  12.067 -28.134
    4    HA2  GLY 689           HA2      GLY 689  55.538  12.228 -28.814
    5    HA3  GLY 689           HA3      GLY 689  54.437  12.436 -30.174

  No H/Q in entry =           5
  In of MODEL   34
    1    H    SER 690           H        SER 690  56.452  11.823 -31.344
    2    HA   SER 690           HA       SER 690  56.187   9.272 -32.404
    3    HB2  SER 690           HB2      SER 690  58.546  11.135 -32.577
    4    HB3  SER 690           HB3      SER 690  58.110   9.865 -33.722
    5    HG   SER 690           HG       SER 690  57.303  11.644 -34.580

  No H/Q in entry =           5
  In of MODEL   34
    1    H    HIS 691           H        HIS 691  56.687   7.442 -31.426
    2    HA   HIS 691           HA       HIS 691  58.949   7.325 -29.592
    3    HB2  HIS 691           HB2      HIS 691  56.655   5.460 -30.132
    4    HB3  HIS 691           HB3      HIS 691  58.123   4.858 -29.382
    5    HD1  HIS 691           HD1      HIS 691  58.243   5.049 -26.936
    6    HD2  HIS 691           HD2      HIS 691  55.388   7.599 -28.542
    7    HE1  HIS 691           HE1      HIS 691  57.003   6.001 -24.966
    8    HE2  HIS 691           HE2      HIS 691  55.473   7.735 -25.974

  No H/Q in entry =           8
  In of MODEL   34
    1    H    MET 692           H        MET 692  60.806   6.623 -30.208
    2    HA   MET 692           HA       MET 692  61.112   5.310 -32.772
    3    HB2  MET 692           HB2      MET 692  63.174   6.012 -30.666
    4    HB3  MET 692           HB3      MET 692  63.524   5.360 -32.259
    5    HG2  MET 692           HG2      MET 692  62.285   8.037 -31.664
    6    HG3  MET 692           HG3      MET 692  63.938   7.739 -32.196
    7    HE3  MET 692           HE1      MET 692  63.386   6.428 -35.857
    8    HE2  MET 692           HE2      MET 692  63.493   5.435 -34.406
    9    HE1  MET 692           HE3      MET 692  64.574   6.814 -34.610

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ASN 693           H        ASN 693  61.511   4.738 -29.340
    2    HA   ASN 693           HA       ASN 693  61.262   1.873 -29.881
    3    HB2  ASN 693           HB2      ASN 693  62.612   3.217 -27.501
    4    HB3  ASN 693           HB3      ASN 693  62.339   1.495 -27.654
    5   HD21  ASN 693          HD21      ASN 693  63.134   1.541 -30.550
    6   HD22  ASN 693          HD22      ASN 693  64.841   1.724 -30.525

  No H/Q in entry =           6
  In of MODEL   34
    1    HA   PRO 694           HA       PRO 694  57.393   2.552 -27.681
    2    HB2  PRO 694           HB2      PRO 694  57.625  -0.342 -27.025
    3    HB3  PRO 694           HB3      PRO 694  56.307   0.513 -27.834
    4    HG2  PRO 694           HG2      PRO 694  57.935  -1.098 -29.210
    5    HG3  PRO 694           HG3      PRO 694  57.338   0.417 -29.905
    6    HD2  PRO 694           HD2      PRO 694  60.022  -0.195 -28.733
    7    HD3  PRO 694           HD3      PRO 694  59.605   0.762 -30.174

  No H/Q in entry =           7
  In of MODEL   34
    1    H    LEU 695           H        LEU 695  59.934   0.500 -26.484
    2    HA   LEU 695           HA       LEU 695  59.802   1.791 -23.905
    3    HB2  LEU 695           HB2      LEU 695  60.124  -0.307 -22.707
    4    HB3  LEU 695           HB3      LEU 695  58.639  -0.356 -23.613
    5    HG   LEU 695           HG       LEU 695  61.195  -1.781 -24.441
    6   HD13  LEU 695          HD11      LEU 695  60.335  -2.698 -22.377
    7   HD12  LEU 695          HD12      LEU 695  60.065  -3.819 -23.709
    8   HD11  LEU 695          HD13      LEU 695  58.728  -2.850 -23.091
    9   HD21  LEU 695          HD21      LEU 695  58.360  -2.057 -25.467
   10   HD23  LEU 695          HD22      LEU 695  59.733  -3.046 -25.960
   11   HD22  LEU 695          HD23      LEU 695  59.705  -1.325 -26.343

  No H/Q in entry =          11
  In of MODEL   34
    1    H    THR 696           H        THR 696  61.659   2.826 -23.789
    2    HA   THR 696           HA       THR 696  63.981   1.745 -25.142
    3    HB   THR 696           HB       THR 696  63.689   4.359 -23.634
    4    HG1  THR 696           HG1      THR 696  62.532   4.966 -25.277
    5   HG21  THR 696          HG21      THR 696  66.010   3.626 -24.052
    6   HG23  THR 696          HG22      THR 696  65.600   5.070 -24.983
    7   HG22  THR 696          HG23      THR 696  65.634   3.494 -25.771

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLN 697           H        GLN 697  63.395   3.248 -21.955
    2    HA   GLN 697           HA       GLN 697  65.437   1.537 -20.782
    3    HB2  GLN 697           HB2      GLN 697  65.332   3.977 -20.237
    4    HB3  GLN 697           HB3      GLN 697  63.745   3.725 -19.536
    5    HG2  GLN 697           HG2      GLN 697  65.462   3.883 -17.823
    6    HG3  GLN 697           HG3      GLN 697  64.714   2.286 -17.822
    7   HE21  GLN 697          HE21      GLN 697  67.575   4.102 -18.572
    8   HE22  GLN 697          HE22      GLN 697  68.633   2.747 -18.706

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ALA 698           H        ALA 698  62.097   1.986 -21.039
    2    HA   ALA 698           HA       ALA 698  60.247   0.835 -20.555
    3    HB3  ALA 698           HB1      ALA 698  60.323  -1.536 -20.174
    4    HB2  ALA 698           HB2      ALA 698  62.006  -1.435 -19.677
    5    HB1  ALA 698           HB3      ALA 698  61.571  -1.126 -21.359

  No H/Q in entry =           5
  In of MODEL   34
    1    H    VAL 699           H        VAL 699  59.114  -0.427 -18.736
    2    HA   VAL 699           HA       VAL 699  60.022   0.596 -16.142
    3    HB   VAL 699           HB       VAL 699  57.131   0.244 -17.028
    4   HG12  VAL 699          HG11      VAL 699  58.270   1.519 -14.547
    5   HG11  VAL 699          HG12      VAL 699  57.437  -0.032 -14.635
    6   HG13  VAL 699          HG13      VAL 699  56.560   1.460 -14.976
    7   HG23  VAL 699          HG21      VAL 699  58.692   2.811 -16.736
    8   HG22  VAL 699          HG22      VAL 699  56.960   2.698 -17.058
    9   HG21  VAL 699          HG23      VAL 699  58.122   2.108 -18.248

  No H/Q in entry =           9
  In of MODEL   34
    1    HA   PRO 700           HA       PRO 700  60.282  -3.796 -15.584
    2    HB2  PRO 700           HB2      PRO 700  60.326  -3.762 -12.802
    3    HB3  PRO 700           HB3      PRO 700  61.735  -3.625 -13.857
    4    HG2  PRO 700           HG2      PRO 700  60.172  -1.489 -12.492
    5    HG3  PRO 700           HG3      PRO 700  61.917  -1.594 -12.773
    6    HD2  PRO 700           HD2      PRO 700  60.341   0.001 -14.232
    7    HD3  PRO 700           HD3      PRO 700  61.731  -0.842 -14.957

  No H/Q in entry =           7
  In of MODEL   34
    1    H    LYS 701           H        LYS 701  58.844  -5.329 -15.511
    2    HA   LYS 701           HA       LYS 701  56.177  -4.825 -14.471
    3    HB2  LYS 701           HB2      LYS 701  57.344  -7.216 -15.930
    4    HB3  LYS 701           HB3      LYS 701  55.668  -7.068 -15.446
    5    HG2  LYS 701           HG2      LYS 701  57.074  -5.275 -17.420
    6    HG3  LYS 701           HG3      LYS 701  56.050  -6.645 -17.842
    7    HD2  LYS 701           HD2      LYS 701  54.165  -5.524 -16.656
    8    HD3  LYS 701           HD3      LYS 701  55.213  -4.132 -16.393
    9    HE2  LYS 701           HE2      LYS 701  55.482  -3.890 -18.832
   10    HE3  LYS 701           HE3      LYS 701  54.403  -5.257 -19.075
   11    HZ2  LYS 701           HZ1      LYS 701  53.674  -2.647 -17.836
   12    HZ1  LYS 701           HZ2      LYS 701  52.646  -3.981 -17.959
   13    HZ3  LYS 701           HZ3      LYS 701  53.163  -3.223 -19.339

  No H/Q in entry =          13
  In of MODEL   34
    1    H    CYS 702           H        CYS 702  55.462  -5.763 -12.624
    2    HA   CYS 702           HA       CYS 702  57.433  -7.387 -11.163
    3    HB2  CYS 702           HB2      CYS 702  55.027  -5.992  -9.933
    4    HB3  CYS 702           HB3      CYS 702  56.443  -6.643  -9.156

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLN 703           H        GLN 703  56.454  -9.196  -9.934
    2    HA   GLN 703           HA       GLN 703  54.330 -10.378 -11.436
    3    HB2  GLN 703           HB2      GLN 703  55.604 -11.250  -8.835
    4    HB3  GLN 703           HB3      GLN 703  54.508 -12.224  -9.804
    5    HG2  GLN 703           HG2      GLN 703  57.222 -11.247 -10.660
    6    HG3  GLN 703           HG3      GLN 703  56.837 -12.877 -10.117
    7   HE21  GLN 703          HE21      GLN 703  57.918 -11.896 -12.649
    8   HE22  GLN 703          HE22      GLN 703  56.864 -12.469 -13.886

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ARG 704           H        ARG 704  52.433 -11.248 -10.113
    2    HA   ARG 704           HA       ARG 704  50.911  -9.010  -9.366
    3    HB2  ARG 704           HB2      ARG 704  50.348 -11.939  -8.984
    4    HB3  ARG 704           HB3      ARG 704  49.164 -10.668  -8.719
    5    HG2  ARG 704           HG2      ARG 704  50.591 -11.079 -11.323
    6    HG3  ARG 704           HG3      ARG 704  49.026 -11.802 -10.932
    7    HD2  ARG 704           HD2      ARG 704  47.975  -9.723 -10.869
    8    HD3  ARG 704           HD3      ARG 704  49.478  -8.866 -10.678
    9    HE   ARG 704           HE       ARG 704  50.011  -9.502 -12.973
   10   HH11  ARG 704          HH11      ARG 704  46.576  -9.477 -12.045
   11   HH12  ARG 704          HH12      ARG 704  46.027  -9.165 -13.627
   12   HH21  ARG 704          HH21      ARG 704  49.234  -8.965 -15.108
   13   HH22  ARG 704          HH22      ARG 704  47.575  -8.794 -15.386

  No H/Q in entry =          13
  In of MODEL   34
    1    H    TRP 705           H        TRP 705  52.755 -11.171  -7.428
    2    HA   TRP 705           HA       TRP 705  51.617 -10.150  -4.946
    3    HB2  TRP 705           HB2      TRP 705  53.012 -11.943  -3.892
    4    HB3  TRP 705           HB3      TRP 705  51.831 -12.543  -5.056
    5    HD1  TRP 705           HD1      TRP 705  55.596 -12.337  -4.440
    6    HE1  TRP 705           HE1      TRP 705  56.818 -13.615  -6.241
    7    HE3  TRP 705           HE3      TRP 705  51.632 -13.402  -7.515
    8    HZ2  TRP 705           HZ2      TRP 705  56.213 -14.996  -8.648
    9    HZ3  TRP 705           HZ3      TRP 705  52.052 -14.739  -9.534
   10    HH2  TRP 705           HH2      TRP 705  54.297 -15.516 -10.088

  No H/Q in entry =          10
  In of MODEL   34
    1    H    GLU 706           H        GLU 706  53.666  -8.954  -7.018
    2    HA   GLU 706           HA       GLU 706  55.654  -8.167  -5.034
    3    HB2  GLU 706           HB2      GLU 706  55.928  -8.446  -8.014
    4    HB3  GLU 706           HB3      GLU 706  57.143  -7.697  -6.972
    5    HG2  GLU 706           HG2      GLU 706  57.354  -9.856  -5.806
    6    HG3  GLU 706           HG3      GLU 706  56.204 -10.555  -6.944

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LYS 707           H        LYS 707  56.435  -6.086  -5.188
    2    HA   LYS 707           HA       LYS 707  54.747  -4.167  -6.584
    3    HB2  LYS 707           HB2      LYS 707  54.896  -2.652  -4.604
    4    HB3  LYS 707           HB3      LYS 707  53.929  -4.085  -4.309
    5    HG2  LYS 707           HG2      LYS 707  55.792  -5.082  -3.068
    6    HG3  LYS 707           HG3      LYS 707  56.777  -3.660  -3.409
    7    HD2  LYS 707           HD2      LYS 707  54.177  -3.625  -1.861
    8    HD3  LYS 707           HD3      LYS 707  55.775  -3.658  -1.120
    9    HE2  LYS 707           HE2      LYS 707  56.320  -1.514  -2.156
   10    HE3  LYS 707           HE3      LYS 707  54.758  -1.495  -2.971
   11    HZ3  LYS 707           HZ1      LYS 707  53.671  -1.372  -0.841
   12    HZ2  LYS 707           HZ2      LYS 707  54.745  -0.104  -1.022
   13    HZ1  LYS 707           HZ3      LYS 707  55.148  -1.400  -0.020

  No H/Q in entry =          13
  In of MODEL   34
    1    H    LEU 708           H        LEU 708  55.828  -2.316  -7.229
    2    HA   LEU 708           HA       LEU 708  58.674  -2.738  -7.539
    3    HB2  LEU 708           HB2      LEU 708  57.320  -2.233  -9.507
    4    HB3  LEU 708           HB3      LEU 708  56.823  -0.715  -8.785
    5    HG   LEU 708           HG       LEU 708  59.147   0.087  -8.903
    6   HD12  LEU 708          HD11      LEU 708  60.792  -1.148 -10.228
    7   HD11  LEU 708          HD12      LEU 708  59.676  -2.511 -10.333
    8   HD13  LEU 708          HD13      LEU 708  60.329  -2.021  -8.770
    9   HD23  LEU 708          HD21      LEU 708  58.022  -0.911 -11.516
   10   HD22  LEU 708          HD22      LEU 708  59.220   0.374 -11.336
   11   HD21  LEU 708          HD23      LEU 708  57.589   0.592 -10.704

  No H/Q in entry =          11
  In of MODEL   34
    1    H    GLN 709           H        GLN 709  59.992  -1.903  -6.109
    2    HA   GLN 709           HA       GLN 709  59.768   0.895  -5.550
    3    HB2  GLN 709           HB2      GLN 709  59.998   0.743  -3.171
    4    HB3  GLN 709           HB3      GLN 709  58.628  -0.267  -3.603
    5    HG2  GLN 709           HG2      GLN 709  60.148  -2.257  -3.425
    6    HG3  GLN 709           HG3      GLN 709  61.392  -1.160  -2.907
    7   HE21  GLN 709          HE21      GLN 709  61.372  -0.264  -0.908
    8   HE22  GLN 709          HE22      GLN 709  60.315  -0.777   0.336

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ASN 710           H        ASN 710  61.759   1.781  -5.338
    2    HA   ASN 710           HA       ASN 710  64.028   1.998  -5.266
    3    HB2  ASN 710           HB2      ASN 710  63.647   0.468  -3.152
    4    HB3  ASN 710           HB3      ASN 710  64.135  -0.815  -4.211
    5   HD21  ASN 710          HD21      ASN 710  65.780  -1.171  -2.724
    6   HD22  ASN 710          HD22      ASN 710  67.212  -0.214  -2.793

  No H/Q in entry =           6
  In of MODEL   34
    1    H    SER 711           H        SER 711  62.641   0.740  -7.598
    2    HA   SER 711           HA       SER 711  63.160   0.082  -9.684
    3    HB2  SER 711           HB2      SER 711  65.168   1.544  -9.434
    4    HB3  SER 711           HB3      SER 711  66.061   0.190  -8.759
    5    HG   SER 711           HG       SER 711  65.530  -0.876 -10.837

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ARG 712           H        ARG 712  62.890  -1.825  -7.315
    2    HA   ARG 712           HA       ARG 712  63.709  -4.196  -8.800
    3    HB2  ARG 712           HB2      ARG 712  64.372  -5.331  -6.736
    4    HB3  ARG 712           HB3      ARG 712  65.361  -3.902  -6.992
    5    HG2  ARG 712           HG2      ARG 712  64.124  -2.692  -5.338
    6    HG3  ARG 712           HG3      ARG 712  62.981  -4.015  -5.149
    7    HD2  ARG 712           HD2      ARG 712  64.550  -4.074  -3.315
    8    HD3  ARG 712           HD3      ARG 712  64.864  -5.442  -4.380
    9    HE   ARG 712           HE       ARG 712  66.571  -3.644  -5.331
   10   HH11  ARG 712          HH11      ARG 712  65.999  -4.670  -1.970
   11   HH12  ARG 712          HH12      ARG 712  67.560  -4.316  -1.439
   12   HH21  ARG 712          HH21      ARG 712  68.744  -3.199  -4.613
   13   HH22  ARG 712          HH22      ARG 712  69.175  -3.470  -2.988

  No H/Q in entry =          13
  In of MODEL   34
    1    H    CYS 713           H        CYS 713  62.450  -6.081  -8.120
    2    HA   CYS 713           HA       CYS 713  59.744  -5.262  -7.395
    3    HB2  CYS 713           HB2      CYS 713  60.765  -7.829  -8.619
    4    HB3  CYS 713           HB3      CYS 713  59.074  -7.425  -8.361

  No H/Q in entry =           4
  In of MODEL   34
    1    H    VAL 714           H        VAL 714  59.256  -5.555  -5.334
    2    HA   VAL 714           HA       VAL 714  60.554  -7.748  -3.864
    3    HB   VAL 714           HB       VAL 714  60.113  -6.452  -1.791
    4   HG13  VAL 714          HG11      VAL 714  62.290  -6.205  -2.840
    5   HG12  VAL 714          HG12      VAL 714  61.773  -4.677  -2.116
    6   HG11  VAL 714          HG13      VAL 714  61.657  -4.911  -3.859
    7   HG21  VAL 714          HG21      VAL 714  59.185  -4.285  -3.670
    8   HG23  VAL 714          HG22      VAL 714  59.449  -4.083  -1.944
    9   HG22  VAL 714          HG23      VAL 714  58.187  -5.173  -2.520

  No H/Q in entry =           9
  In of MODEL   34
    1    H    CYS 715           H        CYS 715  59.042  -8.474  -1.998
    2    HA   CYS 715           HA       CYS 715  56.518  -9.029  -3.317
    3    HB2  CYS 715           HB2      CYS 715  57.680 -10.131  -0.759
    4    HB3  CYS 715           HB3      CYS 715  56.169 -10.656  -1.486

  No H/Q in entry =           4
  In of MODEL   34
    1    H    LYS 716           H        LYS 716  54.547  -8.575  -2.530
    2    HA   LYS 716           HA       LYS 716  54.210  -6.189  -0.996
    3    HB2  LYS 716           HB2      LYS 716  52.190  -8.250  -1.945
    4    HB3  LYS 716           HB3      LYS 716  51.785  -6.664  -1.300
    5    HG2  LYS 716           HG2      LYS 716  52.706  -5.554  -3.162
    6    HG3  LYS 716           HG3      LYS 716  53.547  -7.001  -3.704
    7    HD2  LYS 716           HD2      LYS 716  51.674  -6.637  -5.168
    8    HD3  LYS 716           HD3      LYS 716  51.335  -8.040  -4.180
    9    HE2  LYS 716           HE2      LYS 716  49.845  -6.755  -2.777
   10    HE3  LYS 716           HE3      LYS 716  50.271  -5.270  -3.630
   11    HZ1  LYS 716           HZ1      LYS 716  48.939  -7.618  -4.902
   12    HZ3  LYS 716           HZ2      LYS 716  49.266  -6.135  -5.636
   13    HZ2  LYS 716           HZ3      LYS 716  48.153  -6.214  -4.403

  No H/Q in entry =          13
  In of MODEL   34
    1    H    MET 717           H        MET 717  52.272  -6.449   0.778
    2    HA   MET 717           HA       MET 717  53.266  -8.496   2.609
    3    HB2  MET 717           HB2      MET 717  51.991  -5.826   3.216
    4    HB3  MET 717           HB3      MET 717  52.392  -7.024   4.433
    5    HG2  MET 717           HG2      MET 717  54.339  -5.602   2.624
    6    HG3  MET 717           HG3      MET 717  54.094  -5.303   4.341
    7    HE1  MET 717           HE1      MET 717  54.792  -7.022   6.256
    8    HE3  MET 717           HE2      MET 717  55.503  -8.604   5.939
    9    HE2  MET 717           HE3      MET 717  53.822  -8.296   5.511

  No H/Q in entry =           9
  In of MODEL   34
    1    HA   PRO 718           HA       PRO 718  49.419 -10.629   2.517
    2    HB2  PRO 718           HB2      PRO 718  49.456 -10.797   5.482
    3    HB3  PRO 718           HB3      PRO 718  49.408 -12.096   4.286
    4    HG2  PRO 718           HG2      PRO 718  51.639 -11.594   5.628
    5    HG3  PRO 718           HG3      PRO 718  51.703 -12.002   3.902
    6    HD2  PRO 718           HD2      PRO 718  51.928  -9.328   5.232
    7    HD3  PRO 718           HD3      PRO 718  52.878 -10.002   3.888

  No H/Q in entry =           7
  In of MODEL   34
    1    H    TYR 719           H        TYR 719  49.638  -7.856   4.509
    2    HA   TYR 719           HA       TYR 719  46.730  -7.693   4.806
    3    HB2  TYR 719           HB2      TYR 719  47.236  -5.761   6.340
    4    HB3  TYR 719           HB3      TYR 719  47.893  -7.303   6.869
    5    HD1  TYR 719           HD1      TYR 719  50.336  -7.737   6.703
    6    HD2  TYR 719           HD2      TYR 719  48.672  -3.933   5.763
    7    HE1  TYR 719           HE1      TYR 719  52.550  -6.726   6.891
    8    HE2  TYR 719           HE2      TYR 719  50.895  -2.916   5.929
    9    HH   TYR 719           HH       TYR 719  53.018  -3.347   6.926

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLU 720           H        GLU 720  48.832  -6.960   2.517
    2    HA   GLU 720           HA       GLU 720  47.773  -4.344   1.744
    3    HB2  GLU 720           HB2      GLU 720  50.224  -4.939   1.606
    4    HB3  GLU 720           HB3      GLU 720  49.815  -6.160   0.421
    5    HG2  GLU 720           HG2      GLU 720  50.683  -4.278  -0.734
    6    HG3  GLU 720           HG3      GLU 720  48.947  -4.330  -1.039

  No H/Q in entry =           6
  In of MODEL   34
    1    H    CYS 721           H        CYS 721  47.055  -7.516   1.629
    2    HA   CYS 721           HA       CYS 721  46.264  -7.890  -1.095
    3    HB2  CYS 721           HB2      CYS 721  45.724  -9.557   1.357
    4    HB3  CYS 721           HB3      CYS 721  45.572 -10.074  -0.322

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLY 722           H        GLY 722  44.309  -7.526  -1.911
    2    HA3  GLY 722           HA2      GLY 722  42.003  -7.340  -0.170
    3    HA2  GLY 722           HA3      GLY 722  42.430  -5.894  -1.073

  No H/Q in entry =           3
  In of MODEL   34
    1    HA   PRO 723           HA       PRO 723  40.275  -7.504  -4.519
    2    HB2  PRO 723           HB2      PRO 723  42.087  -6.724  -6.593
    3    HB3  PRO 723           HB3      PRO 723  40.673  -5.854  -6.003
    4    HG2  PRO 723           HG2      PRO 723  43.294  -5.019  -5.682
    5    HG3  PRO 723           HG3      PRO 723  41.925  -4.472  -4.703
    6    HD2  PRO 723           HD2      PRO 723  44.005  -6.527  -4.081
    7    HD3  PRO 723           HD3      PRO 723  43.223  -5.351  -3.004

  No H/Q in entry =           7
  In of MODEL   34
    1    H    SER 724           H        SER 724  40.594  -9.756  -4.013
    2    HA   SER 724           HA       SER 724  41.623 -11.148  -6.268
    3    HB2  SER 724           HB2      SER 724  42.828 -11.469  -3.550
    4    HB3  SER 724           HB3      SER 724  42.770 -12.829  -4.670
    5    HG   SER 724           HG       SER 724  43.730 -11.222  -6.184

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU 725           H        LEU 725  41.008 -13.341  -6.285
    2    HA   LEU 725           HA       LEU 725  38.385 -13.864  -5.406
    3    HB2  LEU 725           HB2      LEU 725  40.578 -15.430  -6.684
    4    HB3  LEU 725           HB3      LEU 725  39.064 -16.194  -6.280
    5    HG   LEU 725           HG       LEU 725  39.284 -13.784  -8.080
    6   HD11  LEU 725          HD11      LEU 725  39.112 -16.704  -8.844
    7   HD13  LEU 725          HD12      LEU 725  40.516 -15.648  -9.066
    8   HD12  LEU 725          HD13      LEU 725  39.022 -15.318  -9.936
    9   HD21  LEU 725          HD21      LEU 725  37.105 -15.803  -7.628
   10   HD23  LEU 725          HD22      LEU 725  37.080 -14.502  -8.815
   11   HD22  LEU 725          HD23      LEU 725  37.100 -14.120  -7.095

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ASP 726           H        ASP 726  37.622 -15.166  -3.786
    2    HA   ASP 726           HA       ASP 726  39.431 -15.701  -1.587
    3    HB2  ASP 726           HB2      ASP 726  36.442 -16.170  -1.819
    4    HB3  ASP 726           HB3      ASP 726  37.393 -16.516  -0.391

  No H/Q in entry =           4
  In of MODEL   34
    1    H    VAL 727           H        VAL 727  40.201 -17.585  -1.062
    2    HA   VAL 727           HA       VAL 727  39.134 -20.000  -2.284
    3    HB   VAL 727           HB       VAL 727  41.451 -20.817  -2.728
    4   HG13  VAL 727          HG11      VAL 727  41.807 -19.547  -4.798
    5   HG12  VAL 727          HG12      VAL 727  40.681 -18.316  -4.228
    6   HG11  VAL 727          HG13      VAL 727  40.106 -19.948  -4.561
    7   HG22  VAL 727          HG21      VAL 727  43.312 -19.213  -2.840
    8   HG21  VAL 727          HG22      VAL 727  42.661 -19.317  -1.207
    9   HG23  VAL 727          HG23      VAL 727  42.250 -17.944  -2.232

  No H/Q in entry =           9
  In of MODEL   34
    1    H    CYS 728           H        CYS 728  40.302 -21.958  -1.242
    2    HA   CYS 728           HA       CYS 728  40.587 -21.393   1.610
    3    HB2  CYS 728           HB2      CYS 728  39.450 -23.837   0.257
    4    HB3  CYS 728           HB3      CYS 728  39.566 -23.561   1.992

  No H/Q in entry =           4
  In of MODEL   34
    1    H    ALA 729           H        ALA 729  42.497 -21.982   2.438
    2    HA   ALA 729           HA       ALA 729  44.093 -23.901   0.909
    3    HB3  ALA 729           HB1      ALA 729  44.855 -21.618   0.441
    4    HB2  ALA 729           HB2      ALA 729  46.066 -22.572   1.299
    5    HB1  ALA 729           HB3      ALA 729  45.106 -21.374   2.171

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLN 730           H        GLN 730  45.623 -25.019   2.127
    2    HA   GLN 730           HA       GLN 730  44.834 -25.294   4.911
    3    HB2  GLN 730           HB2      GLN 730  44.810 -27.330   3.516
    4    HB3  GLN 730           HB3      GLN 730  46.526 -27.114   3.215
    5    HG2  GLN 730           HG2      GLN 730  47.050 -27.417   5.517
    6    HG3  GLN 730           HG3      GLN 730  45.351 -27.479   5.956
    7   HE21  GLN 730          HE21      GLN 730  45.428 -29.522   6.817
    8   HE22  GLN 730          HE22      GLN 730  45.763 -30.933   5.904

  No H/Q in entry =           8
  In of MODEL   34
    1    H    ASP 731           H        ASP 731  45.916 -24.478   6.327
    2    HA   ASP 731           HA       ASP 731  48.459 -23.241   6.085
    3    HB2  ASP 731           HB2      ASP 731  46.753 -22.432   7.619
    4    HB3  ASP 731           HB3      ASP 731  46.700 -23.988   8.400

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLU 732           H        GLU 732  50.278 -24.465   5.900
    2    HA   GLU 732           HA       GLU 732  50.414 -27.178   6.554
    3    HB2  GLU 732           HB2      GLU 732  52.605 -25.187   5.969
    4    HB3  GLU 732           HB3      GLU 732  52.920 -26.872   6.313
    5    HG2  GLU 732           HG2      GLU 732  51.197 -25.842   4.080
    6    HG3  GLU 732           HG3      GLU 732  52.853 -26.433   3.932

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ARG 733           H        ARG 733  50.849 -24.467   8.559
    2    HA   ARG 733           HA       ARG 733  52.579 -25.630  10.472
    3    HB2  ARG 733           HB2      ARG 733  52.304 -23.205  10.213
    4    HB3  ARG 733           HB3      ARG 733  50.640 -23.334  10.737
    5    HG2  ARG 733           HG2      ARG 733  52.031 -22.483  12.527
    6    HG3  ARG 733           HG3      ARG 733  51.385 -24.065  12.950
    7    HD2  ARG 733           HD2      ARG 733  53.499 -25.118  12.465
    8    HD3  ARG 733           HD3      ARG 733  54.161 -23.603  11.844
    9    HE   ARG 733           HE       ARG 733  53.328 -23.070  14.398
   10   HH11  ARG 733          HH11      ARG 733  55.644 -25.354  13.036
   11   HH12  ARG 733          HH12      ARG 733  56.713 -25.273  14.348
   12   HH21  ARG 733          HH21      ARG 733  54.758 -22.927  16.179
   13   HH22  ARG 733          HH22      ARG 733  56.204 -23.833  16.206

  No H/Q in entry =          13
  In of MODEL   34
    1    H    SER 734           H        SER 734  49.067 -24.947  10.665
    2    HA   SER 734           HA       SER 734  48.965 -26.932  12.832
    3    HB2  SER 734           HB2      SER 734  46.886 -24.893  12.050
    4    HB3  SER 734           HB3      SER 734  46.918 -25.865  13.522
    5    HG   SER 734           HG       SER 734  49.118 -24.308  12.874

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LYS 735           H        LYS 735  48.503 -26.929   9.571
    2    HA   LYS 735           HA       LYS 735  47.475 -28.170   8.065
    3    HB2  LYS 735           HB2      LYS 735  47.038 -30.037  10.400
    4    HB3  LYS 735           HB3      LYS 735  46.659 -30.457   8.736
    5    HG2  LYS 735           HG2      LYS 735  49.377 -29.841   9.890
    6    HG3  LYS 735           HG3      LYS 735  48.790 -31.396   9.291
    7    HD2  LYS 735           HD2      LYS 735  48.492 -30.254   7.037
    8    HD3  LYS 735           HD3      LYS 735  49.367 -28.900   7.721
    9    HE2  LYS 735           HE2      LYS 735  50.436 -31.699   7.508
   10    HE3  LYS 735           HE3      LYS 735  50.861 -30.360   6.444
   11    HZ3  LYS 735           HZ1      LYS 735  52.521 -30.681   8.095
   12    HZ2  LYS 735           HZ2      LYS 735  51.425 -30.569   9.355
   13    HZ1  LYS 735           HZ3      LYS 735  51.774 -29.206   8.406

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ARG 736           H        ARG 736  46.057 -26.164   9.289
    2    HA   ARG 736           HA       ARG 736  43.267 -27.079   9.456
    3    HB2  ARG 736           HB2      ARG 736  42.898 -24.741  10.333
    4    HB3  ARG 736           HB3      ARG 736  43.966 -25.725  11.330
    5    HG2  ARG 736           HG2      ARG 736  45.914 -24.651  10.247
    6    HG3  ARG 736           HG3      ARG 736  44.805 -23.643   9.333
    7    HD2  ARG 736           HD2      ARG 736  44.060 -22.557  11.313
    8    HD3  ARG 736           HD3      ARG 736  44.947 -23.694  12.334
    9    HE   ARG 736           HE       ARG 736  46.925 -22.707  10.866
   10   HH11  ARG 736          HH11      ARG 736  44.313 -20.977  12.562
   11   HH12  ARG 736          HH12      ARG 736  45.255 -19.591  12.829
   12   HH21  ARG 736          HH21      ARG 736  48.189 -20.769  11.263
   13   HH22  ARG 736          HH22      ARG 736  47.473 -19.473  12.109

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ILE 737           H        ILE 737  41.749 -26.334   7.962
    2    HA   ILE 737           HA       ILE 737  42.834 -25.060   5.585
    3    HB   ILE 737           HB       ILE 737  39.956 -25.804   6.131
    4   HG12  ILE 737          HG12      ILE 737  41.433 -27.794   6.392
    5   HG13  ILE 737          HG13      ILE 737  40.306 -27.949   5.051
    6   HG22  ILE 737          HG21      ILE 737  41.488 -25.449   3.542
    7   HG21  ILE 737          HG22      ILE 737  40.403 -24.264   4.263
    8   HG23  ILE 737          HG23      ILE 737  39.764 -25.809   3.703
    9   HD12  ILE 737          HD11      ILE 737  43.224 -27.272   4.918
   10   HD11  ILE 737          HD12      ILE 737  42.124 -27.355   3.538
   11   HD13  ILE 737          HD13      ILE 737  42.476 -28.814   4.476

  No H/Q in entry =          11
  In of MODEL   34
    1    H    LEU 738           H        LEU 738  42.666 -22.895   5.311
    2    HA   LEU 738           HA       LEU 738  40.580 -21.547   6.804
    3    HB2  LEU 738           HB2      LEU 738  42.092 -19.764   7.471
    4    HB3  LEU 738           HB3      LEU 738  42.554 -21.299   8.190
    5    HG   LEU 738           HG       LEU 738  44.234 -21.288   6.092
    6   HD12  LEU 738          HD11      LEU 738  43.832 -18.397   6.641
    7   HD11  LEU 738          HD12      LEU 738  43.271 -19.285   5.232
    8   HD13  LEU 738          HD13      LEU 738  45.012 -19.155   5.554
    9   HD21  LEU 738          HD21      LEU 738  44.628 -19.724   8.622
   10   HD23  LEU 738          HD22      LEU 738  45.890 -20.218   7.490
   11   HD22  LEU 738          HD23      LEU 738  44.967 -21.451   8.374

  No H/Q in entry =          11
  In of MODEL   34
    1    HA   PRO 739           HA       PRO 739  39.805 -19.375   3.054
    2    HB2  PRO 739           HB2      PRO 739  38.672 -17.108   4.012
    3    HB3  PRO 739           HB3      PRO 739  37.860 -18.687   4.099
    4    HG2  PRO 739           HG2      PRO 739  39.380 -17.221   6.215
    5    HG3  PRO 739           HG3      PRO 739  37.824 -18.062   6.331
    6    HD2  PRO 739           HD2      PRO 739  40.145 -19.183   7.140
    7    HD3  PRO 739           HD3      PRO 739  38.807 -20.135   6.468

  No H/Q in entry =           7
  In of MODEL   34
    1    H    LEU 740           H        LEU 740  41.235 -18.426   1.776
    2    HA   LEU 740           HA       LEU 740  42.709 -16.047   2.661
    3    HB2  LEU 740           HB2      LEU 740  43.857 -18.436   1.201
    4    HB3  LEU 740           HB3      LEU 740  44.631 -16.872   1.220
    5    HG   LEU 740           HG       LEU 740  44.135 -18.590   3.658
    6   HD13  LEU 740          HD11      LEU 740  46.481 -18.983   3.655
    7   HD12  LEU 740          HD12      LEU 740  46.690 -17.989   2.197
    8   HD11  LEU 740          HD13      LEU 740  45.815 -19.513   2.104
    9   HD21  LEU 740          HD21      LEU 740  44.156 -16.188   4.154
   10   HD23  LEU 740          HD22      LEU 740  45.710 -16.052   3.313
   11   HD22  LEU 740          HD23      LEU 740  45.586 -17.005   4.786

  No H/Q in entry =          11
  In of MODEL   34
    1    H    THR 741           H        THR 741  43.697 -15.013   0.606
    2    HA   THR 741           HA       THR 741  41.853 -15.416  -1.610
    3    HB   THR 741           HB       THR 741  42.714 -13.119  -2.292
    4    HG1  THR 741           HG1      THR 741  43.007 -12.125   0.116
    5   HG23  THR 741          HG21      THR 741  40.496 -13.534  -1.645
    6   HG22  THR 741          HG22      THR 741  41.011 -11.985  -0.946
    7   HG21  THR 741          HG23      THR 741  40.895 -13.445   0.073

  No H/Q in entry =           7
  In of MODEL   34
    1    H    VAL 742           H        VAL 742  42.839 -14.857  -3.662
    2    HA   VAL 742           HA       VAL 742  44.994 -16.402  -4.191
    3    HB   VAL 742           HB       VAL 742  44.022 -14.022  -5.763
    4   HG12  VAL 742          HG11      VAL 742  44.964 -15.109  -7.711
    5   HG11  VAL 742          HG12      VAL 742  45.690 -16.353  -6.685
    6   HG13  VAL 742          HG13      VAL 742  46.204 -14.665  -6.543
    7   HG22  VAL 742          HG21      VAL 742  42.297 -15.585  -5.342
    8   HG21  VAL 742          HG22      VAL 742  43.324 -16.913  -5.944
    9   HG23  VAL 742          HG23      VAL 742  42.789 -15.621  -7.039

  No H/Q in entry =           9
  In of MODEL   34
    1    H    CYS 743           H        CYS 743  44.866 -12.848  -3.946
    2    HA   CYS 743           HA       CYS 743  47.538 -12.255  -4.230
    3    HB2  CYS 743           HB2      CYS 743  45.681 -10.591  -4.209
    4    HB3  CYS 743           HB3      CYS 743  45.548 -10.802  -2.473

  No H/Q in entry =           4
  In of MODEL   34
    1    H    LYS 744           H        LYS 744  45.739 -12.983  -1.265
    2    HA   LYS 744           HA       LYS 744  47.805 -12.370   0.533
    3    HB2  LYS 744           HB2      LYS 744  45.229 -12.839   0.782
    4    HB3  LYS 744           HB3      LYS 744  45.794 -14.452   1.160
    5    HG2  LYS 744           HG2      LYS 744  47.150 -13.599   2.979
    6    HG3  LYS 744           HG3      LYS 744  46.632 -11.949   2.606
    7    HD2  LYS 744           HD2      LYS 744  44.287 -12.697   2.941
    8    HD3  LYS 744           HD3      LYS 744  44.899 -14.239   3.520
    9    HE2  LYS 744           HE2      LYS 744  44.434 -12.906   5.425
   10    HE3  LYS 744           HE3      LYS 744  46.188 -12.965   5.250
   11    HZ2  LYS 744           HZ1      LYS 744  45.391 -10.745   5.751
   12    HZ1  LYS 744           HZ2      LYS 744  44.434 -10.744   4.374
   13    HZ3  LYS 744           HZ3      LYS 744  46.103 -10.730   4.229

  No H/Q in entry =          13
  In of MODEL   34
    1    H    MET 745           H        MET 745  46.668 -15.473  -0.741
    2    HA   MET 745           HA       MET 745  48.520 -17.165   0.470
    3    HB2  MET 745           HB2      MET 745  46.979 -18.401  -0.463
    4    HB3  MET 745           HB3      MET 745  46.624 -17.281  -1.768
    5    HG2  MET 745           HG2      MET 745  47.439 -19.175  -2.900
    6    HG3  MET 745           HG3      MET 745  48.820 -18.132  -2.793
    7    HE1  MET 745           HE1      MET 745  47.095 -21.293  -1.448
    8    HE3  MET 745           HE2      MET 745  47.302 -20.424   0.079
    9    HE2  MET 745           HE3      MET 745  48.220 -21.893  -0.241

  No H/Q in entry =           9
  In of MODEL   34
    1    H    HIS 746           H        HIS 746  48.722 -15.440  -2.647
    2    HA   HIS 746           HA       HIS 746  51.185 -16.676  -3.411
    3    HB2  HIS 746           HB2      HIS 746  49.705 -14.313  -4.351
    4    HB3  HIS 746           HB3      HIS 746  51.400 -14.451  -4.851
    5    HD1  HIS 746           HD1      HIS 746  51.899 -16.393  -6.571
    6    HD2  HIS 746           HD2      HIS 746  47.897 -15.911  -5.606
    7    HE1  HIS 746           HE1      HIS 746  50.630 -17.506  -8.407
    8    HE2  HIS 746           HE2      HIS 746  48.203 -17.169  -7.828

  No H/Q in entry =           8
  In of MODEL   34
    1    H    VAL 747           H        VAL 747  50.472 -13.560  -1.925
    2    HA   VAL 747           HA       VAL 747  53.087 -12.609  -1.741
    3    HB   VAL 747           HB       VAL 747  50.579 -12.056  -0.146
    4   HG11  VAL 747          HG11      VAL 747  52.522 -11.705   1.359
    5   HG13  VAL 747          HG12      VAL 747  51.739 -10.193   0.946
    6   HG12  VAL 747          HG13      VAL 747  53.249 -10.648   0.155
    7   HG22  VAL 747          HG21      VAL 747  50.668 -11.280  -2.434
    8   HG21  VAL 747          HG22      VAL 747  52.216 -10.512  -2.111
    9   HG23  VAL 747          HG23      VAL 747  50.750  -9.902  -1.319

  No H/Q in entry =           9
  In of MODEL   34
    1    H    LEU 748           H        LEU 748  51.117 -14.212   0.655
    2    HA   LEU 748           HA       LEU 748  53.080 -14.434   2.584
    3    HB2  LEU 748           HB2      LEU 748  51.087 -14.674   3.573
    4    HB3  LEU 748           HB3      LEU 748  50.335 -15.246   2.119
    5    HG   LEU 748           HG       LEU 748  51.851 -17.067   3.992
    6   HD13  LEU 748          HD11      LEU 748  49.650 -17.611   4.905
    7   HD12  LEU 748          HD12      LEU 748  48.904 -16.411   3.858
    8   HD11  LEU 748          HD13      LEU 748  49.991 -15.896   5.155
    9   HD22  LEU 748          HD21      LEU 748  50.536 -18.782   2.892
   10   HD21  LEU 748          HD22      LEU 748  51.408 -17.867   1.662
   11   HD23  LEU 748          HD23      LEU 748  49.692 -17.575   1.937

  No H/Q in entry =          11
  In of MODEL   34
    1    H    HIS 749           H        HIS 749  52.291 -16.532  -0.091
    2    HA   HIS 749           HA       HIS 749  53.845 -18.786   0.610
    3    HB2  HIS 749           HB2      HIS 749  52.096 -18.557  -1.258
    4    HB3  HIS 749           HB3      HIS 749  53.362 -17.787  -2.201
    5    HD1  HIS 749           HD1      HIS 749  55.166 -19.383  -3.273
    6    HD2  HIS 749           HD2      HIS 749  52.373 -21.253  -0.838
    7    HE1  HIS 749           HE1      HIS 749  55.474 -21.800  -3.664
    8    HE2  HIS 749           HE2      HIS 749  54.111 -22.870  -1.887

  No H/Q in entry =           8
  In of MODEL   34
    1    H    CYS 750           H        CYS 750  54.544 -15.826  -1.195
    2    HA   CYS 750           HA       CYS 750  57.192 -16.669  -1.802
    3    HB2  CYS 750           HB2      CYS 750  55.757 -14.081  -2.282
    4    HB3  CYS 750           HB3      CYS 750  57.387 -14.447  -2.859

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLN 751           H        GLN 751  55.684 -14.861   0.769
    2    HA   GLN 751           HA       GLN 751  58.132 -13.812   1.700
    3    HB2  GLN 751           HB2      GLN 751  55.477 -14.182   3.071
    4    HB3  GLN 751           HB3      GLN 751  56.840 -13.300   3.752
    5    HG2  GLN 751           HG2      GLN 751  55.542 -12.617   1.135
    6    HG3  GLN 751           HG3      GLN 751  55.085 -11.874   2.652
    7   HE21  GLN 751          HE21      GLN 751  55.663  -9.880   1.850
    8   HE22  GLN 751          HE22      GLN 751  57.301  -9.356   1.710

  No H/Q in entry =           8
  In of MODEL   34
    1    H    GLY 752           H        GLY 752  57.095 -16.959   1.572
    2    HA3  GLY 752           HA2      GLY 752  58.839 -18.537   2.259
    3    HA2  GLY 752           HA3      GLY 752  58.952 -17.643   3.763

  No H/Q in entry =           3
  In of MODEL   34
    1    H    ARG 753           H        ARG 753  55.717 -17.890   2.996
    2    HA   ARG 753           HA       ARG 753  55.434 -19.965   5.011
    3    HB2  ARG 753           HB2      ARG 753  53.363 -18.292   3.631
    4    HB3  ARG 753           HB3      ARG 753  53.054 -19.388   4.971
    5    HG2  ARG 753           HG2      ARG 753  54.741 -16.896   5.040
    6    HG3  ARG 753           HG3      ARG 753  53.125 -17.070   5.719
    7    HD2  ARG 753           HD2      ARG 753  54.043 -18.930   7.169
    8    HD3  ARG 753           HD3      ARG 753  55.645 -18.459   6.604
    9    HE   ARG 753           HE       ARG 753  54.266 -16.233   7.631
   10   HH11  ARG 753          HH11      ARG 753  56.051 -19.126   8.701
   11   HH12  ARG 753          HH12      ARG 753  56.364 -18.496  10.253
   12   HH21  ARG 753          HH21      ARG 753  54.742 -15.419   9.790
   13   HH22  ARG 753          HH22      ARG 753  55.606 -16.395  10.884

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ASN 754           H        ASN 754  54.184 -21.844   4.724
    2    HA   ASN 754           HA       ASN 754  53.888 -22.641   1.914
    3    HB2  ASN 754           HB2      ASN 754  54.466 -24.395   4.311
    4    HB3  ASN 754           HB3      ASN 754  54.005 -25.010   2.734
    5   HD21  ASN 754          HD21      ASN 754  56.473 -23.713   4.660
    6   HD22  ASN 754          HD22      ASN 754  57.767 -23.914   3.533

  No H/Q in entry =           6
  In of MODEL   34
    1    H    TYR 755           H        TYR 755  51.961 -23.016   1.231
    2    HA   TYR 755           HA       TYR 755  49.945 -23.996   3.049
    3    HB2  TYR 755           HB2      TYR 755  49.684 -21.510   1.376
    4    HB3  TYR 755           HB3      TYR 755  48.297 -22.509   1.808
    5    HD1  TYR 755           HD1      TYR 755  51.149 -20.686   3.339
    6    HD2  TYR 755           HD2      TYR 755  47.177 -22.070   3.787
    7    HE1  TYR 755           HE1      TYR 755  50.990 -19.491   5.449
    8    HE2  TYR 755           HE2      TYR 755  46.998 -20.890   5.915
    9    HH   TYR 755           HH       TYR 755  48.716 -20.203   7.687

  No H/Q in entry =           9
  In of MODEL   34
    1    H    THR 756           H        THR 756  48.632 -25.332   2.157
    2    HA   THR 756           HA       THR 756  49.199 -26.180  -0.578
    3    HB   THR 756           HB       THR 756  47.854 -27.537   1.768
    4    HG1  THR 756           HG1      THR 756  49.857 -27.878   2.295
    5   HG23  THR 756          HG21      THR 756  47.940 -29.582   0.431
    6   HG22  THR 756          HG22      THR 756  48.608 -28.661  -0.931
    7   HG21  THR 756          HG23      THR 756  46.966 -28.336  -0.357

  No H/Q in entry =           7
  In of MODEL   34
    1    H    LEU 757           H        LEU 757  47.544 -26.089  -2.128
    2    HA   LEU 757           HA       LEU 757  45.192 -24.625  -1.357
    3    HB2  LEU 757           HB2      LEU 757  46.136 -25.635  -4.037
    4    HB3  LEU 757           HB3      LEU 757  44.518 -25.023  -3.813
    5    HG   LEU 757           HG       LEU 757  45.840 -23.315  -4.785
    6   HD11  LEU 757          HD11      LEU 757  44.187 -22.590  -3.200
    7   HD13  LEU 757          HD12      LEU 757  45.575 -21.510  -3.195
    8   HD12  LEU 757          HD13      LEU 757  45.365 -22.671  -1.888
    9   HD21  LEU 757          HD21      LEU 757  47.749 -23.634  -2.465
   10   HD23  LEU 757          HD22      LEU 757  47.825 -22.357  -3.680
   11   HD22  LEU 757          HD23      LEU 757  48.070 -24.037  -4.153

  No H/Q in entry =          11
  In of MODEL   34
    1    H    THR 758           H        THR 758  43.255 -25.324  -1.003
    2    HA   THR 758           HA       THR 758  42.714 -28.150  -1.443
    3    HB   THR 758           HB       THR 758  41.296 -27.912   0.707
    4    HG1  THR 758           HG1      THR 758  41.997 -25.464   0.586
    5   HG23  THR 758          HG21      THR 758  43.234 -28.461   2.134
    6   HG22  THR 758          HG22      THR 758  44.320 -27.838   0.893
    7   HG21  THR 758          HG23      THR 758  43.347 -29.273   0.573

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLY 759           H        GLY 759  40.142 -28.379  -1.006
    2    HA3  GLY 759           HA2      GLY 759  38.995 -26.873  -3.125
    3    HA2  GLY 759           HA3      GLY 759  38.177 -28.047  -2.094

  No H/Q in entry =           3
  In of MODEL   34
    1    H    ARG 760           H        ARG 760  37.038 -25.595  -2.917
    2    HA   ARG 760           HA       ARG 760  37.352 -23.667  -0.817
    3    HB2  ARG 760           HB2      ARG 760  35.747 -22.306  -1.872
    4    HB3  ARG 760           HB3      ARG 760  36.505 -23.156  -3.201
    5    HG2  ARG 760           HG2      ARG 760  33.847 -23.844  -1.963
    6    HG3  ARG 760           HG3      ARG 760  34.067 -22.955  -3.472
    7    HD2  ARG 760           HD2      ARG 760  35.219 -24.969  -4.383
    8    HD3  ARG 760           HD3      ARG 760  34.825 -25.780  -2.852
    9    HE   ARG 760           HE       ARG 760  32.451 -24.941  -3.656
   10   HH11  ARG 760          HH11      ARG 760  34.971 -26.768  -5.326
   11   HH12  ARG 760          HH12      ARG 760  33.906 -27.626  -6.345
   12   HH21  ARG 760          HH21      ARG 760  30.956 -26.092  -5.086
   13   HH22  ARG 760          HH22      ARG 760  31.553 -27.232  -6.183

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ASP 761           H        ASP 761  35.769 -26.566  -0.989
    2    HA   ASP 761           HA       ASP 761  33.700 -25.814   0.835
    3    HB2  ASP 761           HB2      ASP 761  33.182 -27.459  -0.897
    4    HB3  ASP 761           HB3      ASP 761  34.409 -28.543  -0.249

  No H/Q in entry =           4
  In of MODEL   34
    1    H    SER 762           H        SER 762  36.916 -26.699   1.029
    2    HA   SER 762           HA       SER 762  36.859 -28.454   3.234
    3    HB2  SER 762           HB2      SER 762  39.134 -26.831   2.105
    4    HB3  SER 762           HB3      SER 762  39.299 -28.186   3.234
    5    HG   SER 762           HG       SER 762  38.116 -29.412   1.590

  No H/Q in entry =           5
  In of MODEL   34
    1    H    CYS 763           H        CYS 763  36.557 -25.022   3.158
    2    HA   CYS 763           HA       CYS 763  36.335 -25.046   6.052
    3    HB2  CYS 763           HB2      CYS 763  37.706 -23.057   6.400
    4    HB3  CYS 763           HB3      CYS 763  38.692 -24.316   5.683

  No H/Q in entry =           4
  In of MODEL   34
    1    H    THR 764           H        THR 764  35.824 -22.393   6.482
    2    HA   THR 764           HA       THR 764  33.392 -22.216   4.914
    3    HB   THR 764           HB       THR 764  34.040 -20.660   7.399
    4    HG1  THR 764           HG1      THR 764  34.265 -22.684   8.102
    5   HG23  THR 764          HG21      THR 764  32.069 -19.989   6.075
    6   HG22  THR 764          HG22      THR 764  31.564 -20.688   7.616
    7   HG21  THR 764          HG23      THR 764  31.462 -21.641   6.142

  No H/Q in entry =           7
  In of MODEL   34
    1    H    LEU 765           H        LEU 765  33.556 -20.979   3.245
    2    HA   LEU 765           HA       LEU 765  35.322 -18.675   3.227
    3    HB2  LEU 765           HB2      LEU 765  34.887 -20.601   1.406
    4    HB3  LEU 765           HB3      LEU 765  33.570 -19.535   0.973
    5    HG   LEU 765           HG       LEU 765  35.186 -17.732   0.510
    6   HD12  LEU 765          HD11      LEU 765  37.600 -18.341   0.429
    7   HD11  LEU 765          HD12      LEU 765  37.185 -19.858   1.239
    8   HD13  LEU 765          HD13      LEU 765  36.925 -18.325   2.057
    9   HD22  LEU 765          HD21      LEU 765  34.473 -19.226  -1.280
   10   HD21  LEU 765          HD22      LEU 765  35.780 -20.340  -0.876
   11   HD23  LEU 765          HD23      LEU 765  36.153 -18.734  -1.498

  No H/Q in entry =          11
  In of MODEL   34
    1    HA   PRO 766           HA       PRO 766  31.812 -16.070   4.117
    2    HB2  PRO 766           HB2      PRO 766  32.403 -13.794   2.746
    3    HB3  PRO 766           HB3      PRO 766  33.217 -14.251   4.248
    4    HG2  PRO 766           HG2      PRO 766  34.045 -14.677   1.431
    5    HG3  PRO 766           HG3      PRO 766  35.023 -14.040   2.777
    6    HD2  PRO 766           HD2      PRO 766  35.275 -16.594   2.016
    7    HD3  PRO 766           HD3      PRO 766  35.283 -16.197   3.733

  No H/Q in entry =           7
  In of MODEL   34
    1    H    ALA 767           H        ALA 767  30.428 -14.348   2.792
    2    HA   ALA 767           HA       ALA 767  28.468 -14.325   1.712
    3    HB2  ALA 767           HB1      ALA 767  28.496 -14.588  -0.668
    4    HB1  ALA 767           HB2      ALA 767  30.040 -15.454  -0.585
    5    HB3  ALA 767           HB3      ALA 767  29.959 -13.732  -0.154

  No H/Q in entry =           5
  In of MODEL   34
    1    H    SER 768           H        SER 768  27.677 -15.666   3.056
    2    HA   SER 768           HA       SER 768  27.507 -18.423   2.180
    3    HB2  SER 768           HB2      SER 768  27.071 -17.248   4.909
    4    HB3  SER 768           HB3      SER 768  27.004 -18.960   4.483
    5    HG   SER 768           HG       SER 768  29.213 -18.439   3.537

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA 769           H        ALA 769  25.287 -16.100   3.880
    2    HA   ALA 769           HA       ALA 769  23.125 -17.368   2.365
    3    HB3  ALA 769           HB1      ALA 769  21.706 -17.277   4.347
    4    HB1  ALA 769           HB2      ALA 769  23.051 -16.638   5.291
    5    HB2  ALA 769           HB3      ALA 769  23.130 -18.276   4.638

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLU 770           H        GLU 770  21.978 -15.981   1.285
    2    HA   GLU 770           HA       GLU 770  21.196 -14.161   0.352
    3    HB2  GLU 770           HB2      GLU 770  20.769 -13.276   3.196
    4    HB3  GLU 770           HB3      GLU 770  19.949 -12.628   1.774
    5    HG2  GLU 770           HG2      GLU 770  19.818 -15.447   2.779
    6    HG3  GLU 770           HG3      GLU 770  18.527 -14.253   2.895

  No H/Q in entry =           6
  In of MODEL   34
    1    H    LYS 771           H        LYS 771  22.177 -12.789  -0.829
    2    HA   LYS 771           HA       LYS 771  24.371 -11.338   0.422
    3    HB2  LYS 771           HB2      LYS 771  24.543 -11.591  -2.554
    4    HB3  LYS 771           HB3      LYS 771  25.691 -11.680  -1.306
    5    HG2  LYS 771           HG2      LYS 771  23.815 -13.958  -1.641
    6    HG3  LYS 771           HG3      LYS 771  25.358 -13.854  -2.496
    7    HD2  LYS 771           HD2      LYS 771  26.585 -14.011  -0.546
    8    HD3  LYS 771           HD3      LYS 771  25.249 -13.417   0.438
    9    HE2  LYS 771           HE2      LYS 771  25.582 -15.741   0.879
   10    HE3  LYS 771           HE3      LYS 771  24.049 -15.445   0.071
   11    HZ2  LYS 771           HZ1      LYS 771  25.235 -17.430  -0.803
   12    HZ1  LYS 771           HZ2      LYS 771  26.503 -16.436  -1.328
   13    HZ3  LYS 771           HZ3      LYS 771  24.962 -16.270  -1.982

  No H/Q in entry =          13
  In of MODEL   34
    1    H    ALA 772           H        ALA 772  24.927  -9.406  -1.324
    2    HA   ALA 772           HA       ALA 772  22.857  -8.328  -2.914
    3    HB1  ALA 772           HB1      ALA 772  22.009  -7.617  -0.706
    4    HB2  ALA 772           HB2      ALA 772  22.580  -6.238  -1.644
    5    HB3  ALA 772           HB3      ALA 772  23.573  -6.888  -0.341

  No H/Q in entry =           5
  In of MODEL   34
    1    H    CYS 773           H        CYS 773  23.718  -5.942  -3.369
    2    HA   CYS 773           HA       CYS 773  26.629  -5.864  -3.378
    3    HB2  CYS 773           HB2      CYS 773  25.808  -6.309  -5.681
    4    HB3  CYS 773           HB3      CYS 773  24.720  -4.936  -5.564

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLY 774           H        GLY 774  27.249  -3.509  -3.750
    2    HA3  GLY 774           HA2      GLY 774  26.667  -1.202  -3.156
    3    HA2  GLY 774           HA3      GLY 774  25.709  -1.878  -1.825

  No H/Q in entry =           3
  In of MODEL   34
    1    H    ALA 775           H        ALA 775  27.517  -4.034  -1.569
    2    HA   ALA 775           HA       ALA 775  30.144  -3.107  -0.952
    3    HB3  ALA 775           HB1      ALA 775  28.288  -4.194   1.196
    4    HB1  ALA 775           HB2      ALA 775  28.974  -2.570   1.154
    5    HB2  ALA 775           HB3      ALA 775  30.027  -3.966   1.383

  No H/Q in entry =           5
  In of MODEL   34
    1    H    CYS 776           H        CYS 776  30.932  -4.616  -2.355
    2    HA   CYS 776           HA       CYS 776  31.120  -7.290  -1.592
    3    HB2  CYS 776           HB2      CYS 776  29.813  -8.405  -3.414
    4    HB3  CYS 776           HB3      CYS 776  28.738  -7.451  -2.471

  No H/Q in entry =           4
  In of MODEL   34
    1    HA   PRO 777           HA       PRO 777  34.890  -7.345  -3.963
    2    HB2  PRO 777           HB2      PRO 777  33.510  -9.522  -5.474
    3    HB3  PRO 777           HB3      PRO 777  35.195  -9.418  -4.949
    4    HG2  PRO 777           HG2      PRO 777  33.440 -10.775  -3.498
    5    HG3  PRO 777           HG3      PRO 777  34.679  -9.772  -2.726
    6    HD2  PRO 777           HD2      PRO 777  31.758  -9.325  -2.891
    7    HD3  PRO 777           HD3      PRO 777  32.935  -8.683  -1.741

  No H/Q in entry =           7
  In of MODEL   34
    1    H    LEU 778           H        LEU 778  35.848  -6.604  -5.593
    2    HA   LEU 778           HA       LEU 778  34.890  -4.663  -7.155
    3    HB2  LEU 778           HB2      LEU 778  37.103  -4.633  -8.311
    4    HB3  LEU 778           HB3      LEU 778  37.100  -4.568  -6.565
    5    HG   LEU 778           HG       LEU 778  38.999  -5.773  -7.307
    6   HD13  LEU 778          HD11      LEU 778  38.853  -7.938  -6.271
    7   HD12  LEU 778          HD12      LEU 778  37.100  -7.785  -6.198
    8   HD11  LEU 778          HD13      LEU 778  38.125  -6.662  -5.293
    9   HD21  LEU 778          HD21      LEU 778  37.180  -7.553  -8.897
   10   HD23  LEU 778          HD22      LEU 778  38.883  -7.891  -8.604
   11   HD22  LEU 778          HD23      LEU 778  38.428  -6.471  -9.525

  No H/Q in entry =          11
  In of MODEL   34
    1    H    TRP 779           H        TRP 779  34.873  -7.953  -8.295
    2    HA   TRP 779           HA       TRP 779  34.613  -7.069 -11.062
    3    HB2  TRP 779           HB2      TRP 779  34.382  -9.548 -11.553
    4    HB3  TRP 779           HB3      TRP 779  35.901  -9.043 -10.823
    5    HD1  TRP 779           HD1      TRP 779  32.605 -10.873  -9.834
    6    HE1  TRP 779           HE1      TRP 779  33.069 -12.267  -7.792
    7    HE3  TRP 779           HE3      TRP 779  37.395  -9.482  -9.045
    8    HZ2  TRP 779           HZ2      TRP 779  35.232 -12.717  -5.983
    9    HZ3  TRP 779           HZ3      TRP 779  38.621 -10.398  -7.127
   10    HH2  TRP 779           HH2      TRP 779  37.558 -12.011  -5.625

  No H/Q in entry =          10
  In of MODEL   34
    1    H    GLY 780           H        GLY 780  32.566  -6.975  -8.638
    2    HA3  GLY 780           HA2      GLY 780  30.242  -6.698  -8.742
    3    HA2  GLY 780           HA3      GLY 780  30.265  -7.436 -10.355

  No H/Q in entry =           3
  In of MODEL   34
    1    H    LYS 781           H        LYS 781  29.036  -8.043  -7.490
    2    HA   LYS 781           HA       LYS 781  29.628 -10.906  -7.491
    3    HB2  LYS 781           HB2      LYS 781  31.501  -9.742  -6.318
    4    HB3  LYS 781           HB3      LYS 781  30.348  -9.072  -5.194
    5    HG2  LYS 781           HG2      LYS 781  31.373 -10.888  -4.075
    6    HG3  LYS 781           HG3      LYS 781  29.795 -11.499  -4.588
    7    HD2  LYS 781           HD2      LYS 781  30.883 -12.565  -6.507
    8    HD3  LYS 781           HD3      LYS 781  32.439 -11.960  -5.943
    9    HE2  LYS 781           HE2      LYS 781  30.610 -13.788  -4.425
   10    HE3  LYS 781           HE3      LYS 781  32.019 -14.313  -5.340
   11    HZ3  LYS 781           HZ1      LYS 781  32.593 -14.174  -3.004
   12    HZ2  LYS 781           HZ2      LYS 781  32.048 -12.632  -2.831
   13    HZ1  LYS 781           HZ3      LYS 781  33.425 -12.944  -3.765

  No H/Q in entry =          13
  In of MODEL   34
    1    H    CYS 782           H        CYS 782  28.390 -11.912  -5.852
    2    HA   CYS 782           HA       CYS 782  26.098 -10.428  -4.813
    3    HB2  CYS 782           HB2      CYS 782  26.384 -13.429  -5.226
    4    HB3  CYS 782           HB3      CYS 782  24.908 -12.535  -4.866

  No H/Q in entry =           4
  In of MODEL   34
    1    H    ASP 783           H        ASP 783  27.009  -9.832  -2.789
    2    HA   ASP 783           HA       ASP 783  28.106 -11.974  -1.135
    3    HB2  ASP 783           HB2      ASP 783  29.868 -10.752  -2.718
    4    HB3  ASP 783           HB3      ASP 783  29.781  -9.533  -1.465

  No H/Q in entry =           4
  In of MODEL   34
    1    H    ALA 784           H        ALA 784  29.136 -10.560   0.791
    2    HA   ALA 784           HA       ALA 784  28.332  -9.804   2.781
    3    HB1  ALA 784           HB1      ALA 784  29.009  -7.533   3.012
    4    HB3  ALA 784           HB2      ALA 784  28.834  -7.259   1.278
    5    HB2  ALA 784           HB3      ALA 784  30.078  -8.357   1.878

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLU 785           H        GLU 785  26.917  -6.994   1.165
    2    HA   GLU 785           HA       GLU 785  24.252  -7.594   1.791
    3    HB2  GLU 785           HB2      GLU 785  23.994  -6.109   3.790
    4    HB3  GLU 785           HB3      GLU 785  24.931  -7.558   4.101
    5    HG2  GLU 785           HG2      GLU 785  26.999  -6.236   3.930
    6    HG3  GLU 785           HG3      GLU 785  26.033  -4.788   3.660

  No H/Q in entry =           6
  In of MODEL   34
    1    H    SER 786           H        SER 786  23.132  -5.288   2.296
    2    HA   SER 786           HA       SER 786  22.858  -3.125   1.942
    3    HB2  SER 786           HB2      SER 786  24.603  -3.182  -0.532
    4    HB3  SER 786           HB3      SER 786  23.809  -1.753   0.135
    5    HG   SER 786           HG       SER 786  25.822  -3.349   1.262

  No H/Q in entry =           5
  In of MODEL   34
    1    H    SER 787           H        SER 787  22.736  -3.652  -1.577
    2    HA   SER 787           HA       SER 787  19.842  -3.552  -1.082
    3    HB2  SER 787           HB2      SER 787  21.264  -2.591  -3.565
    4    HB3  SER 787           HB3      SER 787  19.560  -2.373  -3.174
    5    HG   SER 787           HG       SER 787  20.112  -1.051  -1.494

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LYS 788           H        LYS 788  21.387  -4.412  -4.183
    2    HA   LYS 788           HA       LYS 788  20.138  -7.071  -4.005
    3    HB2  LYS 788           HB2      LYS 788  19.435  -6.903  -6.289
    4    HB3  LYS 788           HB3      LYS 788  18.764  -5.507  -5.442
    5    HG2  LYS 788           HG2      LYS 788  20.545  -4.095  -6.362
    6    HG3  LYS 788           HG3      LYS 788  21.251  -5.492  -7.159
    7    HD2  LYS 788           HD2      LYS 788  19.128  -5.731  -8.457
    8    HD3  LYS 788           HD3      LYS 788  18.589  -4.207  -7.739
    9    HE2  LYS 788           HE2      LYS 788  20.557  -3.078  -8.670
   10    HE3  LYS 788           HE3      LYS 788  21.079  -4.594  -9.398
   11    HZ2  LYS 788           HZ1      LYS 788  18.625  -3.065 -10.046
   12    HZ1  LYS 788           HZ2      LYS 788  18.990  -4.581 -10.676
   13    HZ3  LYS 788           HZ3      LYS 788  19.976  -3.267 -11.030

  No H/Q in entry =          13
  In of MODEL   34
    1    H    CYS 789           H        CYS 789  21.201  -8.360  -5.949
    2    HA   CYS 789           HA       CYS 789  24.084  -7.954  -5.589
    3    HB2  CYS 789           HB2      CYS 789  22.563 -10.293  -6.748
    4    HB3  CYS 789           HB3      CYS 789  24.272 -10.250  -6.339

  No H/Q in entry =           4
  In of MODEL   34
    1    H    VAL 790           H        VAL 790  25.523  -8.052  -7.501
    2    HA   VAL 790           HA       VAL 790  24.384  -8.220 -10.042
    3    HB   VAL 790           HB       VAL 790  23.646  -5.932  -9.540
    4   HG12  VAL 790          HG11      VAL 790  25.244  -4.080  -9.310
    5   HG11  VAL 790          HG12      VAL 790  26.556  -5.257  -9.226
    6   HG13  VAL 790          HG13      VAL 790  25.323  -5.220  -7.965
    7   HG23  VAL 790          HG21      VAL 790  24.596  -4.782 -11.512
    8   HG22  VAL 790          HG22      VAL 790  24.112  -6.448 -11.838
    9   HG21  VAL 790          HG23      VAL 790  25.816  -6.054 -11.611

  No H/Q in entry =           9
  In of MODEL   34
    1    H    CYS 791           H        CYS 791  25.915  -8.600 -11.531
    2    HA   CYS 791           HA       CYS 791  28.681  -8.513 -10.587
    3    HB2  CYS 791           HB2      CYS 791  29.034 -10.636 -11.854
    4    HB3  CYS 791           HB3      CYS 791  27.935 -10.785 -10.487

  No H/Q in entry =           4
  In of MODEL   34
    1    H    ARG 792           H        ARG 792  30.276  -8.308 -12.332
    2    HA   ARG 792           HA       ARG 792  29.210  -6.863 -14.638
    3    HB2  ARG 792           HB2      ARG 792  32.062  -7.455 -13.820
    4    HB3  ARG 792           HB3      ARG 792  31.574  -6.445 -15.160
    5    HG2  ARG 792           HG2      ARG 792  30.657  -4.816 -13.602
    6    HG3  ARG 792           HG3      ARG 792  31.107  -5.858 -12.243
    7    HD2  ARG 792           HD2      ARG 792  33.454  -5.757 -12.959
    8    HD3  ARG 792           HD3      ARG 792  32.999  -4.690 -14.278
    9    HE   ARG 792           HE       ARG 792  32.104  -3.541 -11.939
   10   HH11  ARG 792          HH11      ARG 792  35.202  -4.303 -13.524
   11   HH12  ARG 792          HH12      ARG 792  36.100  -3.164 -12.635
   12   HH21  ARG 792          HH21      ARG 792  33.334  -1.942 -10.767
   13   HH22  ARG 792          HH22      ARG 792  34.997  -1.753 -11.042

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLU 793           H        GLU 793  30.365  -7.492 -16.730
    2    HA   GLU 793           HA       GLU 793  30.623 -10.380 -16.880
    3    HB2  GLU 793           HB2      GLU 793  30.538  -8.286 -19.074
    4    HB3  GLU 793           HB3      GLU 793  30.753 -10.007 -19.356
    5    HG2  GLU 793           HG2      GLU 793  28.548 -10.374 -18.242
    6    HG3  GLU 793           HG3      GLU 793  28.326  -8.622 -18.250

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ALA 794           H        ALA 794  32.544 -11.117 -18.221
    2    HA   ALA 794           HA       ALA 794  34.855 -10.274 -16.846
    3    HB1  ALA 794           HB1      ALA 794  34.633 -11.986 -19.309
    4    HB2  ALA 794           HB2      ALA 794  34.617 -12.544 -17.622
    5    HB3  ALA 794           HB3      ALA 794  36.057 -11.771 -18.295

  No H/Q in entry =           5
  In of MODEL   34
    1    H    SER 795           H        SER 795  33.359  -9.084 -19.663
    2    HA   SER 795           HA       SER 795  35.639  -8.107 -20.954
    3    HB2  SER 795           HB2      SER 795  33.797  -6.777 -22.165
    4    HB3  SER 795           HB3      SER 795  33.780  -8.537 -22.291
    5    HG   SER 795           HG       SER 795  32.011  -6.831 -21.066

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLU 796           H        GLU 796  33.945  -7.099 -18.180
    2    HA   GLU 796           HA       GLU 796  35.116  -4.413 -18.338
    3    HB2  GLU 796           HB2      GLU 796  32.577  -4.533 -18.268
    4    HB3  GLU 796           HB3      GLU 796  32.716  -5.276 -16.685
    5    HG2  GLU 796           HG2      GLU 796  33.763  -3.253 -15.809
    6    HG3  GLU 796           HG3      GLU 796  33.707  -2.524 -17.409

  No H/Q in entry =           6
  In of MODEL   34
    1    H    CYS 797           H        CYS 797  36.581  -6.598 -17.696
    2    HA   CYS 797           HA       CYS 797  36.879  -7.254 -14.995
    3    HB2  CYS 797           HB2      CYS 797  37.945  -8.542 -16.738
    4    HB3  CYS 797           HB3      CYS 797  38.903  -7.167 -17.283

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLU 798           H        GLU 798  38.867  -5.011 -16.855
    2    HA   GLU 798           HA       GLU 798  39.737  -3.009 -16.578
    3    HB2  GLU 798           HB2      GLU 798  37.762  -2.657 -14.331
    4    HB3  GLU 798           HB3      GLU 798  38.671  -1.381 -15.133
    5    HG2  GLU 798           HG2      GLU 798  36.595  -3.163 -16.402
    6    HG3  GLU 798           HG3      GLU 798  36.396  -1.466 -15.978

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU 799           H        GLU 799  39.401  -4.579 -13.536
    2    HA   GLU 799           HA       GLU 799  41.850  -3.336 -12.575
    3    HB2  GLU 799           HB2      GLU 799  39.898  -3.597 -11.017
    4    HB3  GLU 799           HB3      GLU 799  40.016  -5.334 -11.205
    5    HG2  GLU 799           HG2      GLU 799  41.004  -4.462  -9.095
    6    HG3  GLU 799           HG3      GLU 799  42.123  -5.395 -10.091

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLU 800           H        GLU 800  43.636  -4.675 -11.938
    2    HA   GLU 800           HA       GLU 800  44.017  -6.728 -13.908
    3    HB2  GLU 800           HB2      GLU 800  45.914  -5.676 -11.816
    4    HB3  GLU 800           HB3      GLU 800  46.335  -6.851 -13.052
    5    HG2  GLU 800           HG2      GLU 800  45.778  -5.150 -14.774
    6    HG3  GLU 800           HG3      GLU 800  45.513  -3.988 -13.476

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLY 801           H        GLY 801  43.830  -6.539 -10.350
    2    HA3  GLY 801           HA2      GLY 801  43.903  -8.148  -8.745
    3    HA2  GLY 801           HA3      GLY 801  42.966  -9.110  -9.891

  No H/Q in entry =           3
  In of MODEL   34
    1    H    PHE 802           H        PHE 802  44.048 -11.017  -9.345
    2    HA   PHE 802           HA       PHE 802  46.787 -11.165 -10.319
    3    HB2  PHE 802           HB2      PHE 802  45.104 -12.904  -8.567
    4    HB3  PHE 802           HB3      PHE 802  46.496 -13.572  -9.409
    5    HD1  PHE 802           HD1      PHE 802  47.988 -14.014  -7.734
    6    HD2  PHE 802           HD2      PHE 802  46.104 -10.218  -7.851
    7    HE1  PHE 802           HE1      PHE 802  49.460 -13.255  -6.011
    8    HE2  PHE 802           HE2      PHE 802  47.586  -9.418  -6.114
    9    HZ   PHE 802           HZ       PHE 802  49.299 -10.931  -5.158

  No H/Q in entry =           9
  In of MODEL   34
    1    H    SER 803           H        SER 803  47.233 -13.240 -11.474
    2    HA   SER 803           HA       SER 803  45.045 -13.880 -13.299
    3    HB2  SER 803           HB2      SER 803  48.030 -14.318 -13.630
    4    HB3  SER 803           HB3      SER 803  46.781 -14.593 -14.855
    5    HG   SER 803           HG       SER 803  46.342 -12.187 -14.214

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ILE 804           H        ILE 804  44.309 -15.969 -13.294
    2    HA   ILE 804           HA       ILE 804  45.665 -17.900 -11.552
    3    HB   ILE 804           HB       ILE 804  43.605 -18.593 -10.460
    4   HG12  ILE 804          HG12      ILE 804  41.954 -18.079 -12.275
    5   HG13  ILE 804          HG13      ILE 804  41.438 -17.499 -10.701
    6   HG21  ILE 804          HG21      ILE 804  44.810 -16.848  -9.320
    7   HG23  ILE 804          HG22      ILE 804  43.071 -16.635  -9.079
    8   HG22  ILE 804          HG23      ILE 804  43.925 -15.613 -10.217
    9   HD12  ILE 804          HD11      ILE 804  42.553 -15.831 -12.945
   10   HD11  ILE 804          HD12      ILE 804  42.129 -15.227 -11.347
   11   HD13  ILE 804          HD13      ILE 804  40.883 -15.898 -12.397

  No H/Q in entry =          11
  In of MODEL   34
    1    H    CYS 805           H        CYS 805  45.070 -20.132 -11.959
    2    HA   CYS 805           HA       CYS 805  44.269 -20.526 -14.733
    3    HB2  CYS 805           HB2      CYS 805  46.413 -21.562 -13.957
    4    HB3  CYS 805           HB3      CYS 805  45.440 -22.491 -12.797

  No H/Q in entry =           4
  In of MODEL   34
    1    H    VAL 806           H        VAL 806  42.244 -21.359 -15.090
    2    HA   VAL 806           HA       VAL 806  40.842 -22.664 -12.883
    3    HB   VAL 806           HB       VAL 806  40.022 -20.384 -12.896
    4   HG12  VAL 806          HG11      VAL 806  39.114 -19.313 -14.883
    5   HG11  VAL 806          HG12      VAL 806  39.651 -20.704 -15.836
    6   HG13  VAL 806          HG13      VAL 806  40.834 -19.683 -15.020
    7   HG22  VAL 806          HG21      VAL 806  37.688 -20.612 -13.489
    8   HG21  VAL 806          HG22      VAL 806  38.269 -22.067 -12.678
    9   HG23  VAL 806          HG23      VAL 806  38.052 -22.062 -14.427

  No H/Q in entry =           9
  In of MODEL   34
    1    H    GLU 807           H        GLU 807  39.686 -24.455 -13.414
    2    HA   GLU 807           HA       GLU 807  40.074 -25.524 -16.067
    3    HB2  GLU 807           HB2      GLU 807  40.463 -26.889 -14.017
    4    HB3  GLU 807           HB3      GLU 807  38.766 -26.719 -13.628
    5    HG2  GLU 807           HG2      GLU 807  38.156 -27.900 -15.656
    6    HG3  GLU 807           HG3      GLU 807  39.859 -28.050 -16.086

  No H/Q in entry =           6
  In of MODEL   34
    1    H    VAL 808           H        VAL 808  38.695 -25.117 -17.534
    2    HA   VAL 808           HA       VAL 808  35.845 -24.991 -16.896
    3    HB   VAL 808           HB       VAL 808  37.219 -23.252 -18.896
    4   HG13  VAL 808          HG11      VAL 808  35.158 -21.999 -18.975
    5   HG12  VAL 808          HG12      VAL 808  34.435 -23.150 -17.840
    6   HG11  VAL 808          HG13      VAL 808  34.973 -23.697 -19.434
    7   HG22  VAL 808          HG21      VAL 808  38.021 -22.513 -16.786
    8   HG21  VAL 808          HG22      VAL 808  36.394 -22.509 -16.128
    9   HG23  VAL 808          HG23      VAL 808  36.842 -21.341 -17.379

  No H/Q in entry =           9
  In of MODEL   34
    1    H    ASN 809           H        ASN 809  34.800 -26.366 -18.205
    2    HA   ASN 809           HA       ASN 809  34.248 -27.752 -19.904
    3    HB2  ASN 809           HB2      ASN 809  36.302 -26.146 -21.408
    4    HB3  ASN 809           HB3      ASN 809  35.423 -27.451 -22.160
    5   HD21  ASN 809          HD21      ASN 809  35.439 -24.231 -21.194
    6   HD22  ASN 809          HD22      ASN 809  33.849 -23.795 -21.705

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLY 810           H        GLY 810  36.565 -28.106 -18.050
    2    HA3  GLY 810           HA2      GLY 810  37.663 -30.146 -17.594
    3    HA2  GLY 810           HA3      GLY 810  37.581 -30.532 -19.317

  No H/Q in entry =           3
  In of MODEL   34
    1    H    LYS 811           H        LYS 811  38.526 -27.636 -19.736
    2    HA   LYS 811           HA       LYS 811  41.364 -28.345 -19.629
    3    HB2  LYS 811           HB2      LYS 811  39.903 -26.287 -21.286
    4    HB3  LYS 811           HB3      LYS 811  41.634 -26.587 -21.339
    5    HG2  LYS 811           HG2      LYS 811  41.272 -28.831 -22.135
    6    HG3  LYS 811           HG3      LYS 811  39.530 -28.631 -21.971
    7    HD2  LYS 811           HD2      LYS 811  40.202 -28.403 -24.291
    8    HD3  LYS 811           HD3      LYS 811  39.569 -26.884 -23.668
    9    HE2  LYS 811           HE2      LYS 811  41.797 -26.009 -23.405
   10    HE3  LYS 811           HE3      LYS 811  42.505 -27.548 -23.858
   11    HZ2  LYS 811           HZ1      LYS 811  40.854 -25.825 -25.652
   12    HZ1  LYS 811           HZ2      LYS 811  41.515 -27.314 -26.061
   13    HZ3  LYS 811           HZ3      LYS 811  42.528 -26.032 -25.749

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLU 812           H        GLU 812  42.890 -26.849 -18.870
    2    HA   GLU 812           HA       GLU 812  41.702 -24.977 -16.962
    3    HB2  GLU 812           HB2      GLU 812  44.388 -26.333 -16.961
    4    HB3  GLU 812           HB3      GLU 812  43.994 -25.001 -15.884
    5    HG2  GLU 812           HG2      GLU 812  42.158 -26.307 -14.960
    6    HG3  GLU 812           HG3      GLU 812  42.587 -27.664 -16.002

  No H/Q in entry =           6
  In of MODEL   34
    1    H    GLN 813           H        GLN 813  41.410 -23.123 -17.846
    2    HA   GLN 813           HA       GLN 813  43.527 -21.999 -19.525
    3    HB2  GLN 813           HB2      GLN 813  41.312 -22.084 -20.547
    4    HB3  GLN 813           HB3      GLN 813  40.624 -21.218 -19.179
    5    HG2  GLN 813           HG2      GLN 813  41.936 -19.278 -19.727
    6    HG3  GLN 813           HG3      GLN 813  42.669 -20.108 -21.096
    7   HE21  GLN 813          HE21      GLN 813  39.306 -20.427 -20.220
    8   HE22  GLN 813          HE22      GLN 813  38.666 -19.576 -21.572

  No H/Q in entry =           8
  In of MODEL   34
    1    H    THR 814           H        THR 814  44.263 -19.852 -19.094
    2    HA   THR 814           HA       THR 814  44.074 -19.162 -16.275
    3    HB   THR 814           HB       THR 814  45.973 -18.364 -18.426
    4    HG1  THR 814           HG1      THR 814  45.662 -20.600 -17.452
    5   HG22  THR 814          HG21      THR 814  47.404 -17.586 -16.544
    6   HG21  THR 814          HG22      THR 814  46.114 -17.998 -15.412
    7   HG23  THR 814          HG23      THR 814  45.872 -16.709 -16.593

  No H/Q in entry =           7
  In of MODEL   34
    1    H    MET 815           H        MET 815  43.090 -17.388 -15.648
    2    HA   MET 815           HA       MET 815  42.311 -15.405 -17.683
    3    HB2  MET 815           HB2      MET 815  40.588 -16.214 -15.346
    4    HB3  MET 815           HB3      MET 815  40.146 -15.191 -16.703
    5    HG2  MET 815           HG2      MET 815  40.540 -17.281 -18.150
    6    HG3  MET 815           HG3      MET 815  40.593 -18.103 -16.601
    7    HE1  MET 815           HE1      MET 815  38.842 -19.716 -17.370
    8    HE3  MET 815           HE2      MET 815  38.585 -18.909 -18.908
    9    HE2  MET 815           HE3      MET 815  37.200 -19.323 -17.877

  No H/Q in entry =           9
  In of MODEL   34
    1    H    SER 816           H        SER 816  41.686 -13.352 -16.633
    2    HA   SER 816           HA       SER 816  43.457 -12.673 -14.470
    3    HB2  SER 816           HB2      SER 816  41.400 -11.017 -15.969
    4    HB3  SER 816           HB3      SER 816  42.615 -10.380 -14.855
    5    HG   SER 816           HG       SER 816  42.943 -11.462 -17.433

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLU 817           H        GLU 817  42.655 -11.743 -12.479
    2    HA   GLU 817           HA       GLU 817  41.031 -13.278 -10.957
    3    HB2  GLU 817           HB2      GLU 817  42.578 -11.317 -10.359
    4    HB3  GLU 817           HB3      GLU 817  41.139 -10.321 -10.537
    5    HG2  GLU 817           HG2      GLU 817  40.768 -10.753  -8.375
    6    HG3  GLU 817           HG3      GLU 817  40.292 -12.365  -8.948

  No H/Q in entry =           6
  In of MODEL   34
    1    H    CYS 818           H        CYS 818  40.052 -10.108 -12.247
    2    HA   CYS 818           HA       CYS 818  37.415 -10.212 -11.357
    3    HB2  CYS 818           HB2      CYS 818  38.352  -8.662 -13.751
    4    HB3  CYS 818           HB3      CYS 818  37.069  -8.246 -12.617

  No H/Q in entry =           4
  In of MODEL   34
    1    H    GLU 819           H        GLU 819  38.890 -11.372 -14.284
    2    HA   GLU 819           HA       GLU 819  36.513 -11.806 -15.740
    3    HB2  GLU 819           HB2      GLU 819  38.615 -11.704 -16.925
    4    HB3  GLU 819           HB3      GLU 819  39.260 -13.027 -15.968
    5    HG2  GLU 819           HG2      GLU 819  37.954 -14.610 -17.076
    6    HG3  GLU 819           HG3      GLU 819  36.920 -13.404 -17.818

  No H/Q in entry =           6
  In of MODEL   34
    1    H    ALA 820           H        ALA 820  38.636 -14.217 -14.176
    2    HA   ALA 820           HA       ALA 820  36.961 -16.376 -14.450
    3    HB2  ALA 820           HB1      ALA 820  38.239 -17.439 -12.661
    4    HB3  ALA 820           HB2      ALA 820  38.882 -15.870 -12.194
    5    HB1  ALA 820           HB3      ALA 820  39.292 -16.559 -13.769

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLY 821           H        GLY 821  37.177 -13.957 -11.889
    2    HA3  GLY 821           HA2      GLY 821  35.403 -15.100 -10.029
    3    HA2  GLY 821           HA3      GLY 821  35.876 -13.406 -10.116

  No H/Q in entry =           3
  In of MODEL   34
    1    H    ALA 822           H        ALA 822  34.874 -12.686 -12.587
    2    HA   ALA 822           HA       ALA 822  32.172 -12.289 -11.894
    3    HB3  ALA 822           HB1      ALA 822  31.989 -11.016 -13.932
    4    HB2  ALA 822           HB2      ALA 822  33.512 -11.698 -14.526
    5    HB1  ALA 822           HB3      ALA 822  33.511 -10.637 -13.116

  No H/Q in entry =           5
  In of MODEL   34
    1    H    LEU 823           H        LEU 823  33.805 -14.516 -14.049
    2    HA   LEU 823           HA       LEU 823  31.486 -15.493 -15.273
    3    HB2  LEU 823           HB2      LEU 823  34.170 -16.754 -14.829
    4    HB3  LEU 823           HB3      LEU 823  32.839 -17.776 -15.317
    5    HG   LEU 823           HG       LEU 823  34.054 -17.284 -17.269
    6   HD11  LEU 823          HD11      LEU 823  31.618 -17.157 -17.546
    7   HD13  LEU 823          HD12      LEU 823  32.512 -16.207 -18.710
    8   HD12  LEU 823          HD13      LEU 823  31.731 -15.403 -17.351
    9   HD22  LEU 823          HD21      LEU 823  35.349 -15.367 -16.523
   10   HD21  LEU 823          HD22      LEU 823  33.902 -14.365 -16.566
   11   HD23  LEU 823          HD23      LEU 823  34.561 -15.023 -18.062

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ARG 824           H        ARG 824  32.960 -16.348 -12.181
    2    HA   ARG 824           HA       ARG 824  31.137 -18.468 -11.585
    3    HB2  ARG 824           HB2      ARG 824  32.586 -16.706  -9.581
    4    HB3  ARG 824           HB3      ARG 824  31.807 -18.236  -9.223
    5    HG2  ARG 824           HG2      ARG 824  33.442 -19.323 -10.771
    6    HG3  ARG 824           HG3      ARG 824  34.305 -17.777 -10.848
    7    HD2  ARG 824           HD2      ARG 824  33.791 -19.538  -8.471
    8    HD3  ARG 824           HD3      ARG 824  35.330 -19.244  -9.251
    9    HE   ARG 824           HE       ARG 824  34.450 -16.779  -8.470
   10   HH11  ARG 824          HH11      ARG 824  35.117 -19.818  -6.761
   11   HH12  ARG 824          HH12      ARG 824  35.575 -19.082  -5.315
   12   HH21  ARG 824          HH21      ARG 824  35.062 -15.763  -6.508
   13   HH22  ARG 824          HH22      ARG 824  35.557 -16.664  -5.161

  No H/Q in entry =          13
  In of MODEL   34
    1    H    CYS 825           H        CYS 825  31.131 -15.054 -10.989
    2    HA   CYS 825           HA       CYS 825  28.858 -14.942  -9.367
    3    HB2  CYS 825           HB2      CYS 825  30.183 -12.883 -11.083
    4    HB3  CYS 825           HB3      CYS 825  28.880 -12.520  -9.959

  No H/Q in entry =           4
  In of MODEL   34
    1    H    ARG 826           H        ARG 826  29.213 -14.887 -12.865
    2    HA   ARG 826           HA       ARG 826  26.444 -14.147 -13.198
    3    HB2  ARG 826           HB2      ARG 826  26.821 -14.333 -15.576
    4    HB3  ARG 826           HB3      ARG 826  28.038 -13.298 -14.813
    5    HG2  ARG 826           HG2      ARG 826  29.624 -15.092 -14.969
    6    HG3  ARG 826           HG3      ARG 826  28.396 -16.160 -15.661
    7    HD2  ARG 826           HD2      ARG 826  29.460 -13.606 -16.872
    8    HD3  ARG 826           HD3      ARG 826  29.742 -15.254 -17.447
    9    HE   ARG 826           HE       ARG 826  27.127 -15.174 -17.482
   10   HH11  ARG 826          HH11      ARG 826  29.512 -12.906 -18.827
   11   HH12  ARG 826          HH12      ARG 826  28.438 -12.201 -19.937
   12   HH21  ARG 826          HH21      ARG 826  25.654 -14.240 -19.048
   13   HH22  ARG 826          HH22      ARG 826  26.189 -13.018 -20.096

  No H/Q in entry =          13
  In of MODEL   34
    1    H    GLY 827           H        GLY 827  27.933 -17.022 -12.513
    2    HA3  GLY 827           HA2      GLY 827  26.490 -18.928 -12.180
    3    HA2  GLY 827           HA3      GLY 827  25.564 -18.341 -13.563

  No H/Q in entry =           3
  In of MODEL   34
    1    H    GLN 828           H        GLN 828  28.550 -17.967 -14.616
    2    HA   GLN 828           HA       GLN 828  28.475 -20.200 -16.373
    3    HB2  GLN 828           HB2      GLN 828  29.661 -18.133 -16.973
    4    HB3  GLN 828           HB3      GLN 828  30.786 -18.377 -15.649
    5    HG2  GLN 828           HG2      GLN 828  32.034 -19.126 -17.459
    6    HG3  GLN 828           HG3      GLN 828  31.326 -20.607 -16.850
    7   HE21  GLN 828          HE21      GLN 828  28.666 -19.725 -18.099
    8   HE22  GLN 828          HE22      GLN 828  28.893 -20.164 -19.746

  No H/Q in entry =           8
  In of MODEL   34
    1    H    SER 829           H        SER 829  29.617 -22.139 -16.310
    2    HA   SER 829           HA       SER 829  30.622 -22.845 -13.699
    3    HB2  SER 829           HB2      SER 829  30.049 -24.573 -16.106
    4    HB3  SER 829           HB3      SER 829  30.469 -25.153 -14.490
    5    HG   SER 829           HG       SER 829  28.322 -23.390 -14.881

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ILE 830           H        ILE 830  32.564 -22.415 -13.338
    2    HA   ILE 830           HA       ILE 830  34.789 -23.268 -15.052
    3    HB   ILE 830           HB       ILE 830  36.020 -21.201 -14.611
    4   HG12  ILE 830          HG12      ILE 830  34.918 -20.648 -12.392
    5   HG13  ILE 830          HG13      ILE 830  35.210 -19.257 -13.394
    6   HG23  ILE 830          HG21      ILE 830  34.719 -21.148 -16.624
    7   HG22  ILE 830          HG22      ILE 830  34.771 -19.527 -15.920
    8   HG21  ILE 830          HG23      ILE 830  33.325 -20.529 -15.741
    9   HD12  ILE 830          HD11      ILE 830  32.605 -20.623 -12.835
   10   HD11  ILE 830          HD12      ILE 830  32.823 -19.560 -14.205
   11   HD13  ILE 830          HD13      ILE 830  33.047 -18.919 -12.588

  No H/Q in entry =          11
  In of MODEL   34
    1    H    SER 831           H        SER 831  36.334 -24.148 -13.719
    2    HA   SER 831           HA       SER 831  35.709 -24.130 -10.868
    3    HB2  SER 831           HB2      SER 831  36.916 -26.221 -12.637
    4    HB3  SER 831           HB3      SER 831  36.811 -26.351 -10.888
    5    HG   SER 831           HG       SER 831  35.094 -27.265 -12.384

  No H/Q in entry =           5
  In of MODEL   34
    1    H    VAL 832           H        VAL 832  37.107 -22.638 -10.023
    2    HA   VAL 832           HA       VAL 832  39.730 -22.214 -11.021
    3    HB   VAL 832           HB       VAL 832  38.585 -21.522  -8.304
    4   HG13  VAL 832          HG11      VAL 832  40.401 -19.842  -8.173
    5   HG12  VAL 832          HG12      VAL 832  41.031 -20.416  -9.714
    6   HG11  VAL 832          HG13      VAL 832  41.049 -21.478  -8.306
    7   HG22  VAL 832          HG21      VAL 832  38.244 -19.262  -9.231
    8   HG21  VAL 832          HG22      VAL 832  37.314 -20.487 -10.098
    9   HG23  VAL 832          HG23      VAL 832  38.798 -19.843 -10.802

  No H/Q in entry =           9
  In of MODEL   34
    1    H    THR 833           H        THR 833  41.229 -23.753 -10.987
    2    HA   THR 833           HA       THR 833  41.140 -25.747  -8.897
    3    HB   THR 833           HB       THR 833  42.770 -26.819 -10.549
    4    HG1  THR 833           HG1      THR 833  42.958 -25.840 -12.514
    5   HG23  THR 833          HG21      THR 833  40.911 -27.612 -11.946
    6   HG22  THR 833          HG22      THR 833  39.940 -26.243 -11.400
    7   HG21  THR 833          HG23      THR 833  40.405 -27.505 -10.252

  No H/Q in entry =           7
  In of MODEL   34
    1    H    SER 834           H        SER 834  43.075 -23.169 -10.203
    2    HA   SER 834           HA       SER 834  45.113 -23.689  -8.182
    3    HB2  SER 834           HB2      SER 834  45.733 -23.027 -11.050
    4    HB3  SER 834           HB3      SER 834  46.878 -23.429  -9.780
    5    HG   SER 834           HG       SER 834  44.922 -25.133 -10.913

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ILE 835           H        ILE 835  45.880 -21.814  -7.325
    2    HA   ILE 835           HA       ILE 835  44.617 -19.392  -8.283
    3    HB   ILE 835           HB       ILE 835  45.578 -18.302  -6.230
    4   HG12  ILE 835          HG12      ILE 835  46.189 -19.925  -4.361
    5   HG13  ILE 835          HG13      ILE 835  46.466 -21.124  -5.612
    6   HG23  ILE 835          HG21      ILE 835  44.032 -19.317  -4.706
    7   HG22  ILE 835          HG22      ILE 835  43.854 -20.695  -5.794
    8   HG21  ILE 835          HG23      ILE 835  43.321 -19.087  -6.307
    9   HD13  ILE 835          HD11      ILE 835  48.194 -19.713  -6.564
   10   HD12  ILE 835          HD12      ILE 835  48.526 -20.068  -4.855
   11   HD11  ILE 835          HD13      ILE 835  47.849 -18.500  -5.336

  No H/Q in entry =          11
  In of MODEL   34
    1    H    ARG 836           H        ARG 836  47.290 -21.025  -8.891
    2    HA   ARG 836           HA       ARG 836  48.989 -18.736  -9.444
    3    HB2  ARG 836           HB2      ARG 836  49.406 -21.670 -10.019
    4    HB3  ARG 836           HB3      ARG 836  50.606 -20.404 -10.215
    5    HG2  ARG 836           HG2      ARG 836  50.576 -20.019  -7.796
    6    HG3  ARG 836           HG3      ARG 836  49.393 -21.316  -7.617
    7    HD2  ARG 836           HD2      ARG 836  51.000 -22.825  -8.739
    8    HD3  ARG 836           HD3      ARG 836  52.199 -21.541  -8.669
    9    HE   ARG 836           HE       ARG 836  51.053 -22.128  -6.111
   10   HH11  ARG 836          HH11      ARG 836  53.617 -23.079  -8.388
   11   HH12  ARG 836          HH12      ARG 836  54.543 -23.856  -7.218
   12   HH21  ARG 836          HH21      ARG 836  52.348 -23.266  -4.500
   13   HH22  ARG 836          HH22      ARG 836  53.813 -23.982  -4.957

  No H/Q in entry =          13
  In of MODEL   34
    1    HA   PRO 837           HA       PRO 837  47.304 -18.618 -13.563
    2    HB2  PRO 837           HB2      PRO 837  49.259 -17.210 -14.816
    3    HB3  PRO 837           HB3      PRO 837  48.092 -16.461 -13.722
    4    HG2  PRO 837           HG2      PRO 837  50.931 -17.231 -13.226
    5    HG3  PRO 837           HG3      PRO 837  50.037 -15.816 -12.649
    6    HD2  PRO 837           HD2      PRO 837  50.538 -18.048 -11.135
    7    HD3  PRO 837           HD3      PRO 837  49.173 -16.948 -10.858

  No H/Q in entry =           7
  In of MODEL   34
    1    H    CYS 838           H        CYS 838  47.498 -19.901 -15.436
    2    HA   CYS 838           HA       CYS 838  49.913 -21.259 -15.409
    3    HB2  CYS 838           HB2      CYS 838  47.262 -22.208 -16.367
    4    HB3  CYS 838           HB3      CYS 838  48.717 -22.987 -16.992

  No H/Q in entry =           4
  In of MODEL   34
    1    H    ALA 839           H        ALA 839  50.126 -22.172 -18.151
    2    HA   ALA 839           HA       ALA 839  50.496 -19.594 -19.467
    3    HB1  ALA 839           HB1      ALA 839  51.587 -22.298 -20.209
    4    HB2  ALA 839           HB2      ALA 839  52.411 -21.107 -19.213
    5    HB3  ALA 839           HB3      ALA 839  52.051 -20.741 -20.903

  No H/Q in entry =           5
  In of MODEL   34
    1    H    ALA 840           H        ALA 840  48.099 -21.575 -19.254
    2    HA   ALA 840           HA       ALA 840  47.547 -21.970 -22.049
    3    HB2  ALA 840           HB1      ALA 840  45.796 -22.472 -19.664
    4    HB3  ALA 840           HB2      ALA 840  46.810 -23.670 -20.481
    5    HB1  ALA 840           HB3      ALA 840  45.437 -22.938 -21.322

  No H/Q in entry =           5
  In of MODEL   34
    1    H    GLU 841           H        GLU 841  47.615 -19.931 -22.749
    2    HA   GLU 841           HA       GLU 841  45.382 -18.157 -22.023
    3    HB2  GLU 841           HB2      GLU 841  47.929 -17.555 -23.532
    4    HB3  GLU 841           HB3      GLU 841  46.728 -16.379 -23.024
    5    HG2  GLU 841           HG2      GLU 841  47.256 -16.847 -20.690
    6    HG3  GLU 841           HG3      GLU 841  48.456 -18.036 -21.204

  No H/Q in entry =           6
  In of MODEL   34
    1    H    THR 842           H        THR 842  45.312 -20.523 -23.671
    2    HA   THR 842           HA       THR 842  44.398 -21.336 -25.518
    3    HB   THR 842           HB       THR 842  44.128 -18.574 -26.663
    4    HG1  THR 842           HG1      THR 842  43.164 -18.617 -24.597
    5   HG23  THR 842          HG21      THR 842  42.168 -19.567 -27.820
    6   HG22  THR 842          HG22      THR 842  42.499 -21.102 -27.022
    7   HG21  THR 842          HG23      THR 842  43.655 -20.445 -28.180

  No H/Q in entry =           7
  In of MODEL   34
    1    H    GLN 843           H        GLN 843  46.087 -22.325 -26.144
    2    HA   GLN 843           HA       GLN 843  47.634 -21.272 -28.355
    3    HB2  GLN 843           HB2      GLN 843  48.862 -22.649 -25.935
    4    HB3  GLN 843           HB3      GLN 843  49.712 -22.347 -27.439
    5    HG2  GLN 843           HG2      GLN 843  49.364 -19.907 -27.052
    6    HG3  GLN 843           HG3      GLN 843  48.702 -20.305 -25.467
    7   HE21  GLN 843          HE21      GLN 843  50.118 -21.067 -23.831
    8   HE22  GLN 843          HE22      GLN 843  51.817 -20.929 -24.011

  No H/Q in entry =           8
  In of MODEL   35
    1    H1   GLY 689           H2       GLY 689  59.664   8.357 -12.499
    2    H2   GLY 689           H1       GLY 689  60.967   7.550 -11.783
    3    H3   GLY 689           H3       GLY 689  59.852   8.381 -10.824
    4    HA2  GLY 689           HA2      GLY 689  61.732   9.566 -12.779
    5    HA3  GLY 689           HA3      GLY 689  61.865   9.658 -11.027

  No H/Q in entry =           5
  In of MODEL   35
    1    H    SER 690           H        SER 690  59.707  10.478  -9.973
    2    HA   SER 690           HA       SER 690  58.452  12.445 -11.670
    3    HB2  SER 690           HB2      SER 690  57.694  11.417  -8.940
    4    HB3  SER 690           HB3      SER 690  56.730  12.509  -9.938
    5    HG   SER 690           HG       SER 690  57.285  10.532 -11.509

  No H/Q in entry =           5
  In of MODEL   35
    1    H    HIS 691           H        HIS 691  59.625  14.211 -11.729
    2    HA   HIS 691           HA       HIS 691  59.861  15.769  -9.268
    3    HB2  HIS 691           HB2      HIS 691  62.079  15.405 -11.297
    4    HB3  HIS 691           HB3      HIS 691  62.012  16.800 -10.245
    5    HD1  HIS 691           HD1      HIS 691  62.814  16.491  -7.835
    6    HD2  HIS 691           HD2      HIS 691  62.780  12.969 -10.026
    7    HE1  HIS 691           HE1      HIS 691  64.152  14.863  -6.503
    8    HE2  HIS 691           HE2      HIS 691  64.017  12.720  -7.755

  No H/Q in entry =           8
  In of MODEL   35
    1    H    MET 692           H        MET 692  60.717  16.088 -12.672
    2    HA   MET 692           HA       MET 692  59.147  18.538 -12.856
    3    HB2  MET 692           HB2      MET 692  61.390  18.467 -13.918
    4    HB3  MET 692           HB3      MET 692  60.867  17.116 -14.913
    5    HG2  MET 692           HG2      MET 692  59.165  18.577 -15.946
    6    HG3  MET 692           HG3      MET 692  59.784  19.924 -14.997
    7    HE2  MET 692           HE1      MET 692  60.134  21.371 -17.179
    8    HE1  MET 692           HE2      MET 692  59.459  20.043 -18.117
    9    HE3  MET 692           HE3      MET 692  60.983  20.785 -18.611

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ASN 693           H        ASN 693  59.391  15.314 -14.174
    2    HA   ASN 693           HA       ASN 693  56.711  15.508 -15.335
    3    HB2  ASN 693           HB2      ASN 693  58.412  14.765 -16.892
    4    HB3  ASN 693           HB3      ASN 693  59.028  13.607 -15.723
    5   HD21  ASN 693          HD21      ASN 693  58.790  11.933 -17.096
    6   HD22  ASN 693          HD22      ASN 693  57.268  11.231 -17.513

  No H/Q in entry =           6
  In of MODEL   35
    1    HA   PRO 694           HA       PRO 694  55.784  12.808 -11.832
    2    HB2  PRO 694           HB2      PRO 694  53.174  13.258 -11.700
    3    HB3  PRO 694           HB3      PRO 694  54.328  14.523 -11.261
    4    HG2  PRO 694           HG2      PRO 694  52.702  14.227 -13.744
    5    HG3  PRO 694           HG3      PRO 694  53.166  15.701 -12.876
    6    HD2  PRO 694           HD2      PRO 694  54.424  14.639 -15.165
    7    HD3  PRO 694           HD3      PRO 694  55.056  15.914 -14.100

  No H/Q in entry =           7
  In of MODEL   35
    1    H    LEU 695           H        LEU 695  55.116  12.373 -15.058
    2    HA   LEU 695           HA       LEU 695  53.360  10.068 -14.651
    3    HB2  LEU 695           HB2      LEU 695  54.116  11.534 -17.179
    4    HB3  LEU 695           HB3      LEU 695  52.971  10.211 -17.078
    5    HG   LEU 695           HG       LEU 695  52.622  12.929 -15.798
    6   HD12  LEU 695          HD11      LEU 695  51.245  11.720 -18.188
    7   HD11  LEU 695          HD12      LEU 695  52.451  13.002 -18.231
    8   HD13  LEU 695          HD13      LEU 695  50.889  13.285 -17.461
    9   HD23  LEU 695          HD21      LEU 695  50.328  12.172 -15.346
   10   HD22  LEU 695          HD22      LEU 695  51.521  11.189 -14.500
   11   HD21  LEU 695          HD23      LEU 695  50.741  10.569 -15.956

  No H/Q in entry =          11
  In of MODEL   35
    1    H    THR 696           H        THR 696  53.868   8.231 -16.263
    2    HA   THR 696           HA       THR 696  56.768   7.874 -16.410
    3    HB   THR 696           HB       THR 696  54.857   5.698 -15.508
    4    HG1  THR 696           HG1      THR 696  54.898   6.962 -13.817
    5   HG22  THR 696          HG21      THR 696  57.878   5.889 -15.429
    6   HG21  THR 696          HG22      THR 696  56.953   4.925 -16.575
    7   HG23  THR 696          HG23      THR 696  56.913   4.528 -14.855

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLN 697           H        GLN 697  53.593   6.724 -17.596
    2    HA   GLN 697           HA       GLN 697  52.879   5.853 -19.525
    3    HB2  GLN 697           HB2      GLN 697  55.234   7.414 -20.560
    4    HB3  GLN 697           HB3      GLN 697  54.362   6.352 -21.648
    5    HG2  GLN 697           HG2      GLN 697  53.504   8.555 -21.922
    6    HG3  GLN 697           HG3      GLN 697  52.283   7.600 -21.101
    7   HE21  GLN 697          HE21      GLN 697  51.275   9.363 -20.288
    8   HE22  GLN 697          HE22      GLN 697  51.911  10.338 -19.027

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ALA 698           H        ALA 698  54.373   4.170 -17.858
    2    HA   ALA 698           HA       ALA 698  55.260   2.226 -19.833
    3    HB2  ALA 698           HB1      ALA 698  57.235   1.661 -18.531
    4    HB3  ALA 698           HB2      ALA 698  56.853   2.932 -17.374
    5    HB1  ALA 698           HB3      ALA 698  57.296   3.354 -19.029

  No H/Q in entry =           5
  In of MODEL   35
    1    H    VAL 699           H        VAL 699  55.028   0.107 -19.141
    2    HA   VAL 699           HA       VAL 699  53.218  -0.266 -16.904
    3    HB   VAL 699           HB       VAL 699  54.313  -2.284 -18.904
    4   HG11  VAL 699          HG11      VAL 699  53.652  -3.354 -16.810
    5   HG13  VAL 699          HG12      VAL 699  52.527  -3.774 -18.104
    6   HG12  VAL 699          HG13      VAL 699  52.073  -2.573 -16.894
    7   HG23  VAL 699          HG21      VAL 699  51.620  -0.930 -18.795
    8   HG22  VAL 699          HG22      VAL 699  52.082  -2.195 -19.934
    9   HG21  VAL 699          HG23      VAL 699  52.886  -0.626 -19.981

  No H/Q in entry =           9
  In of MODEL   35
    1    HA   PRO 700           HA       PRO 700  56.915  -1.268 -14.529
    2    HB2  PRO 700           HB2      PRO 700  55.170  -1.814 -12.271
    3    HB3  PRO 700           HB3      PRO 700  56.322  -0.493 -12.481
    4    HG2  PRO 700           HG2      PRO 700  53.616  -0.130 -12.454
    5    HG3  PRO 700           HG3      PRO 700  54.736   0.928 -13.328
    6    HD2  PRO 700           HD2      PRO 700  52.999  -1.272 -14.372
    7    HD3  PRO 700           HD3      PRO 700  53.388   0.314 -15.078

  No H/Q in entry =           7
  In of MODEL   35
    1    H    LYS 701           H        LYS 701  57.927  -3.102 -14.223
    2    HA   LYS 701           HA       LYS 701  56.377  -5.503 -14.615
    3    HB2  LYS 701           HB2      LYS 701  59.377  -5.141 -14.717
    4    HB3  LYS 701           HB3      LYS 701  58.563  -6.683 -14.907
    5    HG2  LYS 701           HG2      LYS 701  58.990  -6.021 -17.109
    6    HG3  LYS 701           HG3      LYS 701  57.312  -5.548 -16.832
    7    HD2  LYS 701           HD2      LYS 701  58.006  -3.260 -16.411
    8    HD3  LYS 701           HD3      LYS 701  59.691  -3.711 -16.671
    9    HE2  LYS 701           HE2      LYS 701  57.460  -3.850 -18.699
   10    HE3  LYS 701           HE3      LYS 701  58.768  -2.671 -18.663
   11    HZ1  LYS 701           HZ1      LYS 701  60.337  -4.527 -18.996
   12    HZ3  LYS 701           HZ2      LYS 701  59.227  -4.372 -20.258
   13    HZ2  LYS 701           HZ3      LYS 701  59.029  -5.594 -19.131

  No H/Q in entry =          13
  In of MODEL   35
    1    H    CYS 702           H        CYS 702  55.586  -4.917 -12.436
    2    HA   CYS 702           HA       CYS 702  57.176  -6.337 -10.414
    3    HB2  CYS 702           HB2      CYS 702  54.523  -5.002  -9.796
    4    HB3  CYS 702           HB3      CYS 702  55.885  -5.325  -8.776

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLN 703           H        GLN 703  56.269  -8.256  -9.617
    2    HA   GLN 703           HA       GLN 703  54.295  -9.436 -11.309
    3    HB2  GLN 703           HB2      GLN 703  55.364 -10.409  -8.657
    4    HB3  GLN 703           HB3      GLN 703  54.434 -11.358  -9.807
    5    HG2  GLN 703           HG2      GLN 703  57.188 -10.227 -10.232
    6    HG3  GLN 703           HG3      GLN 703  56.778 -11.916  -9.953
    7   HE21  GLN 703          HE21      GLN 703  54.433 -11.872 -11.748
    8   HE22  GLN 703          HE22      GLN 703  55.061 -11.767 -13.337

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ARG 704           H        ARG 704  52.395 -10.564  -9.979
    2    HA   ARG 704           HA       ARG 704  50.966  -8.164  -9.310
    3    HB2  ARG 704           HB2      ARG 704  49.961 -10.978  -9.654
    4    HB3  ARG 704           HB3      ARG 704  48.934  -9.563  -9.413
    5    HG2  ARG 704           HG2      ARG 704  49.739  -8.553 -11.434
    6    HG3  ARG 704           HG3      ARG 704  50.926  -9.857 -11.606
    7    HD2  ARG 704           HD2      ARG 704  49.235 -11.436 -12.046
    8    HD3  ARG 704           HD3      ARG 704  47.976 -10.273 -11.623
    9    HE   ARG 704           HE       ARG 704  49.372  -9.072 -13.624
   10   HH11  ARG 704          HH11      ARG 704  47.851 -12.271 -13.529
   11   HH12  ARG 704          HH12      ARG 704  47.107 -12.090 -15.053
   12   HH21  ARG 704          HH21      ARG 704  48.312  -8.879 -15.741
   13   HH22  ARG 704          HH22      ARG 704  47.346 -10.166 -16.297

  No H/Q in entry =          13
  In of MODEL   35
    1    H    TRP 705           H        TRP 705  52.534 -10.449  -7.496
    2    HA   TRP 705           HA       TRP 705  51.094  -9.749  -5.051
    3    HB2  TRP 705           HB2      TRP 705  52.658 -11.399  -3.976
    4    HB3  TRP 705           HB3      TRP 705  51.693 -12.087  -5.272
    5    HD1  TRP 705           HD1      TRP 705  55.307 -11.157  -4.417
    6    HE1  TRP 705           HE1      TRP 705  56.878 -12.310  -6.091
    7    HE3  TRP 705           HE3      TRP 705  51.832 -13.093  -7.590
    8    HZ2  TRP 705           HZ2      TRP 705  56.653 -13.843  -8.460
    9    HZ3  TRP 705           HZ3      TRP 705  52.566 -14.367  -9.510
   10    HH2  TRP 705           HH2      TRP 705  54.939 -14.764  -9.943

  No H/Q in entry =          10
  In of MODEL   35
    1    H    GLU 706           H        GLU 706  53.106  -8.201  -6.953
    2    HA   GLU 706           HA       GLU 706  54.786  -7.122  -4.820
    3    HB2  GLU 706           HB2      GLU 706  55.336  -7.279  -7.772
    4    HB3  GLU 706           HB3      GLU 706  56.342  -6.431  -6.603
    5    HG2  GLU 706           HG2      GLU 706  56.709  -8.604  -5.477
    6    HG3  GLU 706           HG3      GLU 706  55.822  -9.381  -6.786

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LYS 707           H        LYS 707  55.413  -4.913  -5.202
    2    HA   LYS 707           HA       LYS 707  53.489  -3.312  -6.659
    3    HB2  LYS 707           HB2      LYS 707  53.124  -1.832  -4.706
    4    HB3  LYS 707           HB3      LYS 707  52.487  -3.446  -4.438
    5    HG2  LYS 707           HG2      LYS 707  54.482  -3.983  -3.099
    6    HG3  LYS 707           HG3      LYS 707  55.067  -2.334  -3.344
    7    HD2  LYS 707           HD2      LYS 707  53.051  -1.471  -2.239
    8    HD3  LYS 707           HD3      LYS 707  52.495  -3.125  -1.976
    9    HE2  LYS 707           HE2      LYS 707  54.530  -3.556  -0.629
   10    HE3  LYS 707           HE3      LYS 707  55.004  -1.881  -0.869
   11    HZ2  LYS 707           HZ1      LYS 707  53.893  -2.260   1.250
   12    HZ1  LYS 707           HZ2      LYS 707  52.483  -2.727   0.449
   13    HZ3  LYS 707           HZ3      LYS 707  53.073  -1.152   0.286

  No H/Q in entry =          13
  In of MODEL   35
    1    H    LEU 708           H        LEU 708  54.272  -1.198  -7.055
    2    HA   LEU 708           HA       LEU 708  57.180  -1.091  -7.103
    3    HB2  LEU 708           HB2      LEU 708  55.882  -0.762  -9.195
    4    HB3  LEU 708           HB3      LEU 708  55.109   0.630  -8.472
    5    HG   LEU 708           HG       LEU 708  57.395   1.680  -8.292
    6   HD12  LEU 708          HD11      LEU 708  59.151   0.815  -9.750
    7   HD11  LEU 708          HD12      LEU 708  58.166  -0.607 -10.085
    8   HD13  LEU 708          HD13      LEU 708  58.754  -0.305  -8.450
    9   HD21  LEU 708          HD21      LEU 708  56.373   1.014 -11.054
   10   HD23  LEU 708          HD22      LEU 708  57.470   2.336 -10.656
   11   HD22  LEU 708          HD23      LEU 708  55.824   2.335 -10.024

  No H/Q in entry =          11
  In of MODEL   35
    1    H    GLN 709           H        GLN 709  58.102  -0.014  -5.479
    2    HA   GLN 709           HA       GLN 709  57.167   2.649  -4.865
    3    HB2  GLN 709           HB2      GLN 709  57.063   2.403  -2.498
    4    HB3  GLN 709           HB3      GLN 709  56.128   1.054  -3.119
    5    HG2  GLN 709           HG2      GLN 709  58.123  -0.396  -2.783
    6    HG3  GLN 709           HG3      GLN 709  58.927   0.995  -2.035
    7   HE21  GLN 709          HE21      GLN 709  59.096  -0.060  -0.063
    8   HE22  GLN 709          HE22      GLN 709  57.736  -0.325   0.964

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ASN 710           H        ASN 710  58.893   3.955  -4.263
    2    HA   ASN 710           HA       ASN 710  61.086   4.624  -4.130
    3    HB2  ASN 710           HB2      ASN 710  60.999   2.812  -2.270
    4    HB3  ASN 710           HB3      ASN 710  61.798   1.759  -3.415
    5   HD21  ASN 710          HD21      ASN 710  62.060   4.365  -1.342
    6   HD22  ASN 710          HD22      ASN 710  63.762   4.669  -1.413

  No H/Q in entry =           6
  In of MODEL   35
    1    H    SER 711           H        SER 711  59.803   3.337  -6.472
    2    HA   SER 711           HA       SER 711  60.169   2.798  -8.591
    3    HB2  SER 711           HB2      SER 711  62.933   3.842  -8.005
    4    HB3  SER 711           HB3      SER 711  62.273   3.571  -9.632
    5    HG   SER 711           HG       SER 711  60.516   4.932  -8.219

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ARG 712           H        ARG 712  60.866   0.863  -6.369
    2    HA   ARG 712           HA       ARG 712  62.247  -1.083  -8.072
    3    HB2  ARG 712           HB2      ARG 712  63.178  -2.122  -6.078
    4    HB3  ARG 712           HB3      ARG 712  63.661  -0.436  -6.125
    5    HG2  ARG 712           HG2      ARG 712  61.970   0.123  -4.502
    6    HG3  ARG 712           HG3      ARG 712  61.400  -1.538  -4.468
    7    HD2  ARG 712           HD2      ARG 712  62.816  -1.210  -2.564
    8    HD3  ARG 712           HD3      ARG 712  63.682  -2.212  -3.734
    9    HE   ARG 712           HE       ARG 712  64.279   0.524  -4.103
   10   HH11  ARG 712          HH11      ARG 712  65.040  -2.186  -1.918
   11   HH12  ARG 712          HH12      ARG 712  66.575  -1.564  -1.511
   12   HH21  ARG 712          HH21      ARG 712  66.407   1.342  -3.471
   13   HH22  ARG 712          HH22      ARG 712  67.356   0.396  -2.410

  No H/Q in entry =          13
  In of MODEL   35
    1    H    CYS 713           H        CYS 713  61.535  -3.313  -7.557
    2    HA   CYS 713           HA       CYS 713  58.665  -3.279  -7.045
    3    HB2  CYS 713           HB2      CYS 713  60.418  -5.413  -8.264
    4    HB3  CYS 713           HB3      CYS 713  58.654  -5.418  -8.223

  No H/Q in entry =           4
  In of MODEL   35
    1    H    VAL 714           H        VAL 714  58.090  -3.836  -5.065
    2    HA   VAL 714           HA       VAL 714  59.736  -5.788  -3.596
    3    HB   VAL 714           HB       VAL 714  58.956  -4.742  -1.484
    4   HG11  VAL 714          HG11      VAL 714  60.298  -2.799  -3.342
    5   HG13  VAL 714          HG12      VAL 714  61.100  -4.040  -2.380
    6   HG12  VAL 714          HG13      VAL 714  60.297  -2.687  -1.583
    7   HG21  VAL 714          HG21      VAL 714  56.858  -3.769  -2.265
    8   HG23  VAL 714          HG22      VAL 714  57.746  -2.618  -3.263
    9   HG22  VAL 714          HG23      VAL 714  57.863  -2.532  -1.510

  No H/Q in entry =           9
  In of MODEL   35
    1    H    CYS 715           H        CYS 715  58.319  -6.922  -1.877
    2    HA   CYS 715           HA       CYS 715  55.968  -7.846  -3.297
    3    HB2  CYS 715           HB2      CYS 715  57.207  -8.858  -0.703
    4    HB3  CYS 715           HB3      CYS 715  55.960  -9.659  -1.634

  No H/Q in entry =           4
  In of MODEL   35
    1    H    LYS 716           H        LYS 716  53.912  -7.646  -2.398
    2    HA   LYS 716           HA       LYS 716  53.724  -5.382  -0.642
    3    HB2  LYS 716           HB2      LYS 716  51.313  -5.474  -1.025
    4    HB3  LYS 716           HB3      LYS 716  52.213  -5.507  -2.534
    5    HG2  LYS 716           HG2      LYS 716  51.852  -7.906  -2.705
    6    HG3  LYS 716           HG3      LYS 716  50.979  -7.885  -1.172
    7    HD2  LYS 716           HD2      LYS 716  49.427  -7.917  -3.060
    8    HD3  LYS 716           HD3      LYS 716  49.289  -6.406  -2.162
    9    HE2  LYS 716           HE2      LYS 716  50.667  -5.290  -3.765
   10    HE3  LYS 716           HE3      LYS 716  50.891  -6.778  -4.687
   11    HZ3  LYS 716           HZ1      LYS 716  49.183  -5.382  -5.680
   12    HZ2  LYS 716           HZ2      LYS 716  48.324  -5.341  -4.248
   13    HZ1  LYS 716           HZ3      LYS 716  48.465  -6.785  -5.093

  No H/Q in entry =          13
  In of MODEL   35
    1    H    MET 717           H        MET 717  51.693  -5.704   0.893
    2    HA   MET 717           HA       MET 717  52.579  -7.816   2.724
    3    HB2  MET 717           HB2      MET 717  51.057  -5.263   3.242
    4    HB3  MET 717           HB3      MET 717  51.530  -6.419   4.473
    5    HG2  MET 717           HG2      MET 717  53.417  -4.835   2.736
    6    HG3  MET 717           HG3      MET 717  53.007  -4.470   4.411
    7    HE1  MET 717           HE1      MET 717  53.807  -5.883   6.489
    8    HE3  MET 717           HE2      MET 717  54.653  -7.422   6.365
    9    HE2  MET 717           HE3      MET 717  52.974  -7.298   5.843

  No H/Q in entry =           9
  In of MODEL   35
    1    HA   PRO 718           HA       PRO 718  48.853 -10.052   2.078
    2    HB2  PRO 718           HB2      PRO 718  48.363 -11.117   4.549
    3    HB3  PRO 718           HB3      PRO 718  49.615 -11.708   3.453
    4    HG2  PRO 718           HG2      PRO 718  49.865  -9.832   5.774
    5    HG3  PRO 718           HG3      PRO 718  50.909 -11.195   5.322
    6    HD2  PRO 718           HD2      PRO 718  51.593  -8.656   4.778
    7    HD3  PRO 718           HD3      PRO 718  51.976  -9.982   3.659

  No H/Q in entry =           7
  In of MODEL   35
    1    H    TYR 719           H        TYR 719  48.794  -7.368   4.090
    2    HA   TYR 719           HA       TYR 719  45.906  -7.611   4.464
    3    HB2  TYR 719           HB2      TYR 719  46.060  -5.787   6.108
    4    HB3  TYR 719           HB3      TYR 719  47.100  -7.133   6.535
    5    HD1  TYR 719           HD1      TYR 719  46.926  -3.621   5.718
    6    HD2  TYR 719           HD2      TYR 719  49.577  -6.905   6.226
    7    HE1  TYR 719           HE1      TYR 719  48.797  -2.059   5.977
    8    HE2  TYR 719           HE2      TYR 719  51.452  -5.346   6.503
    9    HH   TYR 719           HH       TYR 719  50.975  -2.016   6.962

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLU 720           H        GLU 720  47.976  -6.492   2.272
    2    HA   GLU 720           HA       GLU 720  46.422  -4.140   1.552
    3    HB2  GLU 720           HB2      GLU 720  48.863  -5.448   0.364
    4    HB3  GLU 720           HB3      GLU 720  48.092  -4.032  -0.356
    5    HG2  GLU 720           HG2      GLU 720  48.577  -2.788   1.724
    6    HG3  GLU 720           HG3      GLU 720  49.390  -4.219   2.360

  No H/Q in entry =           6
  In of MODEL   35
    1    H    CYS 721           H        CYS 721  46.331  -7.370   1.303
    2    HA   CYS 721           HA       CYS 721  45.458  -7.782  -1.368
    3    HB2  CYS 721           HB2      CYS 721  45.119  -9.509   1.088
    4    HB3  CYS 721           HB3      CYS 721  44.940 -10.032  -0.584

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLY 722           H        GLY 722  43.536  -7.256  -2.102
    2    HA3  GLY 722           HA2      GLY 722  41.215  -7.350  -0.326
    3    HA2  GLY 722           HA3      GLY 722  41.529  -5.888  -1.254

  No H/Q in entry =           3
  In of MODEL   35
    1    HA   PRO 723           HA       PRO 723  39.654  -7.845  -4.743
    2    HB2  PRO 723           HB2      PRO 723  41.810  -7.216  -6.637
    3    HB3  PRO 723           HB3      PRO 723  40.205  -6.494  -6.521
    4    HG2  PRO 723           HG2      PRO 723  42.449  -5.132  -5.882
    5    HG3  PRO 723           HG3      PRO 723  40.900  -4.850  -5.069
    6    HD2  PRO 723           HD2      PRO 723  43.236  -6.493  -4.168
    7    HD3  PRO 723           HD3      PRO 723  42.265  -5.334  -3.239

  No H/Q in entry =           7
  In of MODEL   35
    1    H    SER 724           H        SER 724  39.612 -10.128  -4.743
    2    HA   SER 724           HA       SER 724  41.644 -11.754  -6.019
    3    HB2  SER 724           HB2      SER 724  42.602 -10.912  -3.753
    4    HB3  SER 724           HB3      SER 724  41.439 -12.050  -3.065
    5    HG   SER 724           HG       SER 724  43.043 -12.707  -5.193

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU 725           H        LEU 725  41.110 -13.858  -6.116
    2    HA   LEU 725           HA       LEU 725  38.356 -14.552  -5.722
    3    HB2  LEU 725           HB2      LEU 725  40.685 -15.963  -6.830
    4    HB3  LEU 725           HB3      LEU 725  39.359 -16.921  -6.219
    5    HG   LEU 725           HG       LEU 725  38.837 -16.763  -8.357
    6   HD12  LEU 725          HD11      LEU 725  37.375 -14.440  -7.401
    7   HD11  LEU 725          HD12      LEU 725  36.981 -16.145  -7.148
    8   HD13  LEU 725          HD13      LEU 725  37.037 -15.469  -8.784
    9   HD21  LEU 725          HD21      LEU 725  40.587 -15.357  -9.124
   10   HD23  LEU 725          HD22      LEU 725  39.733 -13.954  -8.463
   11   HD22  LEU 725          HD23      LEU 725  39.041 -14.846  -9.811

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ASP 726           H        ASP 726  37.548 -15.569  -4.001
    2    HA   ASP 726           HA       ASP 726  39.089 -16.234  -1.691
    3    HB2  ASP 726           HB2      ASP 726  36.263 -17.125  -2.324
    4    HB3  ASP 726           HB3      ASP 726  36.998 -16.942  -0.742

  No H/Q in entry =           4
  In of MODEL   35
    1    H    VAL 727           H        VAL 727  40.083 -18.150  -1.315
    2    HA   VAL 727           HA       VAL 727  39.197 -20.533  -2.778
    3    HB   VAL 727           HB       VAL 727  41.550 -21.206  -3.220
    4   HG11  VAL 727          HG11      VAL 727  40.262 -20.172  -4.998
    5   HG13  VAL 727          HG12      VAL 727  41.958 -19.701  -5.107
    6   HG12  VAL 727          HG13      VAL 727  40.768 -18.572  -4.458
    7   HG22  VAL 727          HG21      VAL 727  43.358 -19.546  -3.068
    8   HG21  VAL 727          HG22      VAL 727  42.652 -19.867  -1.486
    9   HG23  VAL 727          HG23      VAL 727  42.234 -18.390  -2.352

  No H/Q in entry =           9
  In of MODEL   35
    1    H    CYS 728           H        CYS 728  40.436 -22.528  -1.919
    2    HA   CYS 728           HA       CYS 728  40.422 -22.384   1.011
    3    HB2  CYS 728           HB2      CYS 728  38.763 -23.981  -0.062
    4    HB3  CYS 728           HB3      CYS 728  40.125 -24.866  -0.724

  No H/Q in entry =           4
  In of MODEL   35
    1    H    ALA 729           H        ALA 729  42.293 -22.897   2.097
    2    HA   ALA 729           HA       ALA 729  44.330 -24.285   0.594
    3    HB3  ALA 729           HB1      ALA 729  44.804 -21.893   0.308
    4    HB2  ALA 729           HB2      ALA 729  46.043 -22.695   1.269
    5    HB1  ALA 729           HB3      ALA 729  44.823 -21.704   2.061

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLN 730           H        GLN 730  46.000 -25.052   1.930
    2    HA   GLN 730           HA       GLN 730  45.087 -25.533   4.651
    3    HB2  GLN 730           HB2      GLN 730  45.175 -27.600   3.292
    4    HB3  GLN 730           HB3      GLN 730  46.863 -27.282   2.944
    5    HG2  GLN 730           HG2      GLN 730  47.466 -27.515   5.246
    6    HG3  GLN 730           HG3      GLN 730  45.789 -27.690   5.726
    7   HE21  GLN 730          HE21      GLN 730  46.141 -29.697   6.670
    8   HE22  GLN 730          HE22      GLN 730  46.507 -31.097   5.725

  No H/Q in entry =           8
  In of MODEL   35
    1    H    ASP 731           H        ASP 731  46.369 -24.895   6.168
    2    HA   ASP 731           HA       ASP 731  48.735 -23.344   5.704
    3    HB2  ASP 731           HB2      ASP 731  47.095 -22.948   7.568
    4    HB3  ASP 731           HB3      ASP 731  47.586 -24.473   8.282

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLU 732           H        GLU 732  50.925 -24.016   6.126
    2    HA   GLU 732           HA       GLU 732  51.247 -26.908   6.152
    3    HB2  GLU 732           HB2      GLU 732  53.098 -24.709   5.363
    4    HB3  GLU 732           HB3      GLU 732  53.698 -26.337   5.654
    5    HG2  GLU 732           HG2      GLU 732  51.593 -25.546   3.667
    6    HG3  GLU 732           HG3      GLU 732  53.261 -26.002   3.302

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ARG 733           H        ARG 733  51.407 -24.451   8.383
    2    HA   ARG 733           HA       ARG 733  53.320 -25.968   9.981
    3    HB2  ARG 733           HB2      ARG 733  53.652 -23.475   9.573
    4    HB3  ARG 733           HB3      ARG 733  52.233 -23.215  10.580
    5    HG2  ARG 733           HG2      ARG 733  54.174 -22.917  11.934
    6    HG3  ARG 733           HG3      ARG 733  53.401 -24.433  12.405
    7    HD2  ARG 733           HD2      ARG 733  54.990 -25.674  10.990
    8    HD3  ARG 733           HD3      ARG 733  55.767 -24.155  10.557
    9    HE   ARG 733           HE       ARG 733  55.775 -24.291  13.293
   10   HH11  ARG 733          HH11      ARG 733  57.148 -26.204  10.594
   11   HH12  ARG 733          HH12      ARG 733  58.458 -26.757  11.530
   12   HH21  ARG 733          HH21      ARG 733  57.620 -25.095  14.515
   13   HH22  ARG 733          HH22      ARG 733  58.734 -26.129  13.746

  No H/Q in entry =          13
  In of MODEL   35
    1    H    SER 734           H        SER 734  50.161 -24.499   9.929
    2    HA   SER 734           HA       SER 734  49.386 -25.686  12.465
    3    HB2  SER 734           HB2      SER 734  47.652 -24.159  10.529
    4    HB3  SER 734           HB3      SER 734  47.449 -24.332  12.271
    5    HG   SER 734           HG       SER 734  48.928 -22.562  10.847

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LYS 735           H        LYS 735  49.168 -26.311   9.053
    2    HA   LYS 735           HA       LYS 735  48.242 -27.857   7.748
    3    HB2  LYS 735           HB2      LYS 735  48.206 -29.507  10.272
    4    HB3  LYS 735           HB3      LYS 735  47.957 -30.136   8.653
    5    HG2  LYS 735           HG2      LYS 735  50.477 -28.856   9.710
    6    HG3  LYS 735           HG3      LYS 735  50.231 -30.564   9.367
    7    HD2  LYS 735           HD2      LYS 735  50.189 -28.314   7.339
    8    HD3  LYS 735           HD3      LYS 735  51.518 -29.427   7.596
    9    HE2  LYS 735           HE2      LYS 735  50.018 -31.301   6.922
   10    HE3  LYS 735           HE3      LYS 735  48.740 -30.129   6.613
   11    HZ3  LYS 735           HZ1      LYS 735  49.812 -30.691   4.560
   12    HZ2  LYS 735           HZ2      LYS 735  51.318 -30.394   5.198
   13    HZ1  LYS 735           HZ3      LYS 735  50.298 -29.111   4.900

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ARG 736           H        ARG 736  46.441 -26.010   9.163
    2    HA   ARG 736           HA       ARG 736  43.933 -27.561   9.129
    3    HB2  ARG 736           HB2      ARG 736  42.871 -25.706  10.134
    4    HB3  ARG 736           HB3      ARG 736  44.401 -25.862  10.987
    5    HG2  ARG 736           HG2      ARG 736  45.324 -23.999   9.902
    6    HG3  ARG 736           HG3      ARG 736  44.089 -24.013   8.650
    7    HD2  ARG 736           HD2      ARG 736  43.546 -22.245  10.009
    8    HD3  ARG 736           HD3      ARG 736  42.430 -23.513  10.480
    9    HE   ARG 736           HE       ARG 736  44.760 -23.494  12.101
   10   HH11  ARG 736          HH11      ARG 736  41.532 -22.071  11.751
   11   HH12  ARG 736          HH12      ARG 736  41.549 -21.297  13.265
   12   HH21  ARG 736          HH21      ARG 736  44.750 -22.447  14.228
   13   HH22  ARG 736          HH22      ARG 736  43.398 -21.519  14.698

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ILE 737           H        ILE 737  42.184 -26.888   7.901
    2    HA   ILE 737           HA       ILE 737  42.928 -25.729   5.379
    3    HB   ILE 737           HB       ILE 737  40.295 -26.832   6.412
    4   HG12  ILE 737          HG12      ILE 737  42.073 -28.536   6.186
    5   HG13  ILE 737          HG13      ILE 737  40.762 -28.791   5.041
    6   HG23  ILE 737          HG21      ILE 737  39.616 -26.780   4.072
    7   HG22  ILE 737          HG22      ILE 737  41.168 -26.052   3.663
    8   HG21  ILE 737          HG23      ILE 737  40.026 -25.167   4.674
    9   HD13  ILE 737          HD11      ILE 737  42.857 -29.159   3.953
   10   HD12  ILE 737          HD12      ILE 737  43.452 -27.605   4.536
   11   HD11  ILE 737          HD13      ILE 737  42.161 -27.648   3.319

  No H/Q in entry =          11
  In of MODEL   35
    1    H    LEU 738           H        LEU 738  42.682 -23.608   5.080
    2    HA   LEU 738           HA       LEU 738  40.589 -22.271   6.572
    3    HB2  LEU 738           HB2      LEU 738  41.903 -20.383   7.184
    4    HB3  LEU 738           HB3      LEU 738  42.745 -21.801   7.766
    5    HG   LEU 738           HG       LEU 738  43.497 -20.094   5.381
    6   HD12  LEU 738          HD11      LEU 738  44.795 -20.421   8.075
    7   HD11  LEU 738          HD12      LEU 738  43.906 -19.009   7.509
    8   HD13  LEU 738          HD13      LEU 738  45.424 -19.463   6.735
    9   HD21  LEU 738          HD21      LEU 738  44.052 -22.414   5.059
   10   HD23  LEU 738          HD22      LEU 738  44.941 -22.441   6.588
   11   HD22  LEU 738          HD23      LEU 738  45.505 -21.433   5.233

  No H/Q in entry =          11
  In of MODEL   35
    1    HA   PRO 739           HA       PRO 739  39.701 -20.339   2.671
    2    HB2  PRO 739           HB2      PRO 739  38.398 -18.147   3.579
    3    HB3  PRO 739           HB3      PRO 739  37.685 -19.766   3.661
    4    HG2  PRO 739           HG2      PRO 739  39.045 -18.202   5.815
    5    HG3  PRO 739           HG3      PRO 739  37.547 -19.149   5.894
    6    HD2  PRO 739           HD2      PRO 739  39.981 -20.127   6.734
    7    HD3  PRO 739           HD3      PRO 739  38.680 -21.153   6.073

  No H/Q in entry =           7
  In of MODEL   35
    1    H    LEU 740           H        LEU 740  41.018 -19.175   1.465
    2    HA   LEU 740           HA       LEU 740  42.329 -16.796   2.565
    3    HB2  LEU 740           HB2      LEU 740  43.646 -18.979   0.952
    4    HB3  LEU 740           HB3      LEU 740  44.302 -17.370   1.095
    5    HG   LEU 740           HG       LEU 740  44.006 -19.397   3.312
    6   HD11  LEU 740          HD11      LEU 740  46.380 -18.227   1.865
    7   HD13  LEU 740          HD12      LEU 740  45.782 -19.873   1.734
    8   HD12  LEU 740          HD13      LEU 740  46.475 -19.309   3.257
    9   HD21  LEU 740          HD21      LEU 740  45.143 -16.591   3.375
   10   HD23  LEU 740          HD22      LEU 740  45.217 -17.759   4.691
   11   HD22  LEU 740          HD23      LEU 740  43.661 -17.119   4.171

  No H/Q in entry =          11
  In of MODEL   35
    1    H    THR 741           H        THR 741  43.371 -15.691   0.607
    2    HA   THR 741           HA       THR 741  41.595 -15.953  -1.660
    3    HB   THR 741           HB       THR 741  42.702 -13.404  -1.661
    4    HG1  THR 741           HG1      THR 741  42.174 -12.623   0.404
    5   HG21  THR 741          HG21      THR 741  40.561 -14.100  -2.438
    6   HG23  THR 741          HG22      THR 741  40.370 -12.719  -1.330
    7   HG22  THR 741          HG23      THR 741  39.983 -14.370  -0.792

  No H/Q in entry =           7
  In of MODEL   35
    1    H    VAL 742           H        VAL 742  42.592 -15.608  -3.653
    2    HA   VAL 742           HA       VAL 742  45.067 -16.813  -3.835
    3    HB   VAL 742           HB       VAL 742  43.651 -17.083  -5.740
    4   HG12  VAL 742          HG11      VAL 742  43.514 -14.214  -6.142
    5   HG11  VAL 742          HG12      VAL 742  42.260 -15.310  -5.513
    6   HG13  VAL 742          HG13      VAL 742  42.913 -15.535  -7.151
    7   HG23  VAL 742          HG21      VAL 742  45.608 -15.124  -6.782
    8   HG22  VAL 742          HG22      VAL 742  45.015 -16.590  -7.583
    9   HG21  VAL 742          HG23      VAL 742  46.129 -16.682  -6.194

  No H/Q in entry =           9
  In of MODEL   35
    1    H    CYS 743           H        CYS 743  44.393 -13.413  -3.892
    2    HA   CYS 743           HA       CYS 743  46.992 -12.531  -4.470
    3    HB2  CYS 743           HB2      CYS 743  44.961 -11.063  -4.511
    4    HB3  CYS 743           HB3      CYS 743  44.879 -11.184  -2.766

  No H/Q in entry =           4
  In of MODEL   35
    1    H    LYS 744           H        LYS 744  45.329 -13.202  -1.459
    2    HA   LYS 744           HA       LYS 744  47.359 -12.339   0.279
    3    HB2  LYS 744           HB2      LYS 744  44.914 -12.760   0.750
    4    HB3  LYS 744           HB3      LYS 744  45.304 -14.456   0.832
    5    HG2  LYS 744           HG2      LYS 744  46.721 -14.158   2.733
    6    HG3  LYS 744           HG3      LYS 744  46.602 -12.400   2.607
    7    HD2  LYS 744           HD2      LYS 744  44.180 -12.561   3.023
    8    HD3  LYS 744           HD3      LYS 744  44.345 -14.303   3.232
    9    HE2  LYS 744           HE2      LYS 744  45.794 -13.968   5.150
   10    HE3  LYS 744           HE3      LYS 744  45.759 -12.224   4.899
   11    HZ3  LYS 744           HZ1      LYS 744  43.409 -12.218   5.389
   12    HZ2  LYS 744           HZ2      LYS 744  44.247 -12.950   6.657
   13    HZ1  LYS 744           HZ3      LYS 744  43.389 -13.895   5.570

  No H/Q in entry =          13
  In of MODEL   35
    1    H    MET 745           H        MET 745  46.456 -15.533  -0.892
    2    HA   MET 745           HA       MET 745  48.479 -17.070   0.284
    3    HB2  MET 745           HB2      MET 745  46.841 -18.347  -0.656
    4    HB3  MET 745           HB3      MET 745  46.667 -17.351  -2.072
    5    HG2  MET 745           HG2      MET 745  47.600 -19.297  -2.932
    6    HG3  MET 745           HG3      MET 745  48.973 -18.253  -2.732
    7    HE2  MET 745           HE1      MET 745  48.035 -21.844  -0.029
    8    HE1  MET 745           HE2      MET 745  47.102 -21.352  -1.444
    9    HE3  MET 745           HE3      MET 745  47.049 -20.385   0.029

  No H/Q in entry =           9
  In of MODEL   35
    1    H    HIS 746           H        HIS 746  48.471 -15.251  -2.761
    2    HA   HIS 746           HA       HIS 746  51.019 -16.254  -3.620
    3    HB2  HIS 746           HB2      HIS 746  49.173 -14.200  -4.545
    4    HB3  HIS 746           HB3      HIS 746  50.866 -13.871  -4.963
    5    HD1  HIS 746           HD1      HIS 746  51.968 -15.854  -6.484
    6    HD2  HIS 746           HD2      HIS 746  47.837 -15.823  -6.151
    7    HE1  HIS 746           HE1      HIS 746  51.137 -17.237  -8.418
    8    HE2  HIS 746           HE2      HIS 746  48.620 -17.315  -8.125

  No H/Q in entry =           8
  In of MODEL   35
    1    H    VAL 747           H        VAL 747  50.005 -13.379  -1.926
    2    HA   VAL 747           HA       VAL 747  52.547 -12.199  -1.745
    3    HB   VAL 747           HB       VAL 747  49.994 -11.775  -0.194
    4   HG11  VAL 747          HG11      VAL 747  51.936 -11.075   1.187
    5   HG13  VAL 747          HG12      VAL 747  50.988  -9.698   0.671
    6   HG12  VAL 747          HG13      VAL 747  52.511 -10.076  -0.141
    7   HG22  VAL 747          HG21      VAL 747  49.854  -9.775  -1.601
    8   HG21  VAL 747          HG22      VAL 747  49.929 -11.258  -2.561
    9   HG23  VAL 747          HG23      VAL 747  51.361 -10.256  -2.384

  No H/Q in entry =           9
  In of MODEL   35
    1    H    LEU 748           H        LEU 748  50.675 -14.122   0.613
    2    HA   LEU 748           HA       LEU 748  52.778 -13.990   2.461
    3    HB2  LEU 748           HB2      LEU 748  51.633 -15.877   3.693
    4    HB3  LEU 748           HB3      LEU 748  50.614 -14.499   3.357
    5    HG   LEU 748           HG       LEU 748  49.629 -15.820   1.467
    6   HD12  LEU 748          HD11      LEU 748  49.808 -18.254   1.561
    7   HD11  LEU 748          HD12      LEU 748  51.068 -18.099   2.786
    8   HD13  LEU 748          HD13      LEU 748  51.341 -17.481   1.158
    9   HD23  LEU 748          HD21      LEU 748  49.306 -16.874   4.268
   10   HD22  LEU 748          HD22      LEU 748  48.167 -17.117   2.945
   11   HD21  LEU 748          HD23      LEU 748  48.470 -15.492   3.560

  No H/Q in entry =          11
  In of MODEL   35
    1    H    HIS 749           H        HIS 749  52.191 -16.093  -0.197
    2    HA   HIS 749           HA       HIS 749  54.145 -18.027   0.427
    3    HB2  HIS 749           HB2      HIS 749  52.371 -17.526  -1.739
    4    HB3  HIS 749           HB3      HIS 749  53.991 -17.723  -2.414
    5    HD1  HIS 749           HD1      HIS 749  54.346 -20.054  -3.113
    6    HD2  HIS 749           HD2      HIS 749  51.850 -19.833   0.207
    7    HE1  HIS 749           HE1      HIS 749  53.682 -22.415  -2.608
    8    HE2  HIS 749           HE2      HIS 749  52.050 -22.264  -0.742

  No H/Q in entry =           8
  In of MODEL   35
    1    H    CYS 750           H        CYS 750  54.351 -14.931  -1.430
    2    HA   CYS 750           HA       CYS 750  57.096 -15.399  -1.984
    3    HB2  CYS 750           HB2      CYS 750  57.158 -13.113  -2.860
    4    HB3  CYS 750           HB3      CYS 750  55.764 -13.982  -3.480

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLN 751           H        GLN 751  55.358 -13.932   0.688
    2    HA   GLN 751           HA       GLN 751  57.664 -12.716   1.723
    3    HB2  GLN 751           HB2      GLN 751  55.168 -13.521   3.215
    4    HB3  GLN 751           HB3      GLN 751  56.444 -12.501   3.864
    5    HG2  GLN 751           HG2      GLN 751  55.971 -11.032   1.776
    6    HG3  GLN 751           HG3      GLN 751  54.453 -11.911   1.736
    7   HE21  GLN 751          HE21      GLN 751  54.957  -9.141   2.223
    8   HE22  GLN 751          HE22      GLN 751  54.305  -8.727   3.749

  No H/Q in entry =           8
  In of MODEL   35
    1    H    GLY 752           H        GLY 752  56.700 -15.954   1.571
    2    HA3  GLY 752           HA2      GLY 752  58.524 -17.530   2.008
    3    HA2  GLY 752           HA3      GLY 752  58.811 -16.666   3.505

  No H/Q in entry =           3
  In of MODEL   35
    1    H    ARG 753           H        ARG 753  55.494 -17.031   2.938
    2    HA   ARG 753           HA       ARG 753  55.382 -19.048   5.029
    3    HB2  ARG 753           HB2      ARG 753  53.147 -17.565   3.640
    4    HB3  ARG 753           HB3      ARG 753  52.990 -18.600   5.051
    5    HG2  ARG 753           HG2      ARG 753  54.544 -16.033   4.935
    6    HG3  ARG 753           HG3      ARG 753  52.920 -16.201   5.590
    7    HD2  ARG 753           HD2      ARG 753  53.778 -17.818   7.249
    8    HD3  ARG 753           HD3      ARG 753  55.407 -17.567   6.623
    9    HE   ARG 753           HE       ARG 753  54.429 -15.086   7.242
   10   HH11  ARG 753          HH11      ARG 753  55.182 -18.031   8.999
   11   HH12  ARG 753          HH12      ARG 753  55.462 -17.282  10.505
   12   HH21  ARG 753          HH21      ARG 753  54.827 -14.002   9.262
   13   HH22  ARG 753          HH22      ARG 753  55.242 -14.868  10.652

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ASN 754           H        ASN 754  54.905 -21.136   4.684
    2    HA   ASN 754           HA       ASN 754  54.404 -21.997   1.954
    3    HB2  ASN 754           HB2      ASN 754  54.976 -23.640   4.444
    4    HB3  ASN 754           HB3      ASN 754  54.766 -24.286   2.830
    5   HD21  ASN 754          HD21      ASN 754  57.001 -24.494   4.633
    6   HD22  ASN 754          HD22      ASN 754  58.366 -23.859   3.796

  No H/Q in entry =           6
  In of MODEL   35
    1    H    TYR 755           H        TYR 755  52.486 -22.572   1.289
    2    HA   TYR 755           HA       TYR 755  50.508 -23.668   3.114
    3    HB2  TYR 755           HB2      TYR 755  50.001 -21.241   1.385
    4    HB3  TYR 755           HB3      TYR 755  48.733 -22.349   1.867
    5    HD1  TYR 755           HD1      TYR 755  47.582 -21.981   3.842
    6    HD2  TYR 755           HD2      TYR 755  51.359 -20.136   3.311
    7    HE1  TYR 755           HE1      TYR 755  47.221 -20.668   5.885
    8    HE2  TYR 755           HE2      TYR 755  51.015 -18.822   5.339
    9    HH   TYR 755           HH       TYR 755  49.096 -17.999   6.657

  No H/Q in entry =           9
  In of MODEL   35
    1    H    THR 756           H        THR 756  49.138 -25.072   2.120
    2    HA   THR 756           HA       THR 756  49.861 -25.870  -0.596
    3    HB   THR 756           HB       THR 756  48.579 -27.323   1.736
    4    HG1  THR 756           HG1      THR 756  50.513 -27.706   2.291
    5   HG21  THR 756          HG21      THR 756  47.784 -28.184  -0.405
    6   HG23  THR 756          HG22      THR 756  48.801 -29.363   0.427
    7   HG22  THR 756          HG23      THR 756  49.453 -28.432  -0.939

  No H/Q in entry =           7
  In of MODEL   35
    1    H    LEU 757           H        LEU 757  48.048 -26.216  -2.038
    2    HA   LEU 757           HA       LEU 757  45.634 -24.985  -1.022
    3    HB2  LEU 757           HB2      LEU 757  46.472 -25.512  -3.830
    4    HB3  LEU 757           HB3      LEU 757  44.828 -25.079  -3.402
    5    HG   LEU 757           HG       LEU 757  46.135 -23.129  -2.168
    6   HD11  LEU 757          HD11      LEU 757  48.332 -23.823  -2.859
    7   HD13  LEU 757          HD12      LEU 757  47.920 -22.266  -3.567
    8   HD12  LEU 757          HD13      LEU 757  47.859 -23.726  -4.555
    9   HD23  LEU 757          HD21      LEU 757  45.315 -23.177  -5.055
   10   HD22  LEU 757          HD22      LEU 757  45.492 -21.740  -4.021
   11   HD21  LEU 757          HD23      LEU 757  44.275 -22.950  -3.648

  No H/Q in entry =          11
  In of MODEL   35
    1    H    THR 758           H        THR 758  43.708 -25.839  -1.103
    2    HA   THR 758           HA       THR 758  43.582 -28.694  -1.579
    3    HB   THR 758           HB       THR 758  41.911 -28.572   0.431
    4    HG1  THR 758           HG1      THR 758  41.736 -26.697   1.370
    5   HG22  THR 758          HG21      THR 758  44.850 -28.010   0.934
    6   HG21  THR 758          HG22      THR 758  44.187 -29.597   0.538
    7   HG23  THR 758          HG23      THR 758  43.734 -28.804   2.044

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLY 759           H        GLY 759  40.752 -28.801  -1.104
    2    HA3  GLY 759           HA2      GLY 759  39.888 -27.184  -3.386
    3    HA2  GLY 759           HA3      GLY 759  39.257 -28.780  -2.999

  No H/Q in entry =           3
  In of MODEL   35
    1    H    ARG 760           H        ARG 760  37.727 -26.487  -3.382
    2    HA   ARG 760           HA       ARG 760  36.976 -24.954  -1.212
    3    HB2  ARG 760           HB2      ARG 760  35.056 -24.308  -2.386
    4    HB3  ARG 760           HB3      ARG 760  36.196 -24.748  -3.637
    5    HG2  ARG 760           HG2      ARG 760  33.909 -26.460  -2.657
    6    HG3  ARG 760           HG3      ARG 760  33.900 -25.507  -4.137
    7    HD2  ARG 760           HD2      ARG 760  35.761 -26.929  -4.990
    8    HD3  ARG 760           HD3      ARG 760  35.672 -27.862  -3.490
    9    HE   ARG 760           HE       ARG 760  33.141 -27.765  -4.674
   10   HH11  ARG 760          HH11      ARG 760  36.293 -29.330  -5.282
   11   HH12  ARG 760          HH12      ARG 760  35.612 -30.672  -6.066
   12   HH21  ARG 760          HH21      ARG 760  32.260 -29.647  -5.806
   13   HH22  ARG 760          HH22      ARG 760  33.321 -30.858  -6.370

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ASP 761           H        ASP 761  36.329 -28.297  -1.594
    2    HA   ASP 761           HA       ASP 761  33.907 -28.480  -0.155
    3    HB2  ASP 761           HB2      ASP 761  34.639 -30.241  -1.690
    4    HB3  ASP 761           HB3      ASP 761  36.026 -30.560  -0.654

  No H/Q in entry =           4
  In of MODEL   35
    1    H    SER 762           H        SER 762  37.228 -28.297   0.792
    2    HA   SER 762           HA       SER 762  36.690 -29.440   3.373
    3    HB2  SER 762           HB2      SER 762  39.169 -28.955   3.789
    4    HB3  SER 762           HB3      SER 762  38.774 -30.141   2.547
    5    HG   SER 762           HG       SER 762  39.148 -28.509   0.977

  No H/Q in entry =           5
  In of MODEL   35
    1    H    CYS 763           H        CYS 763  36.866 -26.233   2.104
    2    HA   CYS 763           HA       CYS 763  36.962 -25.176   4.862
    3    HB2  CYS 763           HB2      CYS 763  37.635 -23.068   3.900
    4    HB3  CYS 763           HB3      CYS 763  38.570 -24.333   3.139

  No H/Q in entry =           4
  In of MODEL   35
    1    H    THR 764           H        THR 764  35.655 -23.117   5.112
    2    HA   THR 764           HA       THR 764  33.087 -23.249   3.719
    3    HB   THR 764           HB       THR 764  33.809 -21.792   6.284
    4    HG1  THR 764           HG1      THR 764  32.275 -24.160   6.086
    5   HG21  THR 764          HG21      THR 764  31.140 -22.501   5.047
    6   HG23  THR 764          HG22      THR 764  31.866 -20.894   5.082
    7   HG22  THR 764          HG23      THR 764  31.367 -21.669   6.588

  No H/Q in entry =           7
  In of MODEL   35
    1    H    LEU 765           H        LEU 765  33.194 -21.850   2.054
    2    HA   LEU 765           HA       LEU 765  35.185 -19.760   2.171
    3    HB2  LEU 765           HB2      LEU 765  34.591 -21.490   0.233
    4    HB3  LEU 765           HB3      LEU 765  33.471 -20.197  -0.173
    5    HG   LEU 765           HG       LEU 765  35.375 -18.626  -0.380
    6   HD12  LEU 765          HD11      LEU 765  37.637 -19.504  -0.424
    7   HD11  LEU 765          HD12      LEU 765  37.036 -21.065   0.143
    8   HD13  LEU 765          HD13      LEU 765  36.907 -19.644   1.172
    9   HD22  LEU 765          HD21      LEU 765  36.269 -19.556  -2.444
   10   HD21  LEU 765          HD22      LEU 765  34.527 -19.836  -2.348
   11   HD23  LEU 765          HD23      LEU 765  35.657 -21.148  -2.008

  No H/Q in entry =          11
  In of MODEL   35
    1    HA   PRO 766           HA       PRO 766  32.106 -16.750   3.254
    2    HB2  PRO 766           HB2      PRO 766  33.603 -14.517   2.622
    3    HB3  PRO 766           HB3      PRO 766  33.721 -15.405   4.143
    4    HG2  PRO 766           HG2      PRO 766  35.491 -15.478   1.757
    5    HG3  PRO 766           HG3      PRO 766  35.905 -15.667   3.467
    6    HD2  PRO 766           HD2      PRO 766  35.728 -17.717   1.673
    7    HD3  PRO 766           HD3      PRO 766  35.487 -17.940   3.408

  No H/Q in entry =           7
  In of MODEL   35
    1    H    ALA 767           H        ALA 767  33.817 -16.387   0.183
    2    HA   ALA 767           HA       ALA 767  31.270 -15.630  -1.002
    3    HB3  ALA 767           HB1      ALA 767  32.363 -13.986  -2.425
    4    HB2  ALA 767           HB2      ALA 767  33.908 -14.319  -1.642
    5    HB1  ALA 767           HB3      ALA 767  32.598 -13.578  -0.726

  No H/Q in entry =           5
  In of MODEL   35
    1    H    SER 768           H        SER 768  30.750 -16.845  -2.557
    2    HA   SER 768           HA       SER 768  32.821 -18.082  -4.210
    3    HB2  SER 768           HB2      SER 768  30.263 -19.385  -3.247
    4    HB3  SER 768           HB3      SER 768  31.531 -20.128  -4.230
    5    HG   SER 768           HG       SER 768  32.699 -19.121  -2.129

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA 769           H        ALA 769  30.317 -15.942  -4.044
    2    HA   ALA 769           HA       ALA 769  29.741 -16.054  -6.848
    3    HB1  ALA 769           HB1      ALA 769  28.104 -17.628  -5.926
    4    HB3  ALA 769           HB2      ALA 769  27.315 -16.169  -6.518
    5    HB2  ALA 769           HB3      ALA 769  27.559 -16.399  -4.785

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLU 770           H        GLU 770  27.575 -14.317  -6.802
    2    HA   GLU 770           HA       GLU 770  28.868 -11.855  -6.326
    3    HB2  GLU 770           HB2      GLU 770  26.761 -10.853  -7.143
    4    HB3  GLU 770           HB3      GLU 770  27.365 -12.113  -8.205
    5    HG2  GLU 770           HG2      GLU 770  25.739 -13.679  -7.216
    6    HG3  GLU 770           HG3      GLU 770  25.106 -12.359  -6.237

  No H/Q in entry =           6
  In of MODEL   35
    1    H    LYS 771           H        LYS 771  28.115 -10.136  -5.009
    2    HA   LYS 771           HA       LYS 771  27.274 -11.097  -2.369
    3    HB2  LYS 771           HB2      LYS 771  28.729  -8.596  -3.219
    4    HB3  LYS 771           HB3      LYS 771  28.303  -9.016  -1.577
    5    HG2  LYS 771           HG2      LYS 771  30.168 -10.630  -3.316
    6    HG3  LYS 771           HG3      LYS 771  30.683  -9.417  -2.154
    7    HD2  LYS 771           HD2      LYS 771  30.922 -11.350  -0.929
    8    HD3  LYS 771           HD3      LYS 771  29.304 -10.863  -0.457
    9    HE2  LYS 771           HE2      LYS 771  28.429 -12.513  -2.195
   10    HE3  LYS 771           HE3      LYS 771  30.091 -12.986  -2.450
   11    HZ3  LYS 771           HZ1      LYS 771  28.964 -14.458  -0.911
   12    HZ2  LYS 771           HZ2      LYS 771  28.645 -13.173   0.109
   13    HZ1  LYS 771           HZ3      LYS 771  30.229 -13.660  -0.105

  No H/Q in entry =          13
  In of MODEL   35
    1    H    ALA 772           H        ALA 772  26.317  -9.063  -1.112
    2    HA   ALA 772           HA       ALA 772  23.883  -8.355  -2.572
    3    HB1  ALA 772           HB1      ALA 772  22.983  -7.806  -0.360
    4    HB2  ALA 772           HB2      ALA 772  24.549  -8.179   0.364
    5    HB3  ALA 772           HB3      ALA 772  23.608  -9.455  -0.414

  No H/Q in entry =           5
  In of MODEL   35
    1    H    CYS 773           H        CYS 773  22.983  -6.083  -1.757
    2    HA   CYS 773           HA       CYS 773  24.730  -4.143  -2.830
    3    HB2  CYS 773           HB2      CYS 773  22.251  -3.951  -2.915
    4    HB3  CYS 773           HB3      CYS 773  22.230  -3.710  -1.175

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLY 774           H        GLY 774  26.314  -3.081  -1.903
    2    HA3  GLY 774           HA2      GLY 774  27.085  -1.710  -0.062
    3    HA2  GLY 774           HA3      GLY 774  26.314  -2.856   1.035

  No H/Q in entry =           3
  In of MODEL   35
    1    H    ALA 775           H        ALA 775  27.321  -5.021  -0.847
    2    HA   ALA 775           HA       ALA 775  30.095  -5.018   0.078
    3    HB2  ALA 775           HB1      ALA 775  29.891  -7.483   0.205
    4    HB1  ALA 775           HB2      ALA 775  28.182  -7.343  -0.218
    5    HB3  ALA 775           HB3      ALA 775  28.771  -6.674   1.301

  No H/Q in entry =           5
  In of MODEL   35
    1    H    CYS 776           H        CYS 776  31.223  -4.548  -1.679
    2    HA   CYS 776           HA       CYS 776  30.476  -5.909  -4.158
    3    HB2  CYS 776           HB2      CYS 776  31.557  -3.103  -3.920
    4    HB3  CYS 776           HB3      CYS 776  31.107  -3.950  -5.401

  No H/Q in entry =           4
  In of MODEL   35
    1    HA   PRO 777           HA       PRO 777  34.926  -6.768  -4.027
    2    HB2  PRO 777           HB2      PRO 777  34.454  -8.643  -6.179
    3    HB3  PRO 777           HB3      PRO 777  34.888  -9.013  -4.510
    4    HG2  PRO 777           HG2      PRO 777  32.455  -9.627  -5.633
    5    HG3  PRO 777           HG3      PRO 777  32.716  -9.381  -3.897
    6    HD2  PRO 777           HD2      PRO 777  31.599  -7.498  -5.932
    7    HD3  PRO 777           HD3      PRO 777  31.098  -7.783  -4.246

  No H/Q in entry =           7
  In of MODEL   35
    1    H    LEU 778           H        LEU 778  36.468  -6.879  -6.014
    2    HA   LEU 778           HA       LEU 778  36.361  -4.594  -7.539
    3    HB2  LEU 778           HB2      LEU 778  38.101  -5.573  -8.985
    4    HB3  LEU 778           HB3      LEU 778  38.412  -5.790  -7.275
    5    HG   LEU 778           HG       LEU 778  37.246  -8.001  -8.980
    6   HD11  LEU 778          HD11      LEU 778  39.388  -7.360  -9.965
    7   HD13  LEU 778          HD12      LEU 778  39.473  -8.935  -9.169
    8   HD12  LEU 778          HD13      LEU 778  40.164  -7.520  -8.385
    9   HD23  LEU 778          HD21      LEU 778  38.242  -9.432  -7.226
   10   HD22  LEU 778          HD22      LEU 778  36.985  -8.369  -6.623
   11   HD21  LEU 778          HD23      LEU 778  38.686  -7.973  -6.337

  No H/Q in entry =          11
  In of MODEL   35
    1    H    TRP 779           H        TRP 779  35.116  -7.757  -8.400
    2    HA   TRP 779           HA       TRP 779  34.311  -6.872 -11.039
    3    HB2  TRP 779           HB2      TRP 779  33.495  -9.304 -11.201
    4    HB3  TRP 779           HB3      TRP 779  35.232  -9.028 -11.108
    5    HD1  TRP 779           HD1      TRP 779  32.342  -9.959  -8.656
    6    HE1  TRP 779           HE1      TRP 779  33.278 -11.555  -6.899
    7    HE3  TRP 779           HE3      TRP 779  37.183 -10.015 -10.167
    8    HZ2  TRP 779           HZ2      TRP 779  35.887 -12.766  -6.250
    9    HZ3  TRP 779           HZ3      TRP 779  38.815 -11.428  -8.905
   10    HH2  TRP 779           HH2      TRP 779  38.146 -12.700  -7.027

  No H/Q in entry =          10
  In of MODEL   35
    1    H    GLY 780           H        GLY 780  32.984  -6.274  -8.204
    2    HA3  GLY 780           HA2      GLY 780  30.269  -6.653  -9.251
    3    HA2  GLY 780           HA3      GLY 780  30.622  -6.976  -7.559

  No H/Q in entry =           3
  In of MODEL   35
    1    H    LYS 781           H        LYS 781  28.803  -5.018  -8.721
    2    HA   LYS 781           HA       LYS 781  29.741  -2.776  -7.189
    3    HB2  LYS 781           HB2      LYS 781  30.741  -2.509  -9.500
    4    HB3  LYS 781           HB3      LYS 781  29.103  -2.421 -10.124
    5    HG2  LYS 781           HG2      LYS 781  30.030  -0.217  -9.907
    6    HG3  LYS 781           HG3      LYS 781  28.721  -0.427  -8.738
    7    HD2  LYS 781           HD2      LYS 781  30.356  -0.889  -6.981
    8    HD3  LYS 781           HD3      LYS 781  31.666  -0.700  -8.147
    9    HE2  LYS 781           HE2      LYS 781  29.680   1.401  -7.341
   10    HE3  LYS 781           HE3      LYS 781  31.339   1.281  -6.760
   11    HZ2  LYS 781           HZ1      LYS 781  30.492   1.822  -9.567
   12    HZ1  LYS 781           HZ2      LYS 781  32.086   1.594  -9.061
   13    HZ3  LYS 781           HZ3      LYS 781  31.204   2.895  -8.479

  No H/Q in entry =          13
  In of MODEL   35
    1    H    CYS 782           H        CYS 782  27.930  -1.643  -6.419
    2    HA   CYS 782           HA       CYS 782  25.354  -2.584  -7.377
    3    HB2  CYS 782           HB2      CYS 782  25.984  -0.600  -5.167
    4    HB3  CYS 782           HB3      CYS 782  24.411  -1.314  -5.497

  No H/Q in entry =           4
  In of MODEL   35
    1    H    ASP 783           H        ASP 783  24.988  -1.665  -9.304
    2    HA   ASP 783           HA       ASP 783  25.785   1.079  -9.743
    3    HB2  ASP 783           HB2      ASP 783  24.807  -1.047 -11.624
    4    HB3  ASP 783           HB3      ASP 783  24.769   0.642 -12.100

  No H/Q in entry =           4
  In of MODEL   35
    1    H    ALA 784           H        ALA 784  24.603   2.529  -9.013
    2    HA   ALA 784           HA       ALA 784  22.975   4.031  -8.846
    3    HB3  ALA 784           HB1      ALA 784  22.520   3.600 -11.224
    4    HB2  ALA 784           HB2      ALA 784  21.066   4.045 -10.324
    5    HB1  ALA 784           HB3      ALA 784  21.356   2.362 -10.761

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLU 785           H        GLU 785  21.275   0.914  -8.971
    2    HA   GLU 785           HA       GLU 785  20.179   1.482  -6.354
    3    HB2  GLU 785           HB2      GLU 785  17.851   1.250  -7.098
    4    HB3  GLU 785           HB3      GLU 785  18.642   2.615  -7.864
    5    HG2  GLU 785           HG2      GLU 785  18.949   1.318  -9.899
    6    HG3  GLU 785           HG3      GLU 785  18.175  -0.070  -9.138

  No H/Q in entry =           6
  In of MODEL   35
    1    H    SER 786           H        SER 786  18.136  -0.445  -6.452
    2    HA   SER 786           HA       SER 786  17.588  -2.568  -6.289
    3    HB2  SER 786           HB2      SER 786  20.201  -3.295  -7.663
    4    HB3  SER 786           HB3      SER 786  18.874  -4.406  -7.314
    5    HG   SER 786           HG       SER 786  18.826  -2.138  -8.993

  No H/Q in entry =           5
  In of MODEL   35
    1    H    SER 787           H        SER 787  18.021  -4.453  -4.900
    2    HA   SER 787           HA       SER 787  19.528  -3.566  -2.582
    3    HB2  SER 787           HB2      SER 787  17.692  -5.952  -2.898
    4    HB3  SER 787           HB3      SER 787  18.185  -5.163  -1.400
    5    HG   SER 787           HG       SER 787  16.874  -3.512  -1.786

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LYS 788           H        LYS 788  20.631  -4.773  -5.127
    2    HA   LYS 788           HA       LYS 788  22.060  -7.034  -3.940
    3    HB2  LYS 788           HB2      LYS 788  22.141  -8.064  -6.100
    4    HB3  LYS 788           HB3      LYS 788  20.461  -7.864  -5.598
    5    HG2  LYS 788           HG2      LYS 788  20.285  -5.947  -7.105
    6    HG3  LYS 788           HG3      LYS 788  21.977  -6.133  -7.547
    7    HD2  LYS 788           HD2      LYS 788  19.893  -8.243  -7.946
    8    HD3  LYS 788           HD3      LYS 788  20.290  -7.058  -9.196
    9    HE2  LYS 788           HE2      LYS 788  21.523  -8.999  -9.792
   10    HE3  LYS 788           HE3      LYS 788  22.702  -7.975  -8.991
   11    HZ2  LYS 788           HZ1      LYS 788  22.898 -10.266  -8.301
   12    HZ1  LYS 788           HZ2      LYS 788  21.317 -10.323  -7.760
   13    HZ3  LYS 788           HZ3      LYS 788  22.464  -9.365  -6.981

  No H/Q in entry =          13
  In of MODEL   35
    1    H    CYS 789           H        CYS 789  24.084  -7.441  -5.179
    2    HA   CYS 789           HA       CYS 789  25.309  -4.995  -6.195
    3    HB2  CYS 789           HB2      CYS 789  26.501  -6.025  -4.286
    4    HB3  CYS 789           HB3      CYS 789  26.463  -7.587  -5.085

  No H/Q in entry =           4
  In of MODEL   35
    1    H    VAL 790           H        VAL 790  25.927  -5.116  -8.394
    2    HA   VAL 790           HA       VAL 790  25.080  -7.599  -9.639
    3    HB   VAL 790           HB       VAL 790  23.900  -5.512 -10.390
    4   HG11  VAL 790          HG11      VAL 790  25.672  -3.901 -10.250
    5   HG13  VAL 790          HG12      VAL 790  25.005  -3.930 -11.882
    6   HG12  VAL 790          HG13      VAL 790  26.551  -4.709 -11.548
    7   HG23  VAL 790          HG21      VAL 790  24.048  -5.924 -12.820
    8   HG22  VAL 790          HG22      VAL 790  23.910  -7.410 -11.881
    9   HG21  VAL 790          HG23      VAL 790  25.473  -6.925 -12.540

  No H/Q in entry =           9
  In of MODEL   35
    1    H    CYS 791           H        CYS 791  26.419  -8.531 -11.192
    2    HA   CYS 791           HA       CYS 791  29.208  -7.904 -10.677
    3    HB2  CYS 791           HB2      CYS 791  29.594 -10.183 -11.736
    4    HB3  CYS 791           HB3      CYS 791  28.727 -10.135 -10.198

  No H/Q in entry =           4
  In of MODEL   35
    1    H    ARG 792           H        ARG 792  30.521  -7.208 -12.105
    2    HA   ARG 792           HA       ARG 792  29.450  -6.453 -14.707
    3    HB2  ARG 792           HB2      ARG 792  32.075  -5.714 -13.380
    4    HB3  ARG 792           HB3      ARG 792  31.385  -4.996 -14.829
    5    HG2  ARG 792           HG2      ARG 792  30.228  -4.792 -12.053
    6    HG3  ARG 792           HG3      ARG 792  31.134  -3.536 -12.886
    7    HD2  ARG 792           HD2      ARG 792  28.475  -4.690 -13.748
    8    HD3  ARG 792           HD3      ARG 792  28.737  -3.109 -13.017
    9    HE   ARG 792           HE       ARG 792  29.706  -3.932 -15.676
   10   HH11  ARG 792          HH11      ARG 792  28.481  -1.355 -13.473
   11   HH12  ARG 792          HH12      ARG 792  28.663  -0.138 -14.626
   12   HH21  ARG 792          HH21      ARG 792  29.821  -2.222 -17.252
   13   HH22  ARG 792          HH22      ARG 792  29.408  -0.615 -16.818

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLU 793           H        GLU 793  30.845  -6.901 -16.587
    2    HA   GLU 793           HA       GLU 793  31.795  -9.610 -16.386
    3    HB2  GLU 793           HB2      GLU 793  31.773  -7.748 -18.763
    4    HB3  GLU 793           HB3      GLU 793  32.226  -9.444 -18.824
    5    HG2  GLU 793           HG2      GLU 793  29.518  -8.328 -18.128
    6    HG3  GLU 793           HG3      GLU 793  29.970  -9.153 -19.616

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ALA 794           H        ALA 794  33.905 -10.013 -17.831
    2    HA   ALA 794           HA       ALA 794  35.993  -9.348 -16.085
    3    HB2  ALA 794           HB1      ALA 794  35.901 -11.416 -17.388
    4    HB3  ALA 794           HB2      ALA 794  37.413 -10.543 -17.634
    5    HB1  ALA 794           HB3      ALA 794  36.154 -10.489 -18.866

  No H/Q in entry =           5
  In of MODEL   35
    1    H    SER 795           H        SER 795  35.009  -8.107 -19.214
    2    HA   SER 795           HA       SER 795  37.288  -6.598 -19.682
    3    HB2  SER 795           HB2      SER 795  35.709  -5.547 -21.408
    4    HB3  SER 795           HB3      SER 795  36.032  -7.282 -21.529
    5    HG   SER 795           HG       SER 795  33.726  -6.365 -21.537

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLU 796           H        GLU 796  34.656  -6.099 -17.579
    2    HA   GLU 796           HA       GLU 796  34.808  -3.178 -17.723
    3    HB2  GLU 796           HB2      GLU 796  32.905  -4.915 -16.166
    4    HB3  GLU 796           HB3      GLU 796  32.766  -3.179 -16.419
    5    HG2  GLU 796           HG2      GLU 796  32.514  -3.619 -18.850
    6    HG3  GLU 796           HG3      GLU 796  32.517  -5.345 -18.495

  No H/Q in entry =           6
  In of MODEL   35
    1    H    CYS 797           H        CYS 797  36.278  -5.638 -16.118
    2    HA   CYS 797           HA       CYS 797  36.451  -4.141 -13.621
    3    HB2  CYS 797           HB2      CYS 797  35.835  -6.511 -13.436
    4    HB3  CYS 797           HB3      CYS 797  37.351  -6.943 -14.232

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLU 798           H        GLU 798  37.846  -2.629 -13.915
    2    HA   GLU 798           HA       GLU 798  40.287  -3.005 -15.458
    3    HB2  GLU 798           HB2      GLU 798  40.550  -0.556 -15.102
    4    HB3  GLU 798           HB3      GLU 798  39.050  -1.008 -15.901
    5    HG2  GLU 798           HG2      GLU 798  37.812  -0.685 -13.857
    6    HG3  GLU 798           HG3      GLU 798  39.300  -0.371 -12.967

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU 799           H        GLU 799  39.967  -4.285 -12.879
    2    HA   GLU 799           HA       GLU 799  41.788  -2.895 -11.100
    3    HB2  GLU 799           HB2      GLU 799  39.902  -4.194 -10.185
    4    HB3  GLU 799           HB3      GLU 799  40.565  -5.648 -10.909
    5    HG2  GLU 799           HG2      GLU 799  41.046  -5.527  -8.526
    6    HG3  GLU 799           HG3      GLU 799  42.519  -5.502  -9.496

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLU 800           H        GLU 800  41.657  -5.878 -12.941
    2    HA   GLU 800           HA       GLU 800  43.086  -7.353 -13.634
    3    HB2  GLU 800           HB2      GLU 800  44.944  -5.003 -13.799
    4    HB3  GLU 800           HB3      GLU 800  45.380  -6.608 -14.371
    5    HG2  GLU 800           HG2      GLU 800  43.408  -6.537 -15.873
    6    HG3  GLU 800           HG3      GLU 800  43.147  -4.869 -15.367

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLY 801           H        GLY 801  43.022  -8.597 -12.020
    2    HA3  GLY 801           HA2      GLY 801  44.990  -8.414  -9.883
    3    HA2  GLY 801           HA3      GLY 801  43.630  -9.540 -10.003

  No H/Q in entry =           3
  In of MODEL   35
    1    H    PHE 802           H        PHE 802  44.724 -11.308  -9.682
    2    HA   PHE 802           HA       PHE 802  47.139 -12.009 -11.106
    3    HB2  PHE 802           HB2      PHE 802  45.384 -13.605  -9.260
    4    HB3  PHE 802           HB3      PHE 802  46.883 -14.199  -9.966
    5    HD1  PHE 802           HD1      PHE 802  45.394 -11.989  -7.507
    6    HD2  PHE 802           HD2      PHE 802  49.021 -13.245  -9.315
    7    HE1  PHE 802           HE1      PHE 802  46.658 -10.946  -5.723
    8    HE2  PHE 802           HE2      PHE 802  50.255 -12.223  -7.531
    9    HZ   PHE 802           HZ       PHE 802  49.094 -11.067  -5.707

  No H/Q in entry =           9
  In of MODEL   35
    1    H    SER 803           H        SER 803  47.191 -14.370 -11.903
    2    HA   SER 803           HA       SER 803  44.937 -14.916 -13.636
    3    HB2  SER 803           HB2      SER 803  46.856 -15.992 -15.086
    4    HB3  SER 803           HB3      SER 803  46.597 -14.249 -15.169
    5    HG   SER 803           HG       SER 803  48.825 -15.019 -14.858

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ILE 804           H        ILE 804  44.151 -16.964 -13.403
    2    HA   ILE 804           HA       ILE 804  45.696 -18.790 -11.709
    3    HB   ILE 804           HB       ILE 804  43.793 -19.404 -10.348
    4   HG12  ILE 804          HG12      ILE 804  41.965 -18.941 -12.028
    5   HG13  ILE 804          HG13      ILE 804  41.610 -18.369 -10.411
    6   HG22  ILE 804          HG21      ILE 804  44.177 -16.431 -10.362
    7   HG21  ILE 804          HG22      ILE 804  45.160 -17.621  -9.510
    8   HG23  ILE 804          HG23      ILE 804  43.474 -17.361  -9.037
    9   HD11  ILE 804          HD11      ILE 804  42.187 -16.081 -11.133
   10   HD13  ILE 804          HD12      ILE 804  40.862 -16.782 -12.064
   11   HD12  ILE 804          HD13      ILE 804  42.474 -16.693 -12.766

  No H/Q in entry =          11
  In of MODEL   35
    1    H    CYS 805           H        CYS 805  44.649 -20.989 -11.622
    2    HA   CYS 805           HA       CYS 805  43.866 -21.726 -14.327
    3    HB2  CYS 805           HB2      CYS 805  45.896 -22.798 -13.499
    4    HB3  CYS 805           HB3      CYS 805  45.039 -23.355 -12.068

  No H/Q in entry =           4
  In of MODEL   35
    1    H    VAL 806           H        VAL 806  41.732 -22.022 -14.508
    2    HA   VAL 806           HA       VAL 806  40.313 -23.231 -12.252
    3    HB   VAL 806           HB       VAL 806  39.791 -20.783 -12.545
    4   HG12  VAL 806          HG11      VAL 806  38.538 -20.075 -14.471
    5   HG11  VAL 806          HG12      VAL 806  38.890 -21.639 -15.227
    6   HG13  VAL 806          HG13      VAL 806  40.201 -20.545 -14.810
    7   HG22  VAL 806          HG21      VAL 806  37.370 -20.974 -12.555
    8   HG21  VAL 806          HG22      VAL 806  38.056 -22.314 -11.631
    9   HG23  VAL 806          HG23      VAL 806  37.478 -22.584 -13.263

  No H/Q in entry =           9
  In of MODEL   35
    1    H    GLU 807           H        GLU 807  38.824 -24.833 -12.811
    2    HA   GLU 807           HA       GLU 807  39.089 -25.816 -15.517
    3    HB2  GLU 807           HB2      GLU 807  39.345 -27.396 -13.584
    4    HB3  GLU 807           HB3      GLU 807  37.656 -27.118 -13.192
    5    HG2  GLU 807           HG2      GLU 807  37.059 -27.905 -15.471
    6    HG3  GLU 807           HG3      GLU 807  38.761 -28.312 -15.693

  No H/Q in entry =           6
  In of MODEL   35
    1    H    VAL 808           H        VAL 808  37.806 -24.810 -16.908
    2    HA   VAL 808           HA       VAL 808  35.016 -24.672 -16.309
    3    HB   VAL 808           HB       VAL 808  34.849 -22.890 -17.736
    4   HG13  VAL 808          HG11      VAL 808  36.104 -21.077 -16.640
    5   HG12  VAL 808          HG12      VAL 808  37.148 -22.307 -15.924
    6   HG11  VAL 808          HG13      VAL 808  35.438 -22.257 -15.502
    7   HG23  VAL 808          HG21      VAL 808  36.725 -21.734 -18.902
    8   HG22  VAL 808          HG22      VAL 808  36.379 -23.385 -19.441
    9   HG21  VAL 808          HG23      VAL 808  37.776 -23.080 -18.403

  No H/Q in entry =           9
  In of MODEL   35
    1    H    ASN 809           H        ASN 809  33.765 -25.423 -18.065
    2    HA   ASN 809           HA       ASN 809  33.224 -26.407 -19.956
    3    HB2  ASN 809           HB2      ASN 809  35.962 -25.592 -20.798
    4    HB3  ASN 809           HB3      ASN 809  34.911 -26.488 -21.880
    5   HD21  ASN 809          HD21      ASN 809  35.995 -23.779 -21.982
    6   HD22  ASN 809          HD22      ASN 809  34.623 -22.739 -22.137

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLY 810           H        GLY 810  35.219 -27.718 -17.826
    2    HA3  GLY 810           HA2      GLY 810  35.715 -30.000 -17.442
    3    HA2  GLY 810           HA3      GLY 810  35.402 -30.321 -19.147

  No H/Q in entry =           3
  In of MODEL   35
    1    H    LYS 811           H        LYS 811  37.226 -27.603 -18.896
    2    HA   LYS 811           HA       LYS 811  39.789 -29.015 -19.302
    3    HB2  LYS 811           HB2      LYS 811  38.770 -26.408 -20.421
    4    HB3  LYS 811           HB3      LYS 811  40.345 -27.121 -20.716
    5    HG2  LYS 811           HG2      LYS 811  39.418 -28.861 -22.007
    6    HG3  LYS 811           HG3      LYS 811  37.776 -28.463 -21.490
    7    HD2  LYS 811           HD2      LYS 811  38.272 -27.661 -23.776
    8    HD3  LYS 811           HD3      LYS 811  37.875 -26.351 -22.665
    9    HE2  LYS 811           HE2      LYS 811  40.265 -25.895 -22.378
   10    HE3  LYS 811           HE3      LYS 811  40.654 -27.174 -23.518
   11    HZ2  LYS 811           HZ1      LYS 811  39.225 -24.631 -24.030
   12    HZ1  LYS 811           HZ2      LYS 811  39.287 -25.868 -25.160
   13    HZ3  LYS 811           HZ3      LYS 811  40.720 -25.110 -24.656

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLU 812           H        GLU 812  41.615 -27.689 -18.548
    2    HA   GLU 812           HA       GLU 812  40.797 -25.719 -16.538
    3    HB2  GLU 812           HB2      GLU 812  43.324 -27.376 -16.748
    4    HB3  GLU 812           HB3      GLU 812  43.143 -26.030 -15.626
    5    HG2  GLU 812           HG2      GLU 812  41.291 -27.161 -14.539
    6    HG3  GLU 812           HG3      GLU 812  41.413 -28.495 -15.678

  No H/Q in entry =           6
  In of MODEL   35
    1    H    GLN 813           H        GLN 813  41.332 -23.719 -16.731
    2    HA   GLN 813           HA       GLN 813  42.968 -22.956 -19.022
    3    HB2  GLN 813           HB2      GLN 813  40.697 -23.089 -19.805
    4    HB3  GLN 813           HB3      GLN 813  40.126 -22.154 -18.436
    5    HG2  GLN 813           HG2      GLN 813  41.316 -20.228 -19.249
    6    HG3  GLN 813           HG3      GLN 813  41.913 -21.151 -20.632
    7   HE21  GLN 813          HE21      GLN 813  40.198 -18.748 -20.587
    8   HE22  GLN 813          HE22      GLN 813  38.723 -19.188 -21.365

  No H/Q in entry =           8
  In of MODEL   35
    1    H    THR 814           H        THR 814  43.919 -20.970 -18.790
    2    HA   THR 814           HA       THR 814  43.979 -19.840 -16.102
    3    HB   THR 814           HB       THR 814  45.469 -19.092 -18.546
    4    HG1  THR 814           HG1      THR 814  45.939 -21.220 -17.950
    5   HG23  THR 814          HG21      THR 814  47.125 -18.102 -16.970
    6   HG22  THR 814          HG22      THR 814  46.049 -18.517 -15.636
    7   HG21  THR 814          HG23      THR 814  45.533 -17.353 -16.856

  No H/Q in entry =           7
  In of MODEL   35
    1    H    MET 815           H        MET 815  42.748 -18.248 -15.704
    2    HA   MET 815           HA       MET 815  42.305 -16.244 -17.759
    3    HB2  MET 815           HB2      MET 815  39.990 -15.934 -16.793
    4    HB3  MET 815           HB3      MET 815  40.240 -17.357 -17.786
    5    HG2  MET 815           HG2      MET 815  40.570 -18.651 -15.839
    6    HG3  MET 815           HG3      MET 815  40.203 -17.306 -14.776
    7    HE3  MET 815           HE1      MET 815  38.686 -18.668 -18.187
    8    HE2  MET 815           HE2      MET 815  37.269 -19.526 -17.555
    9    HE1  MET 815           HE3      MET 815  38.889 -20.034 -17.086

  No H/Q in entry =           9
  In of MODEL   35
    1    H    SER 816           H        SER 816  41.359 -14.248 -16.656
    2    HA   SER 816           HA       SER 816  43.321 -13.581 -14.666
    3    HB2  SER 816           HB2      SER 816  41.213 -11.943 -16.084
    4    HB3  SER 816           HB3      SER 816  42.441 -11.276 -15.015
    5    HG   SER 816           HG       SER 816  42.898 -12.717 -17.436

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLU 817           H        GLU 817  42.848 -12.718 -12.675
    2    HA   GLU 817           HA       GLU 817  41.080 -14.008 -11.025
    3    HB2  GLU 817           HB2      GLU 817  43.148 -12.359 -10.623
    4    HB3  GLU 817           HB3      GLU 817  41.825 -11.206 -10.480
    5    HG2  GLU 817           HG2      GLU 817  40.915 -12.341  -8.582
    6    HG3  GLU 817           HG3      GLU 817  42.034 -13.665  -8.809

  No H/Q in entry =           6
  In of MODEL   35
    1    H    CYS 818           H        CYS 818  40.800 -10.862 -12.553
    2    HA   CYS 818           HA       CYS 818  38.356  -9.986 -11.608
    3    HB2  CYS 818           HB2      CYS 818  39.451  -9.505 -14.379
    4    HB3  CYS 818           HB3      CYS 818  38.350  -8.476 -13.468

  No H/Q in entry =           4
  In of MODEL   35
    1    H    GLU 819           H        GLU 819  39.100 -12.194 -14.232
    2    HA   GLU 819           HA       GLU 819  36.469 -12.167 -15.362
    3    HB2  GLU 819           HB2      GLU 819  38.431 -12.441 -16.778
    4    HB3  GLU 819           HB3      GLU 819  38.873 -13.891 -15.900
    5    HG2  GLU 819           HG2      GLU 819  37.093 -15.103 -16.800
    6    HG3  GLU 819           HG3      GLU 819  36.297 -13.635 -17.382

  No H/Q in entry =           6
  In of MODEL   35
    1    H    ALA 820           H        ALA 820  38.501 -14.618 -13.802
    2    HA   ALA 820           HA       ALA 820  36.658 -16.646 -13.640
    3    HB2  ALA 820           HB1      ALA 820  37.988 -17.538 -11.774
    4    HB3  ALA 820           HB2      ALA 820  38.820 -15.985 -11.645
    5    HB1  ALA 820           HB3      ALA 820  38.988 -16.962 -13.105

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLY 821           H        GLY 821  37.194 -13.922 -11.453
    2    HA3  GLY 821           HA2      GLY 821  35.376 -14.700  -9.422
    3    HA2  GLY 821           HA3      GLY 821  36.009 -13.081  -9.689

  No H/Q in entry =           3
  In of MODEL   35
    1    H    ALA 822           H        ALA 822  35.022 -12.512 -12.193
    2    HA   ALA 822           HA       ALA 822  32.375 -11.803 -11.588
    3    HB2  ALA 822           HB1      ALA 822  33.791 -10.545 -13.136
    4    HB3  ALA 822           HB2      ALA 822  32.233 -10.995 -13.830
    5    HB1  ALA 822           HB3      ALA 822  33.700 -11.883 -14.293

  No H/Q in entry =           5
  In of MODEL   35
    1    H    LEU 823           H        LEU 823  33.781 -14.465 -13.345
    2    HA   LEU 823           HA       LEU 823  31.418 -15.498 -14.419
    3    HB2  LEU 823           HB2      LEU 823  33.922 -16.953 -13.585
    4    HB3  LEU 823           HB3      LEU 823  32.636 -17.683 -14.521
    5    HG   LEU 823           HG       LEU 823  34.410 -15.395 -15.387
    6   HD11  LEU 823          HD11      LEU 823  35.533 -17.538 -15.403
    7   HD13  LEU 823          HD12      LEU 823  35.259 -16.941 -17.033
    8   HD12  LEU 823          HD13      LEU 823  34.234 -18.225 -16.384
    9   HD22  LEU 823          HD21      LEU 823  32.202 -15.072 -16.322
   10   HD21  LEU 823          HD22      LEU 823  32.142 -16.746 -16.857
   11   HD23  LEU 823          HD23      LEU 823  33.300 -15.628 -17.581

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ARG 824           H        ARG 824  33.012 -16.181 -11.306
    2    HA   ARG 824           HA       ARG 824  31.213 -18.084 -10.251
    3    HB2  ARG 824           HB2      ARG 824  32.358 -15.817  -8.608
    4    HB3  ARG 824           HB3      ARG 824  31.827 -17.374  -8.025
    5    HG2  ARG 824           HG2      ARG 824  33.791 -18.346  -9.329
    6    HG3  ARG 824           HG3      ARG 824  34.312 -16.677  -9.534
    7    HD2  ARG 824           HD2      ARG 824  33.831 -18.079  -6.915
    8    HD3  ARG 824           HD3      ARG 824  35.398 -17.691  -7.617
    9    HE   ARG 824           HE       ARG 824  34.039 -15.311  -7.427
   10   HH11  ARG 824          HH11      ARG 824  35.130 -17.802  -5.154
   11   HH12  ARG 824          HH12      ARG 824  35.302 -16.731  -3.838
   12   HH21  ARG 824          HH21      ARG 824  34.428 -13.795  -5.534
   13   HH22  ARG 824          HH22      ARG 824  35.011 -14.494  -4.088

  No H/Q in entry =          13
  In of MODEL   35
    1    H    CYS 825           H        CYS 825  31.184 -14.646 -10.253
    2    HA   CYS 825           HA       CYS 825  28.920 -14.285  -8.676
    3    HB2  CYS 825           HB2      CYS 825  30.481 -12.547 -10.490
    4    HB3  CYS 825           HB3      CYS 825  29.075 -11.929  -9.651

  No H/Q in entry =           4
  In of MODEL   35
    1    H    ARG 826           H        ARG 826  29.263 -14.186 -12.262
    2    HA   ARG 826           HA       ARG 826  26.561 -13.369 -12.527
    3    HB2  ARG 826           HB2      ARG 826  26.794 -13.528 -14.869
    4    HB3  ARG 826           HB3      ARG 826  28.303 -12.858 -14.233
    5    HG2  ARG 826           HG2      ARG 826  29.366 -14.954 -14.567
    6    HG3  ARG 826           HG3      ARG 826  27.850 -15.700 -15.106
    7    HD2  ARG 826           HD2      ARG 826  27.845 -13.720 -16.820
    8    HD3  ARG 826           HD3      ARG 826  29.572 -13.664 -16.479
    9    HE   ARG 826           HE       ARG 826  28.436 -16.222 -17.196
   10   HH11  ARG 826          HH11      ARG 826  30.258 -13.317 -18.312
   11   HH12  ARG 826          HH12      ARG 826  30.801 -14.065 -19.728
   12   HH21  ARG 826          HH21      ARG 826  29.124 -17.151 -19.296
   13   HH22  ARG 826          HH22      ARG 826  30.126 -16.247 -20.323

  No H/Q in entry =          13
  In of MODEL   35
    1    H    GLY 827           H        GLY 827  27.946 -16.445 -12.117
    2    HA3  GLY 827           HA2      GLY 827  26.148 -18.118 -11.549
    3    HA2  GLY 827           HA3      GLY 827  25.411 -17.576 -13.058

  No H/Q in entry =           3
  In of MODEL   35
    1    H    GLN 828           H        GLN 828  28.377 -17.408 -13.923
    2    HA   GLN 828           HA       GLN 828  28.417 -19.834 -15.383
    3    HB2  GLN 828           HB2      GLN 828  29.662 -17.856 -16.141
    4    HB3  GLN 828           HB3      GLN 828  30.676 -17.945 -14.717
    5    HG2  GLN 828           HG2      GLN 828  31.879 -18.797 -16.649
    6    HG3  GLN 828           HG3      GLN 828  31.580 -20.084 -15.490
    7   HE21  GLN 828          HE21      GLN 828  29.065 -18.916 -17.639
    8   HE22  GLN 828          HE22      GLN 828  29.026 -20.330 -18.618

  No H/Q in entry =           8
  In of MODEL   35
    1    H    SER 829           H        SER 829  28.899 -21.782 -14.752
    2    HA   SER 829           HA       SER 829  29.870 -22.250 -12.108
    3    HB2  SER 829           HB2      SER 829  29.186 -24.203 -14.316
    4    HB3  SER 829           HB3      SER 829  29.425 -24.592 -12.613
    5    HG   SER 829           HG       SER 829  27.234 -24.391 -13.182

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ILE 830           H        ILE 830  31.902 -22.404 -11.630
    2    HA   ILE 830           HA       ILE 830  33.856 -23.352 -13.573
    3    HB   ILE 830           HB       ILE 830  35.454 -21.605 -13.033
    4   HG12  ILE 830          HG12      ILE 830  34.662 -21.191 -10.665
    5   HG13  ILE 830          HG13      ILE 830  35.083 -19.739 -11.555
    6   HG22  ILE 830          HG21      ILE 830  32.855 -20.299 -13.772
    7   HG21  ILE 830          HG22      ILE 830  33.946 -21.104 -14.887
    8   HG23  ILE 830          HG23      ILE 830  34.461 -19.631 -14.056
    9   HD13  ILE 830          HD11      ILE 830  32.861 -19.062 -11.706
   10   HD12  ILE 830          HD12      ILE 830  32.923 -19.789 -10.078
   11   HD11  ILE 830          HD13      ILE 830  32.257 -20.673 -11.425

  No H/Q in entry =          11
  In of MODEL   35
    1    H    SER 831           H        SER 831  35.706 -24.251 -12.561
    2    HA   SER 831           HA       SER 831  35.354 -24.779  -9.703
    3    HB2  SER 831           HB2      SER 831  36.381 -26.504 -11.919
    4    HB3  SER 831           HB3      SER 831  36.361 -26.954 -10.220
    5    HG   SER 831           HG       SER 831  34.594 -27.802 -11.257

  No H/Q in entry =           5
  In of MODEL   35
    1    H    VAL 832           H        VAL 832  36.923 -23.378  -8.850
    2    HA   VAL 832           HA       VAL 832  39.403 -22.982 -10.214
    3    HB   VAL 832           HB       VAL 832  38.588 -21.145  -8.869
    4   HG12  VAL 832          HG11      VAL 832  38.502 -21.202  -6.408
    5   HG11  VAL 832          HG12      VAL 832  38.867 -22.927  -6.451
    6   HG13  VAL 832          HG13      VAL 832  37.361 -22.328  -7.144
    7   HG22  VAL 832          HG21      VAL 832  40.591 -20.609  -7.528
    8   HG21  VAL 832          HG22      VAL 832  40.997 -21.279  -9.110
    9   HG23  VAL 832          HG23      VAL 832  41.109 -22.289  -7.671

  No H/Q in entry =           9
  In of MODEL   35
    1    H    THR 833           H        THR 833  40.911 -24.413 -10.429
    2    HA   THR 833           HA       THR 833  41.121 -26.526  -8.512
    3    HB   THR 833           HB       THR 833  42.731 -27.443 -10.250
    4    HG1  THR 833           HG1      THR 833  42.788 -26.419 -12.242
    5   HG23  THR 833          HG21      THR 833  40.385 -28.159 -10.197
    6   HG22  THR 833          HG22      THR 833  40.937 -28.014 -11.870
    7   HG21  THR 833          HG23      THR 833  39.930 -26.758 -11.162

  No H/Q in entry =           7
  In of MODEL   35
    1    H    SER 834           H        SER 834  42.947 -23.740  -9.697
    2    HA   SER 834           HA       SER 834  44.682 -23.939  -7.415
    3    HB2  SER 834           HB2      SER 834  45.788 -25.430  -9.025
    4    HB3  SER 834           HB3      SER 834  45.844 -24.126 -10.209
    5    HG   SER 834           HG       SER 834  47.385 -24.623  -8.011

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ILE 835           H        ILE 835  45.994 -22.106  -7.169
    2    HA   ILE 835           HA       ILE 835  44.849 -19.675  -8.348
    3    HB   ILE 835           HB       ILE 835  45.935 -18.496  -6.500
    4   HG12  ILE 835          HG12      ILE 835  46.606 -20.011  -4.485
    5   HG13  ILE 835          HG13      ILE 835  46.893 -21.240  -5.704
    6   HG22  ILE 835          HG21      ILE 835  44.191 -20.767  -5.682
    7   HG21  ILE 835          HG22      ILE 835  43.678 -19.198  -6.311
    8   HG23  ILE 835          HG23      ILE 835  44.493 -19.302  -4.740
    9   HD12  ILE 835          HD11      ILE 835  48.254 -18.583  -5.488
   10   HD11  ILE 835          HD12      ILE 835  48.561 -19.800  -6.733
   11   HD13  ILE 835          HD13      ILE 835  48.929 -20.150  -5.035

  No H/Q in entry =          11
  In of MODEL   35
    1    H    ARG 836           H        ARG 836  47.115 -21.706  -9.145
    2    HA   ARG 836           HA       ARG 836  49.136 -19.747  -9.908
    3    HB2  ARG 836           HB2      ARG 836  49.063 -22.755 -10.290
    4    HB3  ARG 836           HB3      ARG 836  50.403 -21.703 -10.688
    5    HG2  ARG 836           HG2      ARG 836  49.367 -22.326  -7.931
    6    HG3  ARG 836           HG3      ARG 836  50.853 -22.924  -8.666
    7    HD2  ARG 836           HD2      ARG 836  50.201 -20.069  -7.949
    8    HD3  ARG 836           HD3      ARG 836  51.347 -21.124  -7.132
    9    HE   ARG 836           HE       ARG 836  51.859 -20.625  -9.939
   10   HH11  ARG 836          HH11      ARG 836  52.759 -19.912  -6.578
   11   HH12  ARG 836          HH12      ARG 836  54.055 -18.904  -7.017
   12   HH21  ARG 836          HH21      ARG 836  53.655 -19.210 -10.509
   13   HH22  ARG 836          HH22      ARG 836  54.571 -18.511  -9.246

  No H/Q in entry =          13
  In of MODEL   35
    1    HA   PRO 837           HA       PRO 837  47.167 -19.767 -13.965
    2    HB2  PRO 837           HB2      PRO 837  49.723 -19.077 -15.185
    3    HB3  PRO 837           HB3      PRO 837  48.284 -18.076 -15.025
    4    HG2  PRO 837           HG2      PRO 837  50.611 -17.628 -13.671
    5    HG3  PRO 837           HG3      PRO 837  49.020 -17.107 -13.103
    6    HD2  PRO 837           HD2      PRO 837  50.694 -19.400 -12.219
    7    HD3  PRO 837           HD3      PRO 837  49.579 -18.372 -11.290

  No H/Q in entry =           7
  In of MODEL   35
    1    H    CYS 838           H        CYS 838  47.076 -21.313 -15.661
    2    HA   CYS 838           HA       CYS 838  49.090 -23.345 -15.366
    3    HB2  CYS 838           HB2      CYS 838  47.547 -24.826 -16.675
    4    HB3  CYS 838           HB3      CYS 838  46.845 -24.284 -15.173

  No H/Q in entry =           4
  In of MODEL   35
    1    H    ALA 839           H        ALA 839  49.462 -24.485 -17.723
    2    HA   ALA 839           HA       ALA 839  50.477 -22.387 -19.399
    3    HB3  ALA 839           HB1      ALA 839  51.370 -24.240 -20.764
    4    HB1  ALA 839           HB2      ALA 839  50.471 -25.382 -19.763
    5    HB2  ALA 839           HB3      ALA 839  51.769 -24.431 -19.057

  No H/Q in entry =           5
  In of MODEL   35
    1    H    ALA 840           H        ALA 840  47.581 -23.876 -19.043
    2    HA   ALA 840           HA       ALA 840  46.760 -23.916 -21.783
    3    HB2  ALA 840           HB1      ALA 840  45.244 -24.204 -19.216
    4    HB3  ALA 840           HB2      ALA 840  45.751 -25.501 -20.304
    5    HB1  ALA 840           HB3      ALA 840  44.508 -24.341 -20.808

  No H/Q in entry =           5
  In of MODEL   35
    1    H    GLU 841           H        GLU 841  47.271 -21.875 -22.351
    2    HA   GLU 841           HA       GLU 841  45.329 -19.807 -21.555
    3    HB2  GLU 841           HB2      GLU 841  47.029 -18.190 -22.445
    4    HB3  GLU 841           HB3      GLU 841  47.578 -19.105 -21.044
    5    HG2  GLU 841           HG2      GLU 841  48.834 -20.604 -22.484
    6    HG3  GLU 841           HG3      GLU 841  48.234 -19.757 -23.904

  No H/Q in entry =           6
  In of MODEL   35
    1    H    THR 842           H        THR 842  46.578 -21.698 -24.031
    2    HA   THR 842           HA       THR 842  44.789 -20.497 -26.056
    3    HB   THR 842           HB       THR 842  47.490 -21.719 -26.717
    4    HG1  THR 842           HG1      THR 842  46.943 -18.950 -26.314
    5   HG22  THR 842          HG21      THR 842  45.801 -19.657 -28.148
    6   HG21  THR 842          HG22      THR 842  45.816 -21.373 -28.518
    7   HG23  THR 842          HG23      THR 842  47.275 -20.410 -28.763

  No H/Q in entry =           7
  In of MODEL   35
    1    H    GLN 843           H        GLN 843  44.697 -22.790 -24.120
    2    HA   GLN 843           HA       GLN 843  44.660 -25.040 -25.981
    3    HB2  GLN 843           HB2      GLN 843  45.268 -25.084 -23.018
    4    HB3  GLN 843           HB3      GLN 843  45.169 -26.490 -24.061
    5    HG2  GLN 843           HG2      GLN 843  47.200 -24.275 -24.299
    6    HG3  GLN 843           HG3      GLN 843  47.483 -25.860 -23.583
    7   HE21  GLN 843          HE21      GLN 843  48.784 -24.564 -25.877
    8   HE22  GLN 843          HE22      GLN 843  48.571 -25.681 -27.176

  No H/Q in entry =           8
  In of MODEL   36
    1    H1   GLY 689           H2       GLY 689  63.965   6.607  -1.349
    2    H2   GLY 689           H1       GLY 689  64.167   5.607  -2.656
    3    H3   GLY 689           H3       GLY 689  65.520   6.359  -1.975
    4    HA2  GLY 689           HA2      GLY 689  64.806   7.426  -4.052
    5    HA3  GLY 689           HA3      GLY 689  64.654   8.510  -2.667

  No H/Q in entry =           5
  In of MODEL   36
    1    H    SER 690           H        SER 690  62.773   9.500  -2.435
    2    HA   SER 690           HA       SER 690  60.324   8.126  -2.627
    3    HB2  SER 690           HB2      SER 690  60.867  11.071  -2.370
    4    HB3  SER 690           HB3      SER 690  59.391  10.218  -1.928
    5    HG   SER 690           HG       SER 690  60.542   9.101  -0.357

  No H/Q in entry =           5
  In of MODEL   36
    1    H    HIS 691           H        HIS 691  59.141   7.805  -4.410
    2    HA   HIS 691           HA       HIS 691  59.263   9.802  -6.546
    3    HB2  HIS 691           HB2      HIS 691  58.687   6.824  -6.740
    4    HB3  HIS 691           HB3      HIS 691  58.412   7.953  -8.053
    5    HD1  HIS 691           HD1      HIS 691  60.501   8.755  -9.377
    6    HD2  HIS 691           HD2      HIS 691  61.385   6.165  -6.253
    7    HE1  HIS 691           HE1      HIS 691  62.848   7.998  -9.771
    8    HE2  HIS 691           HE2      HIS 691  63.302   6.318  -7.949

  No H/Q in entry =           8
  In of MODEL   36
    1    H    MET 692           H        MET 692  57.417  10.893  -6.788
    2    HA   MET 692           HA       MET 692  55.177   9.997  -5.201
    3    HB2  MET 692           HB2      MET 692  54.141  12.186  -5.686
    4    HB3  MET 692           HB3      MET 692  55.723  12.348  -4.959
    5    HG2  MET 692           HG2      MET 692  55.154  12.646  -7.903
    6    HG3  MET 692           HG3      MET 692  55.235  13.984  -6.763
    7    HE2  MET 692           HE1      MET 692  58.495  14.471  -8.846
    8    HE1  MET 692           HE2      MET 692  57.010  15.213  -8.255
    9    HE3  MET 692           HE3      MET 692  56.931  13.903  -9.430

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ASN 693           H        ASN 693  56.205   9.779  -8.366
    2    HA   ASN 693           HA       ASN 693  53.482   9.173  -9.242
    3    HB2  ASN 693           HB2      ASN 693  55.934   9.899 -10.864
    4    HB3  ASN 693           HB3      ASN 693  54.469   9.258 -11.587
    5   HD21  ASN 693          HD21      ASN 693  54.154  11.128 -12.797
    6   HD22  ASN 693          HD22      ASN 693  53.629  12.614 -12.115

  No H/Q in entry =           6
  In of MODEL   36
    1    HA   PRO 694           HA       PRO 694  54.634   4.860  -8.879
    2    HB2  PRO 694           HB2      PRO 694  52.420   4.595 -10.860
    3    HB3  PRO 694           HB3      PRO 694  52.658   3.737  -9.334
    4    HG2  PRO 694           HG2      PRO 694  50.835   5.654  -9.518
    5    HG3  PRO 694           HG3      PRO 694  51.837   5.504  -8.065
    6    HD2  PRO 694           HD2      PRO 694  52.044   7.469 -10.311
    7    HD3  PRO 694           HD3      PRO 694  52.301   7.693  -8.565

  No H/Q in entry =           7
  In of MODEL   36
    1    H    LEU 695           H        LEU 695  53.626   6.067 -12.093
    2    HA   LEU 695           HA       LEU 695  55.850   4.553 -13.226
    3    HB2  LEU 695           HB2      LEU 695  53.382   4.197 -13.997
    4    HB3  LEU 695           HB3      LEU 695  53.545   5.763 -14.751
    5    HG   LEU 695           HG       LEU 695  53.794   3.952 -16.376
    6   HD11  LEU 695          HD11      LEU 695  56.385   5.404 -15.960
    7   HD13  LEU 695          HD12      LEU 695  54.983   5.977 -16.866
    8   HD12  LEU 695          HD13      LEU 695  55.888   4.575 -17.437
    9   HD22  LEU 695          HD21      LEU 695  55.695   2.435 -16.325
   10   HD21  LEU 695          HD22      LEU 695  54.671   2.231 -14.902
   11   HD23  LEU 695          HD23      LEU 695  56.196   3.104 -14.777

  No H/Q in entry =          11
  In of MODEL   36
    1    H    THR 696           H        THR 696  57.505   5.706 -13.736
    2    HA   THR 696           HA       THR 696  57.345   8.402 -14.721
    3    HB   THR 696           HB       THR 696  57.455   8.706 -12.248
    4    HG1  THR 696           HG1      THR 696  58.724  10.292 -12.589
    5   HG23  THR 696          HG21      THR 696  59.381   7.885 -10.937
    6   HG22  THR 696          HG22      THR 696  59.975   7.035 -12.364
    7   HG21  THR 696          HG23      THR 696  58.443   6.559 -11.631

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLN 697           H        GLN 697  60.262   8.649 -14.457
    2    HA   GLN 697           HA       GLN 697  61.011   6.705 -16.460
    3    HB2  GLN 697           HB2      GLN 697  62.744   8.829 -15.156
    4    HB3  GLN 697           HB3      GLN 697  63.325   7.724 -16.382
    5    HG2  GLN 697           HG2      GLN 697  62.860   9.772 -17.472
    6    HG3  GLN 697           HG3      GLN 697  61.583   8.653 -17.928
    7   HE21  GLN 697          HE21      GLN 697  61.809  10.372 -14.853
    8   HE22  GLN 697          HE22      GLN 697  60.421  11.344 -15.092

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ALA 698           H        ALA 698  60.391   5.098 -14.991
    2    HA   ALA 698           HA       ALA 698  62.444   3.446 -14.143
    3    HB1  ALA 698           HB1      ALA 698  60.815   4.744 -11.918
    4    HB2  ALA 698           HB2      ALA 698  62.560   4.893 -12.131
    5    HB3  ALA 698           HB3      ALA 698  61.854   3.333 -11.711

  No H/Q in entry =           5
  In of MODEL   36
    1    H    VAL 699           H        VAL 699  61.493   1.551 -14.667
    2    HA   VAL 699           HA       VAL 699  58.588   1.582 -14.726
    3    HB   VAL 699           HB       VAL 699  59.584   1.370 -16.956
    4   HG11  VAL 699          HG11      VAL 699  60.880  -1.152 -15.969
    5   HG13  VAL 699          HG12      VAL 699  61.689   0.345 -16.439
    6   HG12  VAL 699          HG13      VAL 699  60.836  -0.612 -17.648
    7   HG21  VAL 699          HG21      VAL 699  58.246  -1.184 -16.066
    8   HG23  VAL 699          HG22      VAL 699  58.424  -0.664 -17.739
    9   HG22  VAL 699          HG23      VAL 699  57.442   0.285 -16.620

  No H/Q in entry =           9
  In of MODEL   36
    1    HA   PRO 700           HA       PRO 700  58.718  -1.548 -11.587
    2    HB2  PRO 700           HB2      PRO 700  56.074  -2.332 -11.896
    3    HB3  PRO 700           HB3      PRO 700  56.640  -1.044 -10.833
    4    HG2  PRO 700           HG2      PRO 700  55.350  -0.862 -13.501
    5    HG3  PRO 700           HG3      PRO 700  55.291   0.264 -12.136
    6    HD2  PRO 700           HD2      PRO 700  56.780   0.647 -14.397
    7    HD3  PRO 700           HD3      PRO 700  57.166   1.372 -12.825

  No H/Q in entry =           7
  In of MODEL   36
    1    H    LYS 701           H        LYS 701  59.386  -3.457 -11.785
    2    HA   LYS 701           HA       LYS 701  58.608  -5.154 -14.046
    3    HB2  LYS 701           HB2      LYS 701  60.903  -6.088 -14.065
    4    HB3  LYS 701           HB3      LYS 701  60.918  -4.374 -14.416
    5    HG2  LYS 701           HG2      LYS 701  61.512  -5.468 -11.674
    6    HG3  LYS 701           HG3      LYS 701  62.727  -5.312 -12.939
    7    HD2  LYS 701           HD2      LYS 701  62.411  -2.919 -13.014
    8    HD3  LYS 701           HD3      LYS 701  61.083  -2.999 -11.868
    9    HE2  LYS 701           HE2      LYS 701  63.054  -2.268 -10.732
   10    HE3  LYS 701           HE3      LYS 701  62.658  -3.888 -10.178
   11    HZ3  LYS 701           HZ1      LYS 701  65.000  -3.626 -10.548
   12    HZ2  LYS 701           HZ2      LYS 701  64.754  -3.156 -12.139
   13    HZ1  LYS 701           HZ3      LYS 701  64.413  -4.745 -11.670

  No H/Q in entry =          13
  In of MODEL   36
    1    H    CYS 702           H        CYS 702  57.459  -4.849 -11.586
    2    HA   CYS 702           HA       CYS 702  58.336  -7.112  -9.942
    3    HB2  CYS 702           HB2      CYS 702  56.377  -4.969  -9.151
    4    HB3  CYS 702           HB3      CYS 702  57.409  -5.963  -8.135

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLN 703           H        GLN 703  56.702  -8.611  -9.331
    2    HA   GLN 703           HA       GLN 703  54.651  -8.780 -11.343
    3    HB2  GLN 703           HB2      GLN 703  55.372 -10.684  -9.135
    4    HB3  GLN 703           HB3      GLN 703  54.244 -11.007 -10.447
    5    HG2  GLN 703           HG2      GLN 703  57.184 -10.441 -10.737
    6    HG3  GLN 703           HG3      GLN 703  56.399 -12.008 -10.917
    7   HE21  GLN 703          HE21      GLN 703  57.975 -10.357 -12.743
    8   HE22  GLN 703          HE22      GLN 703  57.051 -10.160 -14.178

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ARG 704           H        ARG 704  52.599  -9.982 -10.233
    2    HA   ARG 704           HA       ARG 704  51.186  -7.732  -9.217
    3    HB2  ARG 704           HB2      ARG 704  50.418 -10.529  -9.872
    4    HB3  ARG 704           HB3      ARG 704  49.302  -9.539  -8.952
    5    HG2  ARG 704           HG2      ARG 704  48.622  -8.504 -10.771
    6    HG3  ARG 704           HG3      ARG 704  50.282  -8.112 -11.256
    7    HD2  ARG 704           HD2      ARG 704  49.016 -10.801 -11.681
    8    HD3  ARG 704           HD3      ARG 704  48.905  -9.522 -12.880
    9    HE   ARG 704           HE       ARG 704  51.575  -9.770 -12.261
   10   HH11  ARG 704          HH11      ARG 704  49.069 -11.709 -13.834
   11   HH12  ARG 704          HH12      ARG 704  50.159 -12.663 -14.718
   12   HH21  ARG 704          HH21      ARG 704  53.114 -11.121 -13.487
   13   HH22  ARG 704          HH22      ARG 704  52.491 -12.337 -14.493

  No H/Q in entry =          13
  In of MODEL   36
    1    H    TRP 705           H        TRP 705  52.868 -10.167  -7.620
    2    HA   TRP 705           HA       TRP 705  51.399  -9.663  -5.178
    3    HB2  TRP 705           HB2      TRP 705  52.783 -11.589  -4.250
    4    HB3  TRP 705           HB3      TRP 705  51.704 -11.980  -5.573
    5    HD1  TRP 705           HD1      TRP 705  55.413 -11.821  -4.722
    6    HE1  TRP 705           HE1      TRP 705  56.750 -12.961  -6.598
    7    HE3  TRP 705           HE3      TRP 705  51.655 -12.526  -8.110
    8    HZ2  TRP 705           HZ2      TRP 705  56.268 -14.021  -9.171
    9    HZ3  TRP 705           HZ3      TRP 705  52.165 -13.589 -10.238
   10    HH2  TRP 705           HH2      TRP 705  54.432 -14.339 -10.764

  No H/Q in entry =          10
  In of MODEL   36
    1    H    GLU 706           H        GLU 706  53.598  -8.087  -6.793
    2    HA   GLU 706           HA       GLU 706  55.307  -7.441  -4.506
    3    HB2  GLU 706           HB2      GLU 706  56.060  -7.549  -7.423
    4    HB3  GLU 706           HB3      GLU 706  57.126  -7.088  -6.097
    5    HG2  GLU 706           HG2      GLU 706  56.907  -9.339  -5.176
    6    HG3  GLU 706           HG3      GLU 706  55.861  -9.777  -6.522

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LYS 707           H        LYS 707  56.454  -5.313  -5.023
    2    HA   LYS 707           HA       LYS 707  54.961  -3.361  -6.569
    3    HB2  LYS 707           HB2      LYS 707  55.706  -2.964  -3.643
    4    HB3  LYS 707           HB3      LYS 707  55.129  -1.691  -4.699
    5    HG2  LYS 707           HG2      LYS 707  53.000  -2.924  -4.942
    6    HG3  LYS 707           HG3      LYS 707  53.609  -4.118  -3.809
    7    HD2  LYS 707           HD2      LYS 707  52.269  -2.722  -2.467
    8    HD3  LYS 707           HD3      LYS 707  53.900  -2.156  -2.162
    9    HE2  LYS 707           HE2      LYS 707  51.910  -0.860  -4.057
   10    HE3  LYS 707           HE3      LYS 707  52.249  -0.311  -2.428
   11    HZ2  LYS 707           HZ1      LYS 707  54.087  -0.267  -4.763
   12    HZ1  LYS 707           HZ2      LYS 707  54.572   0.087  -3.189
   13    HZ3  LYS 707           HZ3      LYS 707  53.427   1.046  -3.954

  No H/Q in entry =          13
  In of MODEL   36
    1    H    LEU 708           H        LEU 708  56.396  -1.225  -6.438
    2    HA   LEU 708           HA       LEU 708  59.172  -2.097  -6.881
    3    HB2  LEU 708           HB2      LEU 708  58.087  -1.481  -8.931
    4    HB3  LEU 708           HB3      LEU 708  57.537   0.038  -8.249
    5    HG   LEU 708           HG       LEU 708  60.004   0.639  -8.008
    6   HD12  LEU 708          HD11      LEU 708  61.566  -0.458  -9.521
    7   HD11  LEU 708          HD12      LEU 708  60.341  -1.670  -9.893
    8   HD13  LEU 708          HD13      LEU 708  60.977  -1.539  -8.257
    9   HD21  LEU 708          HD21      LEU 708  58.812   0.333 -10.764
   10   HD23  LEU 708          HD22      LEU 708  60.183   1.365 -10.357
   11   HD22  LEU 708          HD23      LEU 708  58.597   1.690  -9.662

  No H/Q in entry =          11
  In of MODEL   36
    1    H    GLN 709           H        GLN 709  60.419  -1.373  -5.273
    2    HA   GLN 709           HA       GLN 709  60.577   1.480  -4.856
    3    HB2  GLN 709           HB2      GLN 709  60.538   1.433  -2.465
    4    HB3  GLN 709           HB3      GLN 709  59.079   0.607  -2.979
    5    HG2  GLN 709           HG2      GLN 709  60.276  -1.559  -2.607
    6    HG3  GLN 709           HG3      GLN 709  61.615  -0.636  -1.980
    7   HE21  GLN 709          HE21      GLN 709  61.494   0.321   0.012
    8   HE22  GLN 709          HE22      GLN 709  60.213   0.007   1.117

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ASN 710           H        ASN 710  62.635   2.100  -4.211
    2    HA   ASN 710           HA       ASN 710  64.909   1.966  -4.077
    3    HB2  ASN 710           HB2      ASN 710  64.153   0.486  -2.051
    4    HB3  ASN 710           HB3      ASN 710  64.524  -0.856  -3.094
    5   HD21  ASN 710          HD21      ASN 710  66.053  -1.475  -1.526
    6   HD22  ASN 710          HD22      ASN 710  67.581  -0.675  -1.487

  No H/Q in entry =           6
  In of MODEL   36
    1    H    SER 711           H        SER 711  63.504   1.133  -6.463
    2    HA   SER 711           HA       SER 711  63.905   0.429  -8.549
    3    HB2  SER 711           HB2      SER 711  66.736   0.114  -7.574
    4    HB3  SER 711           HB3      SER 711  66.244   0.126  -9.277
    5    HG   SER 711           HG       SER 711  66.132   2.174  -7.355

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ARG 712           H        ARG 712  63.473  -1.589  -6.208
    2    HA   ARG 712           HA       ARG 712  64.134  -3.935  -7.840
    3    HB2  ARG 712           HB2      ARG 712  64.393  -5.266  -5.794
    4    HB3  ARG 712           HB3      ARG 712  65.571  -3.962  -5.857
    5    HG2  ARG 712           HG2      ARG 712  64.449  -2.742  -4.183
    6    HG3  ARG 712           HG3      ARG 712  62.993  -3.711  -4.360
    7    HD2  ARG 712           HD2      ARG 712  65.611  -4.847  -3.414
    8    HD3  ARG 712           HD3      ARG 712  64.365  -4.223  -2.326
    9    HE   ARG 712           HE       ARG 712  63.125  -6.082  -3.981
   10   HH11  ARG 712          HH11      ARG 712  65.726  -6.192  -1.558
   11   HH12  ARG 712          HH12      ARG 712  65.326  -7.750  -1.019
   12   HH21  ARG 712          HH21      ARG 712  62.559  -8.198  -3.193
   13   HH22  ARG 712          HH22      ARG 712  63.484  -8.917  -1.960

  No H/Q in entry =          13
  In of MODEL   36
    1    H    CYS 713           H        CYS 713  62.802  -5.837  -6.901
    2    HA   CYS 713           HA       CYS 713  60.017  -4.996  -6.866
    3    HB2  CYS 713           HB2      CYS 713  61.242  -7.748  -7.170
    4    HB3  CYS 713           HB3      CYS 713  59.572  -7.293  -7.502

  No H/Q in entry =           4
  In of MODEL   36
    1    H    VAL 714           H        VAL 714  59.066  -5.020  -4.912
    2    HA   VAL 714           HA       VAL 714  60.210  -6.773  -2.841
    3    HB   VAL 714           HB       VAL 714  59.407  -5.190  -1.126
    4   HG12  VAL 714          HG11      VAL 714  61.203  -3.901  -3.158
    5   HG11  VAL 714          HG12      VAL 714  61.690  -5.018  -1.885
    6   HG13  VAL 714          HG13      VAL 714  61.056  -3.423  -1.465
    7   HG21  VAL 714          HG21      VAL 714  58.709  -3.383  -3.448
    8   HG23  VAL 714          HG22      VAL 714  58.673  -2.924  -1.746
    9   HG22  VAL 714          HG23      VAL 714  57.562  -4.155  -2.350

  No H/Q in entry =           9
  In of MODEL   36
    1    H    CYS 715           H        CYS 715  58.595  -7.593  -1.330
    2    HA   CYS 715           HA       CYS 715  56.201  -8.241  -2.837
    3    HB2  CYS 715           HB2      CYS 715  57.136  -9.231  -0.130
    4    HB3  CYS 715           HB3      CYS 715  55.836  -9.917  -1.097

  No H/Q in entry =           4
  In of MODEL   36
    1    H    LYS 716           H        LYS 716  54.152  -7.598  -2.236
    2    HA   LYS 716           HA       LYS 716  54.044  -5.249  -0.609
    3    HB2  LYS 716           HB2      LYS 716  51.500  -5.378  -1.112
    4    HB3  LYS 716           HB3      LYS 716  52.593  -5.057  -2.439
    5    HG2  LYS 716           HG2      LYS 716  52.358  -7.276  -3.273
    6    HG3  LYS 716           HG3      LYS 716  51.543  -7.799  -1.802
    7    HD2  LYS 716           HD2      LYS 716  49.917  -7.525  -3.590
    8    HD3  LYS 716           HD3      LYS 716  49.645  -6.317  -2.347
    9    HE2  LYS 716           HE2      LYS 716  49.367  -5.195  -4.391
   10    HE3  LYS 716           HE3      LYS 716  50.952  -4.709  -3.823
   11    HZ2  LYS 716           HZ1      LYS 716  50.792  -5.214  -6.215
   12    HZ1  LYS 716           HZ2      LYS 716  50.498  -6.821  -5.902
   13    HZ3  LYS 716           HZ3      LYS 716  51.987  -6.112  -5.482

  No H/Q in entry =          13
  In of MODEL   36
    1    H    MET 717           H        MET 717  51.630  -5.293   0.768
    2    HA   MET 717           HA       MET 717  52.448  -6.971   2.997
    3    HB2  MET 717           HB2      MET 717  50.418  -4.723   2.849
    4    HB3  MET 717           HB3      MET 717  50.858  -5.589   4.297
    5    HG2  MET 717           HG2      MET 717  52.978  -4.165   2.753
    6    HG3  MET 717           HG3      MET 717  51.886  -3.248   3.783
    7    HE3  MET 717           HE1      MET 717  53.516  -6.934   4.576
    8    HE2  MET 717           HE2      MET 717  55.011  -6.348   5.300
    9    HE1  MET 717           HE3      MET 717  54.664  -6.017   3.603

  No H/Q in entry =           9
  In of MODEL   36
    1    HA   PRO 718           HA       PRO 718  49.329  -9.872   1.608
    2    HB2  PRO 718           HB2      PRO 718  49.479 -11.138   4.233
    3    HB3  PRO 718           HB3      PRO 718  49.923 -11.785   2.659
    4    HG2  PRO 718           HG2      PRO 718  51.744 -11.095   4.581
    5    HG3  PRO 718           HG3      PRO 718  52.091 -11.119   2.847
    6    HD2  PRO 718           HD2      PRO 718  51.635  -8.819   4.666
    7    HD3  PRO 718           HD3      PRO 718  52.615  -8.939   3.192

  No H/Q in entry =           7
  In of MODEL   36
    1    H    TYR 719           H        TYR 719  49.107  -8.128   4.552
    2    HA   TYR 719           HA       TYR 719  46.358  -8.869   5.048
    3    HB2  TYR 719           HB2      TYR 719  46.517  -7.334   6.993
    4    HB3  TYR 719           HB3      TYR 719  47.767  -8.567   6.981
    5    HD1  TYR 719           HD1      TYR 719  47.053  -5.026   6.875
    6    HD2  TYR 719           HD2      TYR 719  50.120  -7.923   6.418
    7    HE1  TYR 719           HE1      TYR 719  48.747  -3.269   7.167
    8    HE2  TYR 719           HE2      TYR 719  51.816  -6.184   6.714
    9    HH   TYR 719           HH       TYR 719  52.066  -3.811   6.530

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLU 720           H        GLU 720  47.879  -6.759   3.050
    2    HA   GLU 720           HA       GLU 720  45.718  -4.789   3.043
    3    HB2  GLU 720           HB2      GLU 720  48.486  -4.916   1.973
    4    HB3  GLU 720           HB3      GLU 720  47.407  -3.715   1.300
    5    HG2  GLU 720           HG2      GLU 720  48.351  -4.016   4.145
    6    HG3  GLU 720           HG3      GLU 720  48.724  -2.708   3.020

  No H/Q in entry =           6
  In of MODEL   36
    1    H    CYS 721           H        CYS 721  46.403  -7.669   1.823
    2    HA   CYS 721           HA       CYS 721  45.732  -7.199  -0.927
    3    HB2  CYS 721           HB2      CYS 721  46.340  -9.723   0.592
    4    HB3  CYS 721           HB3      CYS 721  46.155  -9.594  -1.152

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLY 722           H        GLY 722  43.631  -6.504  -0.805
    2    HA3  GLY 722           HA2      GLY 722  41.652  -8.279   0.405
    3    HA2  GLY 722           HA3      GLY 722  41.359  -6.648  -0.175

  No H/Q in entry =           3
  In of MODEL   36
    1    HA   PRO 723           HA       PRO 723  39.520  -7.952  -3.902
    2    HB2  PRO 723           HB2      PRO 723  41.001  -6.664  -5.874
    3    HB3  PRO 723           HB3      PRO 723  39.664  -5.948  -4.966
    4    HG2  PRO 723           HG2      PRO 723  42.609  -5.729  -4.501
    5    HG3  PRO 723           HG3      PRO 723  41.354  -4.482  -4.361
    6    HD2  PRO 723           HD2      PRO 723  42.370  -5.645  -2.188
    7    HD3  PRO 723           HD3      PRO 723  40.635  -5.274  -2.288

  No H/Q in entry =           7
  In of MODEL   36
    1    H    SER 724           H        SER 724  39.885 -10.167  -4.121
    2    HA   SER 724           HA       SER 724  41.280 -11.076  -6.335
    3    HB2  SER 724           HB2      SER 724  42.688 -12.673  -4.879
    4    HB3  SER 724           HB3      SER 724  43.316 -11.053  -5.192
    5    HG   SER 724           HG       SER 724  42.034 -10.688  -3.075

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU 725           H        LEU 725  41.200 -13.495  -6.290
    2    HA   LEU 725           HA       LEU 725  38.475 -14.282  -5.735
    3    HB2  LEU 725           HB2      LEU 725  40.891 -15.551  -6.865
    4    HB3  LEU 725           HB3      LEU 725  39.490 -16.559  -6.493
    5    HG   LEU 725           HG       LEU 725  39.348 -14.168  -8.327
    6   HD12  LEU 725          HD11      LEU 725  39.902 -17.053  -9.042
    7   HD11  LEU 725          HD12      LEU 725  41.071 -15.731  -9.157
    8   HD13  LEU 725          HD13      LEU 725  39.629 -15.725 -10.170
    9   HD21  LEU 725          HD21      LEU 725  37.258 -15.086  -7.465
   10   HD23  LEU 725          HD22      LEU 725  37.719 -16.677  -8.081
   11   HD22  LEU 725          HD23      LEU 725  37.446 -15.337  -9.200

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ASP 726           H        ASP 726  37.705 -15.098  -3.984
    2    HA   ASP 726           HA       ASP 726  39.433 -15.871  -1.849
    3    HB2  ASP 726           HB2      ASP 726  36.427 -15.976  -2.131
    4    HB3  ASP 726           HB3      ASP 726  37.261 -16.588  -0.707

  No H/Q in entry =           4
  In of MODEL   36
    1    H    VAL 727           H        VAL 727  40.196 -17.743  -1.368
    2    HA   VAL 727           HA       VAL 727  39.209 -20.116  -2.763
    3    HB   VAL 727           HB       VAL 727  41.575 -20.798  -3.253
    4   HG13  VAL 727          HG11      VAL 727  41.866 -19.396  -5.255
    5   HG12  VAL 727          HG12      VAL 727  40.682 -18.259  -4.622
    6   HG11  VAL 727          HG13      VAL 727  40.189 -19.898  -5.048
    7   HG21  VAL 727          HG21      VAL 727  42.735 -19.346  -1.672
    8   HG23  VAL 727          HG22      VAL 727  42.214 -17.922  -2.571
    9   HG22  VAL 727          HG23      VAL 727  43.335 -19.066  -3.305

  No H/Q in entry =           9
  In of MODEL   36
    1    H    CYS 728           H        CYS 728  40.038 -22.111  -1.772
    2    HA   CYS 728           HA       CYS 728  40.503 -21.702   1.080
    3    HB2  CYS 728           HB2      CYS 728  39.650 -24.228  -0.345
    4    HB3  CYS 728           HB3      CYS 728  39.615 -23.902   1.384

  No H/Q in entry =           4
  In of MODEL   36
    1    H    ALA 729           H        ALA 729  42.404 -22.289   1.946
    2    HA   ALA 729           HA       ALA 729  44.242 -23.870   0.303
    3    HB2  ALA 729           HB1      ALA 729  46.053 -22.346   0.900
    4    HB1  ALA 729           HB2      ALA 729  44.900 -21.317   1.753
    5    HB3  ALA 729           HB3      ALA 729  44.784 -21.508   0.005

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLN 730           H        GLN 730  46.007 -24.732   1.615
    2    HA   GLN 730           HA       GLN 730  45.063 -25.208   4.340
    3    HB2  GLN 730           HB2      GLN 730  45.178 -27.235   2.932
    4    HB3  GLN 730           HB3      GLN 730  46.891 -26.939   2.693
    5    HG2  GLN 730           HG2      GLN 730  47.358 -27.258   4.992
    6    HG3  GLN 730           HG3      GLN 730  45.656 -27.380   5.397
    7   HE21  GLN 730          HE21      GLN 730  45.780 -29.457   6.222
    8   HE22  GLN 730          HE22      GLN 730  46.150 -30.831   5.249

  No H/Q in entry =           8
  In of MODEL   36
    1    H    ASP 731           H        ASP 731  46.132 -24.506   5.879
    2    HA   ASP 731           HA       ASP 731  48.523 -22.964   5.613
    3    HB2  ASP 731           HB2      ASP 731  46.786 -22.386   7.242
    4    HB3  ASP 731           HB3      ASP 731  46.991 -23.943   8.025

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLU 732           H        GLU 732  50.567 -23.819   5.633
    2    HA   GLU 732           HA       GLU 732  50.828 -26.610   6.143
    3    HB2  GLU 732           HB2      GLU 732  52.829 -24.541   5.343
    4    HB3  GLU 732           HB3      GLU 732  53.264 -26.226   5.619
    5    HG2  GLU 732           HG2      GLU 732  51.305 -25.183   3.587
    6    HG3  GLU 732           HG3      GLU 732  52.915 -25.833   3.269

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ARG 733           H        ARG 733  50.735 -24.208   8.359
    2    HA   ARG 733           HA       ARG 733  52.832 -25.418   9.965
    3    HB2  ARG 733           HB2      ARG 733  52.895 -23.004   9.940
    4    HB3  ARG 733           HB3      ARG 733  51.202 -22.905  10.389
    5    HG2  ARG 733           HG2      ARG 733  52.633 -22.388  12.280
    6    HG3  ARG 733           HG3      ARG 733  51.739 -23.877  12.584
    7    HD2  ARG 733           HD2      ARG 733  53.756 -25.149  11.866
    8    HD3  ARG 733           HD3      ARG 733  54.635 -23.630  11.750
    9    HE   ARG 733           HE       ARG 733  53.347 -24.490  14.231
   10   HH11  ARG 733          HH11      ARG 733  56.253 -23.336  12.549
   11   HH12  ARG 733          HH12      ARG 733  57.251 -23.357  13.917
   12   HH21  ARG 733          HH21      ARG 733  54.747 -24.510  16.145
   13   HH22  ARG 733          HH22      ARG 733  56.372 -24.041  16.000

  No H/Q in entry =          13
  In of MODEL   36
    1    H    SER 734           H        SER 734  49.379 -24.746  10.092
    2    HA   SER 734           HA       SER 734  49.218 -26.660  12.327
    3    HB2  SER 734           HB2      SER 734  47.115 -24.726  11.350
    4    HB3  SER 734           HB3      SER 734  47.080 -25.669  12.845
    5    HG   SER 734           HG       SER 734  48.890 -23.598  12.147

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LYS 735           H        LYS 735  48.899 -26.584   9.037
    2    HA   LYS 735           HA       LYS 735  47.991 -27.790   7.430
    3    HB2  LYS 735           HB2      LYS 735  47.758 -29.879   9.601
    4    HB3  LYS 735           HB3      LYS 735  47.542 -30.205   7.886
    5    HG2  LYS 735           HG2      LYS 735  50.059 -29.198   9.209
    6    HG3  LYS 735           HG3      LYS 735  49.781 -30.838   8.637
    7    HD2  LYS 735           HD2      LYS 735  49.824 -28.366   6.873
    8    HD3  LYS 735           HD3      LYS 735  51.174 -29.464   7.080
    9    HE2  LYS 735           HE2      LYS 735  49.787 -31.293   6.146
   10    HE3  LYS 735           HE3      LYS 735  48.464 -30.148   5.916
   11    HZ3  LYS 735           HZ1      LYS 735  49.642 -30.471   3.864
   12    HZ2  LYS 735           HZ2      LYS 735  51.117 -30.114   4.562
   13    HZ1  LYS 735           HZ3      LYS 735  49.997 -28.904   4.367

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ARG 736           H        ARG 736  46.278 -26.054   8.803
    2    HA   ARG 736           HA       ARG 736  43.669 -27.361   8.738
    3    HB2  ARG 736           HB2      ARG 736  42.808 -25.303   9.668
    4    HB3  ARG 736           HB3      ARG 736  44.166 -25.888  10.625
    5    HG2  ARG 736           HG2      ARG 736  45.624 -24.283   9.600
    6    HG3  ARG 736           HG3      ARG 736  44.324 -23.736   8.540
    7    HD2  ARG 736           HD2      ARG 736  44.642 -22.247  10.324
    8    HD3  ARG 736           HD3      ARG 736  43.064 -23.011  10.499
    9    HE   ARG 736           HE       ARG 736  44.228 -24.518  12.149
   10   HH11  ARG 736          HH11      ARG 736  45.469 -21.201  11.602
   11   HH12  ARG 736          HH12      ARG 736  45.997 -21.021  13.196
   12   HH21  ARG 736          HH21      ARG 736  45.009 -24.231  14.309
   13   HH22  ARG 736          HH22      ARG 736  45.705 -22.750  14.787

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ILE 737           H        ILE 737  42.019 -26.681   7.325
    2    HA   ILE 737           HA       ILE 737  42.933 -25.356   4.921
    3    HB   ILE 737           HB       ILE 737  40.143 -26.325   5.595
    4   HG12  ILE 737          HG12      ILE 737  41.742 -28.225   5.715
    5   HG13  ILE 737          HG13      ILE 737  40.618 -28.395   4.378
    6   HG21  ILE 737          HG21      ILE 737  40.331 -24.705   3.768
    7   HG23  ILE 737          HG22      ILE 737  39.785 -26.273   3.203
    8   HG22  ILE 737          HG23      ILE 737  41.458 -25.781   2.931
    9   HD12  ILE 737          HD11      ILE 737  43.481 -27.494   4.213
   10   HD11  ILE 737          HD12      ILE 737  42.361 -27.592   2.854
   11   HD13  ILE 737          HD13      ILE 737  42.841 -29.062   3.711

  No H/Q in entry =          11
  In of MODEL   36
    1    H    LEU 738           H        LEU 738  42.808 -23.221   4.850
    2    HA   LEU 738           HA       LEU 738  40.728 -21.979   6.434
    3    HB2  LEU 738           HB2      LEU 738  42.102 -19.862   6.390
    4    HB3  LEU 738           HB3      LEU 738  42.638 -21.143   7.438
    5    HG   LEU 738           HG       LEU 738  44.620 -21.516   6.046
    6   HD12  LEU 738          HD11      LEU 738  44.996 -20.347   3.999
    7   HD11  LEU 738          HD12      LEU 738  43.206 -20.160   3.919
    8   HD13  LEU 738          HD13      LEU 738  43.936 -21.737   4.025
    9   HD22  LEU 738          HD21      LEU 738  44.747 -19.555   7.459
   10   HD21  LEU 738          HD22      LEU 738  44.023 -18.585   6.179
   11   HD23  LEU 738          HD23      LEU 738  45.614 -19.300   5.944

  No H/Q in entry =          11
  In of MODEL   36
    1    HA   PRO 739           HA       PRO 739  39.486 -20.060   2.634
    2    HB2  PRO 739           HB2      PRO 739  37.917 -18.114   3.588
    3    HB3  PRO 739           HB3      PRO 739  37.367 -19.800   3.578
    4    HG2  PRO 739           HG2      PRO 739  38.345 -18.148   5.850
    5    HG3  PRO 739           HG3      PRO 739  37.144 -19.449   5.829
    6    HD2  PRO 739           HD2      PRO 739  39.778 -19.714   6.671
    7    HD3  PRO 739           HD3      PRO 739  38.702 -21.045   6.180

  No H/Q in entry =           7
  In of MODEL   36
    1    H    LEU 740           H        LEU 740  41.037 -19.008   1.687
    2    HA   LEU 740           HA       LEU 740  41.995 -16.484   2.830
    3    HB2  LEU 740           HB2      LEU 740  43.442 -18.637   1.336
    4    HB3  LEU 740           HB3      LEU 740  43.966 -16.991   1.127
    5    HG   LEU 740           HG       LEU 740  44.006 -18.523   3.780
    6   HD12  LEU 740          HD11      LEU 740  46.351 -18.482   3.498
    7   HD11  LEU 740          HD12      LEU 740  46.189 -17.729   1.885
    8   HD13  LEU 740          HD13      LEU 740  45.549 -19.347   2.200
    9   HD23  LEU 740          HD21      LEU 740  45.231 -16.582   4.585
   10   HD22  LEU 740          HD22      LEU 740  43.622 -16.087   4.074
   11   HD21  LEU 740          HD23      LEU 740  45.014 -15.763   3.039

  No H/Q in entry =          11
  In of MODEL   36
    1    H    THR 741           H        THR 741  43.198 -15.430   0.680
    2    HA   THR 741           HA       THR 741  41.314 -15.544  -1.513
    3    HB   THR 741           HB       THR 741  42.352 -12.871  -0.486
    4    HG1  THR 741           HG1      THR 741  39.791 -13.881   0.280
    5   HG22  THR 741          HG21      THR 741  39.804 -13.681  -1.883
    6   HG21  THR 741          HG22      THR 741  41.225 -12.993  -2.670
    7   HG23  THR 741          HG23      THR 741  40.307 -12.035  -1.509

  No H/Q in entry =           7
  In of MODEL   36
    1    H    VAL 742           H        VAL 742  42.385 -15.064  -3.505
    2    HA   VAL 742           HA       VAL 742  44.862 -16.157  -3.856
    3    HB   VAL 742           HB       VAL 742  43.546 -14.149  -5.699
    4   HG13  VAL 742          HG11      VAL 742  45.824 -14.288  -6.280
    5   HG12  VAL 742          HG12      VAL 742  44.830 -15.108  -7.481
    6   HG11  VAL 742          HG13      VAL 742  45.766 -16.056  -6.307
    7   HG23  VAL 742          HG21      VAL 742  42.826 -16.132  -6.907
    8   HG22  VAL 742          HG22      VAL 742  42.149 -15.979  -5.290
    9   HG21  VAL 742          HG23      VAL 742  43.456 -17.141  -5.592

  No H/Q in entry =           9
  In of MODEL   36
    1    H    CYS 743           H        CYS 743  44.297 -12.640  -3.597
    2    HA   CYS 743           HA       CYS 743  46.976 -12.006  -4.177
    3    HB2  CYS 743           HB2      CYS 743  45.010 -10.411  -4.353
    4    HB3  CYS 743           HB3      CYS 743  45.011 -10.302  -2.607

  No H/Q in entry =           4
  In of MODEL   36
    1    H    LYS 744           H        LYS 744  45.225 -12.533  -1.176
    2    HA   LYS 744           HA       LYS 744  47.246 -11.929   0.677
    3    HB2  LYS 744           HB2      LYS 744  45.086 -14.032   0.792
    4    HB3  LYS 744           HB3      LYS 744  46.068 -13.533   2.158
    5    HG2  LYS 744           HG2      LYS 744  45.094 -11.350   2.132
    6    HG3  LYS 744           HG3      LYS 744  44.297 -11.669   0.592
    7    HD2  LYS 744           HD2      LYS 744  42.962 -13.442   1.694
    8    HD3  LYS 744           HD3      LYS 744  43.718 -13.015   3.230
    9    HE2  LYS 744           HE2      LYS 744  42.728 -10.850   3.209
   10    HE3  LYS 744           HE3      LYS 744  42.208 -11.036   1.534
   11    HZ2  LYS 744           HZ1      LYS 744  40.387 -11.354   3.122
   12    HZ1  LYS 744           HZ2      LYS 744  41.180 -12.659   3.807
   13    HZ3  LYS 744           HZ3      LYS 744  40.669 -12.729   2.201

  No H/Q in entry =          13
  In of MODEL   36
    1    H    MET 745           H        MET 745  46.279 -15.033  -0.695
    2    HA   MET 745           HA       MET 745  48.258 -16.677   0.338
    3    HB2  MET 745           HB2      MET 745  46.671 -17.954  -0.648
    4    HB3  MET 745           HB3      MET 745  46.365 -16.811  -1.934
    5    HG2  MET 745           HG2      MET 745  47.220 -18.734  -3.011
    6    HG3  MET 745           HG3      MET 745  48.540 -17.602  -2.971
    7    HE3  MET 745           HE1      MET 745  47.161 -20.124  -0.175
    8    HE2  MET 745           HE2      MET 745  48.241 -21.484  -0.534
    9    HE1  MET 745           HE3      MET 745  47.108 -20.915  -1.746

  No H/Q in entry =           9
  In of MODEL   36
    1    H    HIS 746           H        HIS 746  48.340 -14.887  -2.725
    2    HA   HIS 746           HA       HIS 746  50.848 -15.979  -3.508
    3    HB2  HIS 746           HB2      HIS 746  49.185 -13.761  -4.472
    4    HB3  HIS 746           HB3      HIS 746  50.906 -13.647  -4.865
    5    HD1  HIS 746           HD1      HIS 746  51.802 -15.933  -6.180
    6    HD2  HIS 746           HD2      HIS 746  47.725 -15.140  -6.207
    7    HE1  HIS 746           HE1      HIS 746  50.894 -17.171  -8.154
    8    HE2  HIS 746           HE2      HIS 746  48.399 -16.895  -7.981

  No H/Q in entry =           8
  In of MODEL   36
    1    H    VAL 747           H        VAL 747  50.009 -12.985  -1.891
    2    HA   VAL 747           HA       VAL 747  52.669 -12.090  -1.828
    3    HB   VAL 747           HB       VAL 747  50.216 -11.170  -0.330
    4   HG13  VAL 747          HG11      VAL 747  51.486  -9.149   0.157
    5   HG12  VAL 747          HG12      VAL 747  52.908  -9.827  -0.633
    6   HG11  VAL 747          HG13      VAL 747  52.294 -10.546   0.857
    7   HG22  VAL 747          HG21      VAL 747  50.224  -9.407  -2.008
    8   HG21  VAL 747          HG22      VAL 747  50.152 -11.008  -2.765
    9   HG23  VAL 747          HG23      VAL 747  51.673 -10.122  -2.722

  No H/Q in entry =           9
  In of MODEL   36
    1    H    LEU 748           H        LEU 748  50.618 -13.725   0.580
    2    HA   LEU 748           HA       LEU 748  52.666 -13.632   2.511
    3    HB2  LEU 748           HB2      LEU 748  51.382 -15.364   3.783
    4    HB3  LEU 748           HB3      LEU 748  50.416 -13.990   3.308
    5    HG   LEU 748           HG       LEU 748  49.469 -15.432   1.480
    6   HD12  LEU 748          HD11      LEU 748  50.769 -17.648   3.040
    7   HD11  LEU 748          HD12      LEU 748  51.183 -17.158   1.401
    8   HD13  LEU 748          HD13      LEU 748  49.593 -17.847   1.743
    9   HD22  LEU 748          HD21      LEU 748  48.241 -14.920   3.490
   10   HD21  LEU 748          HD22      LEU 748  49.033 -16.242   4.344
   11   HD23  LEU 748          HD23      LEU 748  47.937 -16.587   3.005

  No H/Q in entry =          11
  In of MODEL   36
    1    H    HIS 749           H        HIS 749  52.081 -15.688  -0.155
    2    HA   HIS 749           HA       HIS 749  53.749 -17.836   0.635
    3    HB2  HIS 749           HB2      HIS 749  51.956 -17.663  -1.283
    4    HB3  HIS 749           HB3      HIS 749  53.322 -17.114  -2.244
    5    HD1  HIS 749           HD1      HIS 749  55.114 -18.903  -2.871
    6    HD2  HIS 749           HD2      HIS 749  51.970 -20.318  -0.565
    7    HE1  HIS 749           HE1      HIS 749  55.323 -21.410  -2.894
    8    HE2  HIS 749           HE2      HIS 749  53.423 -22.247  -1.509

  No H/Q in entry =           8
  In of MODEL   36
    1    H    CYS 750           H        CYS 750  54.275 -14.771  -1.067
    2    HA   CYS 750           HA       CYS 750  57.021 -15.516  -1.544
    3    HB2  CYS 750           HB2      CYS 750  57.251 -13.263  -2.611
    4    HB3  CYS 750           HB3      CYS 750  56.008 -14.266  -3.341

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLN 751           H        GLN 751  55.213 -13.902   0.831
    2    HA   GLN 751           HA       GLN 751  57.383 -12.667   2.165
    3    HB2  GLN 751           HB2      GLN 751  54.793 -13.780   3.238
    4    HB3  GLN 751           HB3      GLN 751  55.952 -12.898   4.217
    5    HG2  GLN 751           HG2      GLN 751  54.571 -11.818   1.789
    6    HG3  GLN 751           HG3      GLN 751  54.050 -11.525   3.440
    7   HE21  GLN 751          HE21      GLN 751  54.766  -9.508   1.553
    8   HE22  GLN 751          HE22      GLN 751  56.173  -8.724   2.144

  No H/Q in entry =           8
  In of MODEL   36
    1    H    GLY 752           H        GLY 752  56.438 -15.937   1.789
    2    HA3  GLY 752           HA2      GLY 752  58.321 -17.490   2.153
    3    HA2  GLY 752           HA3      GLY 752  58.517 -16.722   3.720

  No H/Q in entry =           3
  In of MODEL   36
    1    H    ARG 753           H        ARG 753  55.297 -16.815   3.319
    2    HA   ARG 753           HA       ARG 753  55.026 -18.989   5.166
    3    HB2  ARG 753           HB2      ARG 753  52.855 -17.494   3.676
    4    HB3  ARG 753           HB3      ARG 753  52.647 -18.513   5.095
    5    HG2  ARG 753           HG2      ARG 753  54.179 -15.917   5.016
    6    HG3  ARG 753           HG3      ARG 753  52.535 -16.118   5.620
    7    HD2  ARG 753           HD2      ARG 753  53.327 -17.604   7.367
    8    HD3  ARG 753           HD3      ARG 753  54.969 -17.511   6.732
    9    HE   ARG 753           HE       ARG 753  54.273 -14.930   7.187
   10   HH11  ARG 753          HH11      ARG 753  54.396 -17.810   9.228
   11   HH12  ARG 753          HH12      ARG 753  54.782 -16.960  10.656
   12   HH21  ARG 753          HH21      ARG 753  54.807 -13.770   9.074
   13   HH22  ARG 753          HH22      ARG 753  54.993 -14.579  10.578

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ASN 754           H        ASN 754  54.099 -20.983   4.785
    2    HA   ASN 754           HA       ASN 754  54.037 -21.702   1.954
    3    HB2  ASN 754           HB2      ASN 754  54.631 -23.510   4.321
    4    HB3  ASN 754           HB3      ASN 754  54.582 -24.017   2.638
    5   HD21  ASN 754          HD21      ASN 754  56.441 -22.520   5.109
    6   HD22  ASN 754          HD22      ASN 754  57.872 -22.278   4.183

  No H/Q in entry =           6
  In of MODEL   36
    1    H    TYR 755           H        TYR 755  52.245 -22.442   1.115
    2    HA   TYR 755           HA       TYR 755  50.135 -23.482   2.788
    3    HB2  TYR 755           HB2      TYR 755  49.848 -20.987   1.131
    4    HB3  TYR 755           HB3      TYR 755  48.495 -22.067   1.457
    5    HD1  TYR 755           HD1      TYR 755  51.042 -19.933   3.113
    6    HD2  TYR 755           HD2      TYR 755  47.315 -21.912   3.448
    7    HE1  TYR 755           HE1      TYR 755  50.641 -18.799   5.241
    8    HE2  TYR 755           HE2      TYR 755  46.906 -20.793   5.577
    9    HH   TYR 755           HH       TYR 755  48.306 -19.830   7.367

  No H/Q in entry =           9
  In of MODEL   36
    1    H    THR 756           H        THR 756  48.920 -24.880   1.805
    2    HA   THR 756           HA       THR 756  49.671 -25.689  -0.893
    3    HB   THR 756           HB       THR 756  48.101 -27.072   1.292
    4    HG1  THR 756           HG1      THR 756  50.004 -27.426   2.041
    5   HG21  THR 756          HG21      THR 756  47.457 -27.858  -0.915
    6   HG23  THR 756          HG22      THR 756  48.364 -29.101  -0.036
    7   HG22  THR 756          HG23      THR 756  49.151 -28.154  -1.311

  No H/Q in entry =           7
  In of MODEL   36
    1    H    LEU 757           H        LEU 757  48.079 -25.854  -2.526
    2    HA   LEU 757           HA       LEU 757  45.633 -24.409  -2.004
    3    HB2  LEU 757           HB2      LEU 757  46.877 -25.462  -4.537
    4    HB3  LEU 757           HB3      LEU 757  45.224 -24.896  -4.498
    5    HG   LEU 757           HG       LEU 757  46.566 -23.167  -5.385
    6   HD12  LEU 757          HD11      LEU 757  45.849 -22.500  -2.545
    7   HD11  LEU 757          HD12      LEU 757  44.788 -22.436  -3.954
    8   HD13  LEU 757          HD13      LEU 757  46.161 -21.341  -3.831
    9   HD22  LEU 757          HD21      LEU 757  48.455 -22.139  -4.183
   10   HD21  LEU 757          HD22      LEU 757  48.769 -23.836  -4.546
   11   HD23  LEU 757          HD23      LEU 757  48.301 -23.355  -2.915

  No H/Q in entry =          11
  In of MODEL   36
    1    H    THR 758           H        THR 758  43.696 -25.243  -1.857
    2    HA   THR 758           HA       THR 758  43.384 -28.098  -2.333
    3    HB   THR 758           HB       THR 758  41.764 -28.010  -0.329
    4    HG1  THR 758           HG1      THR 758  42.276 -25.490  -0.355
    5   HG23  THR 758          HG21      THR 758  43.563 -28.397   1.302
    6   HG22  THR 758          HG22      THR 758  44.718 -27.639   0.211
    7   HG21  THR 758          HG23      THR 758  43.947 -29.160  -0.242

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLY 759           H        GLY 759  40.694 -28.339  -1.972
    2    HA3  GLY 759           HA2      GLY 759  39.693 -26.716  -4.147
    3    HA2  GLY 759           HA3      GLY 759  38.896 -28.106  -3.422

  No H/Q in entry =           3
  In of MODEL   36
    1    H    ARG 760           H        ARG 760  37.267 -26.115  -3.823
    2    HA   ARG 760           HA       ARG 760  37.339 -24.160  -1.714
    3    HB2  ARG 760           HB2      ARG 760  35.309 -23.229  -2.701
    4    HB3  ARG 760           HB3      ARG 760  36.531 -23.515  -3.920
    5    HG2  ARG 760           HG2      ARG 760  34.536 -24.193  -4.953
    6    HG3  ARG 760           HG3      ARG 760  35.281 -25.694  -4.396
    7    HD2  ARG 760           HD2      ARG 760  33.796 -25.702  -2.434
    8    HD3  ARG 760           HD3      ARG 760  33.047 -24.206  -2.990
    9    HE   ARG 760           HE       ARG 760  32.865 -25.990  -5.048
   10   HH11  ARG 760          HH11      ARG 760  31.694 -25.977  -1.699
   11   HH12  ARG 760          HH12      ARG 760  30.236 -26.769  -2.072
   12   HH21  ARG 760          HH21      ARG 760  30.800 -26.995  -5.543
   13   HH22  ARG 760          HH22      ARG 760  29.727 -27.380  -4.266

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ASP 761           H        ASP 761  36.059 -27.274  -2.021
    2    HA   ASP 761           HA       ASP 761  33.801 -26.869  -0.367
    3    HB2  ASP 761           HB2      ASP 761  33.753 -28.668  -1.970
    4    HB3  ASP 761           HB3      ASP 761  35.152 -29.431  -1.231

  No H/Q in entry =           4
  In of MODEL   36
    1    H    SER 762           H        SER 762  37.100 -27.576   0.047
    2    HA   SER 762           HA       SER 762  37.279 -29.088   2.303
    3    HB2  SER 762           HB2      SER 762  39.185 -26.987   1.299
    4    HB3  SER 762           HB3      SER 762  39.587 -28.215   2.500
    5    HG   SER 762           HG       SER 762  39.581 -29.711   1.034

  No H/Q in entry =           5
  In of MODEL   36
    1    H    CYS 763           H        CYS 763  36.737 -25.594   2.190
    2    HA   CYS 763           HA       CYS 763  36.037 -25.755   4.989
    3    HB2  CYS 763           HB2      CYS 763  37.206 -23.696   5.581
    4    HB3  CYS 763           HB3      CYS 763  38.362 -24.889   4.984

  No H/Q in entry =           4
  In of MODEL   36
    1    H    THR 764           H        THR 764  35.080 -23.346   5.501
    2    HA   THR 764           HA       THR 764  33.105 -23.001   3.399
    3    HB   THR 764           HB       THR 764  33.126 -21.969   6.223
    4    HG1  THR 764           HG1      THR 764  32.743 -24.443   5.174
    5   HG22  THR 764          HG21      THR 764  30.879 -22.374   4.224
    6   HG21  THR 764          HG22      THR 764  31.576 -20.823   4.692
    7   HG23  THR 764          HG23      THR 764  30.681 -21.779   5.877

  No H/Q in entry =           7
  In of MODEL   36
    1    H    LEU 765           H        LEU 765  33.519 -21.486   2.044
    2    HA   LEU 765           HA       LEU 765  35.377 -19.376   2.565
    3    HB2  LEU 765           HB2      LEU 765  34.784 -20.768   0.397
    4    HB3  LEU 765           HB3      LEU 765  33.552 -19.525   0.246
    5    HG   LEU 765           HG       LEU 765  35.302 -17.810   0.148
    6   HD13  LEU 765          HD11      LEU 765  37.015 -18.920   1.469
    7   HD12  LEU 765          HD12      LEU 765  37.664 -18.600  -0.146
    8   HD11  LEU 765          HD13      LEU 765  37.109 -20.217   0.293
    9   HD23  LEU 765          HD21      LEU 765  35.660 -20.082  -1.803
   10   HD22  LEU 765          HD22      LEU 765  36.133 -18.405  -2.069
   11   HD21  LEU 765          HD23      LEU 765  34.427 -18.823  -1.902

  No H/Q in entry =          11
  In of MODEL   36
    1    HA   PRO 766           HA       PRO 766  32.339 -16.497   4.081
    2    HB2  PRO 766           HB2      PRO 766  33.531 -14.145   3.180
    3    HB3  PRO 766           HB3      PRO 766  33.910 -14.959   4.697
    4    HG2  PRO 766           HG2      PRO 766  35.367 -14.986   2.111
    5    HG3  PRO 766           HG3      PRO 766  35.999 -15.096   3.758
    6    HD2  PRO 766           HD2      PRO 766  35.793 -17.223   2.077
    7    HD3  PRO 766           HD3      PRO 766  35.706 -17.395   3.830

  No H/Q in entry =           7
  In of MODEL   36
    1    H    ALA 767           H        ALA 767  33.582 -15.484   0.876
    2    HA   ALA 767           HA       ALA 767  30.795 -15.312  -0.004
    3    HB2  ALA 767           HB1      ALA 767  32.897 -13.223  -0.542
    4    HB1  ALA 767           HB2      ALA 767  31.559 -13.043   0.592
    5    HB3  ALA 767           HB3      ALA 767  31.237 -13.206  -1.135

  No H/Q in entry =           5
  In of MODEL   36
    1    H    SER 768           H        SER 768  30.582 -16.737  -1.419
    2    HA   SER 768           HA       SER 768  32.725 -17.187  -3.318
    3    HB2  SER 768           HB2      SER 768  30.268 -18.850  -2.728
    4    HB3  SER 768           HB3      SER 768  31.591 -19.292  -3.806
    5    HG   SER 768           HG       SER 768  31.547 -19.074  -1.019

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA 769           H        ALA 769  29.135 -17.366  -3.544
    2    HA   ALA 769           HA       ALA 769  29.269 -15.570  -5.852
    3    HB2  ALA 769           HB1      ALA 769  27.606 -16.973  -6.994
    4    HB1  ALA 769           HB2      ALA 769  27.678 -18.136  -5.668
    5    HB3  ALA 769           HB3      ALA 769  29.095 -17.865  -6.680

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLU 770           H        GLU 770  27.137 -14.604  -6.353
    2    HA   GLU 770           HA       GLU 770  25.276 -13.510  -5.945
    3    HB2  GLU 770           HB2      GLU 770  24.881 -15.490  -3.725
    4    HB3  GLU 770           HB3      GLU 770  23.632 -14.393  -4.332
    5    HG2  GLU 770           HG2      GLU 770  23.824 -15.428  -6.536
    6    HG3  GLU 770           HG3      GLU 770  25.082 -16.482  -5.887

  No H/Q in entry =           6
  In of MODEL   36
    1    H    LYS 771           H        LYS 771  25.882 -11.526  -5.454
    2    HA   LYS 771           HA       LYS 771  26.673 -11.026  -2.664
    3    HB2  LYS 771           HB2      LYS 771  27.650  -9.437  -5.059
    4    HB3  LYS 771           HB3      LYS 771  28.246  -9.376  -3.409
    5    HG2  LYS 771           HG2      LYS 771  28.493 -11.739  -5.266
    6    HG3  LYS 771           HG3      LYS 771  29.777 -10.602  -4.862
    7    HD2  LYS 771           HD2      LYS 771  29.927 -11.389  -2.651
    8    HD3  LYS 771           HD3      LYS 771  28.340 -12.149  -2.722
    9    HE2  LYS 771           HE2      LYS 771  30.084 -13.824  -2.800
   10    HE3  LYS 771           HE3      LYS 771  29.161 -13.780  -4.291
   11    HZ2  LYS 771           HZ1      LYS 771  31.864 -12.578  -3.890
   12    HZ1  LYS 771           HZ2      LYS 771  30.980 -12.512  -5.321
   13    HZ3  LYS 771           HZ3      LYS 771  31.532 -13.993  -4.731

  No H/Q in entry =          13
  In of MODEL   36
    1    H    ALA 772           H        ALA 772  26.212  -8.854  -1.882
    2    HA   ALA 772           HA       ALA 772  23.968  -7.528  -3.219
    3    HB2  ALA 772           HB1      ALA 772  23.066  -8.892  -1.391
    4    HB1  ALA 772           HB2      ALA 772  22.939  -7.172  -1.007
    5    HB3  ALA 772           HB3      ALA 772  24.203  -8.149  -0.267

  No H/Q in entry =           5
  In of MODEL   36
    1    H    CYS 773           H        CYS 773  23.695  -5.297  -2.239
    2    HA   CYS 773           HA       CYS 773  26.146  -3.914  -2.451
    3    HB2  CYS 773           HB2      CYS 773  23.945  -2.927  -3.055
    4    HB3  CYS 773           HB3      CYS 773  23.491  -2.935  -1.356

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLY 774           H        GLY 774  27.493  -3.065  -0.889
    2    HA3  GLY 774           HA2      GLY 774  27.684  -2.405   1.496
    3    HA2  GLY 774           HA3      GLY 774  26.913  -3.945   1.855

  No H/Q in entry =           3
  In of MODEL   36
    1    H    ALA 775           H        ALA 775  28.324  -5.203  -0.391
    2    HA   ALA 775           HA       ALA 775  31.110  -5.035   0.216
    3    HB1  ALA 775           HB1      ALA 775  31.323  -7.425   0.814
    4    HB3  ALA 775           HB2      ALA 775  29.567  -7.571   0.806
    5    HB2  ALA 775           HB3      ALA 775  30.358  -6.546   2.003

  No H/Q in entry =           5
  In of MODEL   36
    1    H    CYS 776           H        CYS 776  31.631  -4.735  -1.850
    2    HA   CYS 776           HA       CYS 776  30.593  -6.656  -3.784
    3    HB2  CYS 776           HB2      CYS 776  31.276  -3.744  -4.297
    4    HB3  CYS 776           HB3      CYS 776  30.622  -4.900  -5.448

  No H/Q in entry =           4
  In of MODEL   36
    1    HA   PRO 777           HA       PRO 777  34.992  -7.424  -4.102
    2    HB2  PRO 777           HB2      PRO 777  34.886  -9.240  -6.109
    3    HB3  PRO 777           HB3      PRO 777  34.435  -9.646  -4.452
    4    HG2  PRO 777           HG2      PRO 777  32.676  -8.943  -6.772
    5    HG3  PRO 777           HG3      PRO 777  32.470 -10.228  -5.572
    6    HD2  PRO 777           HD2      PRO 777  31.136  -7.883  -5.423
    7    HD3  PRO 777           HD3      PRO 777  31.639  -8.777  -3.977

  No H/Q in entry =           7
  In of MODEL   36
    1    H    LEU 778           H        LEU 778  36.565  -7.458  -5.913
    2    HA   LEU 778           HA       LEU 778  36.666  -5.176  -7.432
    3    HB2  LEU 778           HB2      LEU 778  38.513  -6.283  -8.701
    4    HB3  LEU 778           HB3      LEU 778  38.662  -6.308  -6.958
    5    HG   LEU 778           HG       LEU 778  37.617  -8.684  -8.487
    6   HD11  LEU 778          HD11      LEU 778  40.492  -8.109  -7.786
    7   HD13  LEU 778          HD12      LEU 778  39.782  -8.251  -9.417
    8   HD12  LEU 778          HD13      LEU 778  39.818  -9.646  -8.336
    9   HD21  LEU 778          HD21      LEU 778  38.826  -8.351  -5.751
   10   HD23  LEU 778          HD22      LEU 778  38.598  -9.901  -6.537
   11   HD22  LEU 778          HD23      LEU 778  37.195  -8.931  -6.150

  No H/Q in entry =          11
  In of MODEL   36
    1    H    TRP 779           H        TRP 779  35.101  -8.156  -8.357
    2    HA   TRP 779           HA       TRP 779  34.548  -7.034 -11.018
    3    HB2  TRP 779           HB2      TRP 779  33.808  -9.388 -11.593
    4    HB3  TRP 779           HB3      TRP 779  35.523  -9.235 -11.220
    5    HD1  TRP 779           HD1      TRP 779  32.242 -10.532  -9.617
    6    HE1  TRP 779           HE1      TRP 779  32.870 -12.245  -7.839
    7    HE3  TRP 779           HE3      TRP 779  37.308 -10.096  -9.810
    8    HZ2  TRP 779           HZ2      TRP 779  35.240 -13.284  -6.657
    9    HZ3  TRP 779           HZ3      TRP 779  38.654 -11.495  -8.349
   10    HH2  TRP 779           HH2      TRP 779  37.644 -13.037  -6.819

  No H/Q in entry =          10
  In of MODEL   36
    1    H    GLY 780           H        GLY 780  33.291  -6.568  -8.260
    2    HA3  GLY 780           HA2      GLY 780  30.534  -7.030  -9.146
    3    HA2  GLY 780           HA3      GLY 780  31.020  -7.301  -7.471

  No H/Q in entry =           3
  In of MODEL   36
    1    H    LYS 781           H        LYS 781  29.184  -5.318  -8.779
    2    HA   LYS 781           HA       LYS 781  30.328  -3.019  -7.381
    3    HB2  LYS 781           HB2      LYS 781  31.019  -2.894  -9.775
    4    HB3  LYS 781           HB3      LYS 781  29.315  -2.823 -10.212
    5    HG2  LYS 781           HG2      LYS 781  30.202  -0.595 -10.190
    6    HG3  LYS 781           HG3      LYS 781  29.106  -0.781  -8.812
    7    HD2  LYS 781           HD2      LYS 781  31.089  -1.262  -7.380
    8    HD3  LYS 781           HD3      LYS 781  32.116  -0.902  -8.767
    9    HE2  LYS 781           HE2      LYS 781  32.005   0.967  -7.351
   10    HE3  LYS 781           HE3      LYS 781  31.121   1.348  -8.838
   11    HZ1  LYS 781           HZ1      LYS 781  29.018   0.919  -7.568
   12    HZ3  LYS 781           HZ2      LYS 781  29.957   2.136  -6.878
   13    HZ2  LYS 781           HZ3      LYS 781  29.960   0.626  -6.189

  No H/Q in entry =          13
  In of MODEL   36
    1    H    CYS 782           H        CYS 782  28.770  -2.040  -6.221
    2    HA   CYS 782           HA       CYS 782  26.036  -2.534  -6.902
    3    HB2  CYS 782           HB2      CYS 782  25.575  -0.817  -5.087
    4    HB3  CYS 782           HB3      CYS 782  26.492  -2.212  -4.536

  No H/Q in entry =           4
  In of MODEL   36
    1    H    ASP 783           H        ASP 783  25.425  -1.744  -8.718
    2    HA   ASP 783           HA       ASP 783  25.916   1.056  -9.362
    3    HB2  ASP 783           HB2      ASP 783  27.594  -0.421 -10.555
    4    HB3  ASP 783           HB3      ASP 783  26.244  -1.249 -11.315

  No H/Q in entry =           4
  In of MODEL   36
    1    H    ALA 784           H        ALA 784  24.084   1.964 -10.018
    2    HA   ALA 784           HA       ALA 784  21.912   2.327 -10.231
    3    HB1  ALA 784           HB1      ALA 784  21.565  -0.621 -10.937
    4    HB2  ALA 784           HB2      ALA 784  21.732   0.693 -12.102
    5    HB3  ALA 784           HB3      ALA 784  20.310   0.613 -11.066

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLU 785           H        GLU 785  21.309   2.907  -8.390
    2    HA   GLU 785           HA       GLU 785  21.888   1.664  -5.995
    3    HB2  GLU 785           HB2      GLU 785  21.474   4.102  -6.448
    4    HB3  GLU 785           HB3      GLU 785  19.758   3.745  -6.418
    5    HG2  GLU 785           HG2      GLU 785  19.880   3.080  -4.118
    6    HG3  GLU 785           HG3      GLU 785  21.637   3.239  -4.125

  No H/Q in entry =           6
  In of MODEL   36
    1    H    SER 786           H        SER 786  21.192  -0.254  -5.556
    2    HA   SER 786           HA       SER 786  18.464  -0.702  -4.801
    3    HB2  SER 786           HB2      SER 786  19.824  -2.446  -6.900
    4    HB3  SER 786           HB3      SER 786  18.248  -2.767  -6.174
    5    HG   SER 786           HG       SER 786  18.402  -0.282  -7.143

  No H/Q in entry =           5
  In of MODEL   36
    1    H    SER 787           H        SER 787  18.508  -3.149  -3.834
    2    HA   SER 787           HA       SER 787  20.627  -3.122  -1.933
    3    HB2  SER 787           HB2      SER 787  18.528  -5.217  -2.448
    4    HB3  SER 787           HB3      SER 787  19.477  -5.021  -0.976
    5    HG   SER 787           HG       SER 787  18.503  -2.855  -0.866

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LYS 788           H        LYS 788  20.315  -4.527  -5.010
    2    HA   LYS 788           HA       LYS 788  21.906  -6.863  -4.445
    3    HB2  LYS 788           HB2      LYS 788  21.665  -7.415  -6.773
    4    HB3  LYS 788           HB3      LYS 788  20.107  -6.941  -6.120
    5    HG2  LYS 788           HG2      LYS 788  20.259  -4.783  -7.186
    6    HG3  LYS 788           HG3      LYS 788  21.903  -5.140  -7.724
    7    HD2  LYS 788           HD2      LYS 788  21.015  -7.046  -9.013
    8    HD3  LYS 788           HD3      LYS 788  19.379  -6.553  -8.574
    9    HE2  LYS 788           HE2      LYS 788  19.704  -4.419  -9.703
   10    HE3  LYS 788           HE3      LYS 788  21.371  -4.853 -10.076
   11    HZ3  LYS 788           HZ1      LYS 788  19.993  -5.252 -11.996
   12    HZ2  LYS 788           HZ2      LYS 788  18.926  -6.166 -11.116
   13    HZ1  LYS 788           HZ3      LYS 788  20.479  -6.741 -11.391

  No H/Q in entry =          13
  In of MODEL   36
    1    H    CYS 789           H        CYS 789  23.720  -7.350  -5.981
    2    HA   CYS 789           HA       CYS 789  25.399  -5.035  -6.573
    3    HB2  CYS 789           HB2      CYS 789  26.340  -6.195  -4.625
    4    HB3  CYS 789           HB3      CYS 789  26.157  -7.747  -5.427

  No H/Q in entry =           4
  In of MODEL   36
    1    H    VAL 790           H        VAL 790  26.302  -5.201  -8.663
    2    HA   VAL 790           HA       VAL 790  25.245  -7.471 -10.151
    3    HB   VAL 790           HB       VAL 790  25.514  -6.144 -12.212
    4   HG11  VAL 790          HG11      VAL 790  23.389  -6.079 -11.059
    5   HG13  VAL 790          HG12      VAL 790  23.727  -4.521 -11.814
    6   HG12  VAL 790          HG13      VAL 790  23.940  -4.724 -10.075
    7   HG22  VAL 790          HG21      VAL 790  27.380  -4.708 -11.551
    8   HG21  VAL 790          HG22      VAL 790  26.351  -3.888 -10.381
    9   HG23  VAL 790          HG23      VAL 790  26.015  -3.739 -12.108

  No H/Q in entry =           9
  In of MODEL   36
    1    H    CYS 791           H        CYS 791  26.524  -8.367 -11.801
    2    HA   CYS 791           HA       CYS 791  29.260  -8.692 -10.853
    3    HB2  CYS 791           HB2      CYS 791  27.646 -10.352 -12.786
    4    HB3  CYS 791           HB3      CYS 791  29.185 -10.787 -12.046

  No H/Q in entry =           4
  In of MODEL   36
    1    H    ARG 792           H        ARG 792  30.761  -7.642 -11.912
    2    HA   ARG 792           HA       ARG 792  30.286  -6.831 -14.660
    3    HB2  ARG 792           HB2      ARG 792  32.472  -6.113 -12.675
    4    HB3  ARG 792           HB3      ARG 792  32.404  -5.526 -14.334
    5    HG2  ARG 792           HG2      ARG 792  30.324  -4.990 -12.206
    6    HG3  ARG 792           HG3      ARG 792  31.564  -3.850 -12.735
    7    HD2  ARG 792           HD2      ARG 792  30.660  -3.823 -14.964
    8    HD3  ARG 792           HD3      ARG 792  29.514  -5.086 -14.565
    9    HE   ARG 792           HE       ARG 792  29.293  -2.660 -13.038
   10   HH11  ARG 792          HH11      ARG 792  28.409  -4.297 -16.022
   11   HH12  ARG 792          HH12      ARG 792  26.859  -3.606 -16.162
   12   HH21  ARG 792          HH21      ARG 792  27.080  -1.592 -13.259
   13   HH22  ARG 792          HH22      ARG 792  26.117  -2.065 -14.555

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLU 793           H        GLU 793  30.828  -8.175 -16.106
    2    HA   GLU 793           HA       GLU 793  32.435 -10.418 -15.430
    3    HB2  GLU 793           HB2      GLU 793  31.024  -9.709 -17.991
    4    HB3  GLU 793           HB3      GLU 793  31.888 -11.217 -17.734
    5    HG2  GLU 793           HG2      GLU 793  30.384 -11.724 -15.858
    6    HG3  GLU 793           HG3      GLU 793  29.468 -10.267 -16.237

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ALA 794           H        ALA 794  33.666 -11.036 -17.868
    2    HA   ALA 794           HA       ALA 794  36.106 -10.078 -17.144
    3    HB2  ALA 794           HB1      ALA 794  35.338 -11.479 -19.691
    4    HB3  ALA 794           HB2      ALA 794  35.704 -12.236 -18.149
    5    HB1  ALA 794           HB3      ALA 794  36.971 -11.362 -19.020

  No H/Q in entry =           5
  In of MODEL   36
    1    H    SER 795           H        SER 795  33.815  -9.137 -19.579
    2    HA   SER 795           HA       SER 795  35.475  -7.588 -21.216
    3    HB2  SER 795           HB2      SER 795  32.482  -7.371 -20.839
    4    HB3  SER 795           HB3      SER 795  33.406  -6.830 -22.242
    5    HG   SER 795           HG       SER 795  33.829  -8.921 -22.792

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLU 796           H        GLU 796  34.137  -7.006 -18.096
    2    HA   GLU 796           HA       GLU 796  34.570  -4.114 -18.359
    3    HB2  GLU 796           HB2      GLU 796  32.684  -5.588 -16.502
    4    HB3  GLU 796           HB3      GLU 796  32.951  -3.851 -16.488
    5    HG2  GLU 796           HG2      GLU 796  32.135  -3.823 -18.869
    6    HG3  GLU 796           HG3      GLU 796  31.661  -5.505 -18.646

  No H/Q in entry =           6
  In of MODEL   36
    1    H    CYS 797           H        CYS 797  36.420  -6.327 -17.740
    2    HA   CYS 797           HA       CYS 797  37.112  -6.253 -14.968
    3    HB2  CYS 797           HB2      CYS 797  37.652  -8.178 -16.358
    4    HB3  CYS 797           HB3      CYS 797  38.648  -7.171 -17.403

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLU 798           H        GLU 798  38.036  -4.559 -13.997
    2    HA   GLU 798           HA       GLU 798  40.048  -3.005 -15.466
    3    HB2  GLU 798           HB2      GLU 798  37.705  -1.902 -13.948
    4    HB3  GLU 798           HB3      GLU 798  39.137  -0.947 -14.298
    5    HG2  GLU 798           HG2      GLU 798  38.783  -1.236 -16.672
    6    HG3  GLU 798           HG3      GLU 798  37.391  -2.270 -16.355

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU 799           H        GLU 799  39.967  -5.037 -13.144
    2    HA   GLU 799           HA       GLU 799  41.520  -3.364 -11.313
    3    HB2  GLU 799           HB2      GLU 799  39.532  -4.418 -10.244
    4    HB3  GLU 799           HB3      GLU 799  40.143  -6.001 -10.692
    5    HG2  GLU 799           HG2      GLU 799  40.568  -5.499  -8.327
    6    HG3  GLU 799           HG3      GLU 799  42.068  -5.693  -9.225

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLU 800           H        GLU 800  43.480  -4.228 -10.531
    2    HA   GLU 800           HA       GLU 800  44.970  -5.592 -12.600
    3    HB2  GLU 800           HB2      GLU 800  46.901  -5.127 -11.170
    4    HB3  GLU 800           HB3      GLU 800  45.978  -3.668 -11.550
    5    HG2  GLU 800           HG2      GLU 800  44.971  -3.791  -9.299
    6    HG3  GLU 800           HG3      GLU 800  45.938  -5.225  -8.964

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLY 801           H        GLY 801  43.157  -7.310 -11.552
    2    HA3  GLY 801           HA2      GLY 801  44.144  -8.813  -9.411
    3    HA2  GLY 801           HA3      GLY 801  42.856  -9.319 -10.503

  No H/Q in entry =           3
  In of MODEL   36
    1    H    PHE 802           H        PHE 802  44.457 -11.170  -9.633
    2    HA   PHE 802           HA       PHE 802  46.840 -11.598 -11.172
    3    HB2  PHE 802           HB2      PHE 802  45.290 -13.409  -9.332
    4    HB3  PHE 802           HB3      PHE 802  46.813 -13.847 -10.097
    5    HD1  PHE 802           HD1      PHE 802  48.892 -12.804  -9.398
    6    HD2  PHE 802           HD2      PHE 802  45.211 -11.795  -7.544
    7    HE1  PHE 802           HE1      PHE 802  50.076 -11.774  -7.608
    8    HE2  PHE 802           HE2      PHE 802  46.425 -10.743  -5.735
    9    HZ   PHE 802           HZ       PHE 802  48.876 -10.732  -5.731

  No H/Q in entry =           9
  In of MODEL   36
    1    H    SER 803           H        SER 803  46.985 -13.963 -12.046
    2    HA   SER 803           HA       SER 803  44.606 -14.591 -13.604
    3    HB2  SER 803           HB2      SER 803  46.420 -13.578 -15.045
    4    HB3  SER 803           HB3      SER 803  47.458 -14.940 -14.611
    5    HG   SER 803           HG       SER 803  44.886 -15.395 -15.645

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ILE 804           H        ILE 804  44.067 -16.689 -13.588
    2    HA   ILE 804           HA       ILE 804  45.722 -18.458 -11.951
    3    HB   ILE 804           HB       ILE 804  43.874 -19.215 -10.612
    4   HG12  ILE 804          HG12      ILE 804  42.024 -18.950 -12.271
    5   HG13  ILE 804          HG13      ILE 804  41.601 -18.331 -10.687
    6   HG23  ILE 804          HG21      ILE 804  43.339 -17.217  -9.274
    7   HG22  ILE 804          HG22      ILE 804  43.966 -16.211 -10.579
    8   HG21  ILE 804          HG23      ILE 804  45.047 -17.308  -9.721
    9   HD11  ILE 804          HD11      ILE 804  42.034 -16.039 -11.528
   10   HD13  ILE 804          HD12      ILE 804  40.750 -16.884 -12.380
   11   HD12  ILE 804          HD13      ILE 804  42.328 -16.720 -13.134

  No H/Q in entry =          11
  In of MODEL   36
    1    H    CYS 805           H        CYS 805  44.753 -20.689 -11.966
    2    HA   CYS 805           HA       CYS 805  43.889 -21.383 -14.689
    3    HB2  CYS 805           HB2      CYS 805  46.116 -22.244 -14.000
    4    HB3  CYS 805           HB3      CYS 805  45.369 -22.977 -12.591

  No H/Q in entry =           4
  In of MODEL   36
    1    H    VAL 806           H        VAL 806  41.934 -21.953 -14.825
    2    HA   VAL 806           HA       VAL 806  40.688 -23.189 -12.507
    3    HB   VAL 806           HB       VAL 806  40.019 -20.812 -12.584
    4   HG11  VAL 806          HG11      VAL 806  39.037 -21.388 -15.320
    5   HG13  VAL 806          HG12      VAL 806  40.376 -20.335 -14.858
    6   HG12  VAL 806          HG13      VAL 806  38.720 -19.913 -14.404
    7   HG23  VAL 806          HG21      VAL 806  37.772 -22.617 -13.440
    8   HG22  VAL 806          HG22      VAL 806  37.608 -21.069 -12.598
    9   HG21  VAL 806          HG23      VAL 806  38.369 -22.441 -11.796

  No H/Q in entry =           9
  In of MODEL   36
    1    H    GLU 807           H        GLU 807  39.656 -24.982 -12.894
    2    HA   GLU 807           HA       GLU 807  39.598 -26.138 -15.541
    3    HB2  GLU 807           HB2      GLU 807  40.276 -27.409 -13.523
    4    HB3  GLU 807           HB3      GLU 807  38.682 -27.168 -12.857
    5    HG2  GLU 807           HG2      GLU 807  37.767 -28.424 -14.824
    6    HG3  GLU 807           HG3      GLU 807  39.430 -28.782 -15.268

  No H/Q in entry =           6
  In of MODEL   36
    1    H    VAL 808           H        VAL 808  38.028 -25.586 -16.789
    2    HA   VAL 808           HA       VAL 808  35.243 -25.549 -15.854
    3    HB   VAL 808           HB       VAL 808  36.430 -23.521 -17.706
    4   HG11  VAL 808          HG11      VAL 808  34.145 -23.835 -18.109
    5   HG13  VAL 808          HG12      VAL 808  34.436 -22.235 -17.431
    6   HG12  VAL 808          HG13      VAL 808  33.746 -23.514 -16.414
    7   HG22  VAL 808          HG21      VAL 808  37.440 -23.055 -15.639
    8   HG21  VAL 808          HG22      VAL 808  35.888 -23.133 -14.812
    9   HG23  VAL 808          HG23      VAL 808  36.219 -21.819 -15.955

  No H/Q in entry =           9
  In of MODEL   36
    1    H    ASN 809           H        ASN 809  34.002 -26.598 -17.356
    2    HA   ASN 809           HA       ASN 809  33.312 -27.619 -19.286
    3    HB2  ASN 809           HB2      ASN 809  35.277 -25.663 -20.390
    4    HB3  ASN 809           HB3      ASN 809  34.641 -26.897 -21.448
    5   HD21  ASN 809          HD21      ASN 809  32.729 -25.400 -18.866
    6   HD22  ASN 809          HD22      ASN 809  31.713 -24.488 -19.909

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLY 810           H        GLY 810  35.745 -28.466 -17.675
    2    HA3  GLY 810           HA2      GLY 810  36.832 -30.511 -17.684
    3    HA2  GLY 810           HA3      GLY 810  36.426 -30.683 -19.397

  No H/Q in entry =           3
  In of MODEL   36
    1    H    LYS 811           H        LYS 811  37.622 -27.656 -18.957
    2    HA   LYS 811           HA       LYS 811  40.377 -28.536 -19.517
    3    HB2  LYS 811           HB2      LYS 811  38.907 -26.191 -20.696
    4    HB3  LYS 811           HB3      LYS 811  40.600 -26.588 -20.960
    5    HG2  LYS 811           HG2      LYS 811  39.949 -28.664 -22.062
    6    HG3  LYS 811           HG3      LYS 811  38.253 -28.292 -21.748
    7    HD2  LYS 811           HD2      LYS 811  38.865 -27.734 -24.031
    8    HD3  LYS 811           HD3      LYS 811  38.424 -26.294 -23.111
    9    HE2  LYS 811           HE2      LYS 811  40.766 -25.747 -22.779
   10    HE3  LYS 811           HE3      LYS 811  41.265 -27.216 -23.602
   11    HZ2  LYS 811           HZ1      LYS 811  39.850 -24.890 -24.808
   12    HZ1  LYS 811           HZ2      LYS 811  40.168 -26.313 -25.624
   13    HZ3  LYS 811           HZ3      LYS 811  41.438 -25.355 -25.080

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLU 812           H        GLU 812  42.004 -27.369 -18.590
    2    HA   GLU 812           HA       GLU 812  41.147 -25.503 -16.517
    3    HB2  GLU 812           HB2      GLU 812  43.840 -26.772 -17.019
    4    HB3  GLU 812           HB3      GLU 812  43.519 -25.617 -15.739
    5    HG2  GLU 812           HG2      GLU 812  41.899 -27.187 -14.777
    6    HG3  GLU 812           HG3      GLU 812  42.311 -28.379 -15.999

  No H/Q in entry =           6
  In of MODEL   36
    1    H    GLN 813           H        GLN 813  40.733 -23.632 -17.423
    2    HA   GLN 813           HA       GLN 813  42.578 -22.600 -19.411
    3    HB2  GLN 813           HB2      GLN 813  40.244 -22.572 -19.964
    4    HB3  GLN 813           HB3      GLN 813  39.849 -21.652 -18.514
    5    HG2  GLN 813           HG2      GLN 813  41.244 -19.831 -19.399
    6    HG3  GLN 813           HG3      GLN 813  41.461 -20.728 -20.898
    7   HE21  GLN 813          HE21      GLN 813  38.612 -21.737 -20.596
    8   HE22  GLN 813          HE22      GLN 813  37.644 -20.425 -21.129

  No H/Q in entry =           8
  In of MODEL   36
    1    H    THR 814           H        THR 814  43.425 -20.525 -19.184
    2    HA   THR 814           HA       THR 814  43.861 -19.717 -16.428
    3    HB   THR 814           HB       THR 814  45.214 -18.884 -18.991
    4    HG1  THR 814           HG1      THR 814  45.164 -21.106 -17.784
    5   HG23  THR 814          HG21      THR 814  46.971 -18.064 -17.479
    6   HG22  THR 814          HG22      THR 814  46.021 -18.600 -16.088
    7   HG21  THR 814          HG23      THR 814  45.427 -17.295 -17.100

  No H/Q in entry =           7
  In of MODEL   36
    1    H    MET 815           H        MET 815  42.700 -18.054 -15.765
    2    HA   MET 815           HA       MET 815  41.672 -16.222 -17.804
    3    HB2  MET 815           HB2      MET 815  40.191 -16.960 -15.279
    4    HB3  MET 815           HB3      MET 815  39.598 -15.994 -16.616
    5    HG2  MET 815           HG2      MET 815  39.839 -18.134 -18.031
    6    HG3  MET 815           HG3      MET 815  40.109 -18.893 -16.467
    7    HE1  MET 815           HE1      MET 815  38.335 -20.553 -17.008
    8    HE3  MET 815           HE2      MET 815  37.897 -19.777 -18.524
    9    HE2  MET 815           HE3      MET 815  36.638 -20.204 -17.351

  No H/Q in entry =           9
  In of MODEL   36
    1    H    SER 816           H        SER 816  41.116 -14.158 -16.826
    2    HA   SER 816           HA       SER 816  43.068 -13.393 -14.887
    3    HB2  SER 816           HB2      SER 816  41.886 -11.136 -15.134
    4    HB3  SER 816           HB3      SER 816  42.673 -11.768 -16.601
    5    HG   SER 816           HG       SER 816  40.529 -12.545 -17.161

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLU 817           H        GLU 817  42.500 -12.406 -12.888
    2    HA   GLU 817           HA       GLU 817  40.926 -13.971 -11.293
    3    HB2  GLU 817           HB2      GLU 817  42.812 -12.428 -10.702
    4    HB3  GLU 817           HB3      GLU 817  41.635 -11.136 -10.863
    5    HG2  GLU 817           HG2      GLU 817  40.588 -11.574  -8.970
    6    HG3  GLU 817           HG3      GLU 817  40.930 -13.315  -9.046

  No H/Q in entry =           6
  In of MODEL   36
    1    H    CYS 818           H        CYS 818  40.112 -10.793 -12.687
    2    HA   CYS 818           HA       CYS 818  37.558 -10.763 -11.458
    3    HB2  CYS 818           HB2      CYS 818  38.438  -9.118 -13.838
    4    HB3  CYS 818           HB3      CYS 818  37.118  -8.758 -12.722

  No H/Q in entry =           4
  In of MODEL   36
    1    H    GLU 819           H        GLU 819  38.803 -12.219 -14.206
    2    HA   GLU 819           HA       GLU 819  36.383 -12.438 -15.713
    3    HB2  GLU 819           HB2      GLU 819  38.552 -12.427 -16.753
    4    HB3  GLU 819           HB3      GLU 819  39.046 -13.809 -15.818
    5    HG2  GLU 819           HG2      GLU 819  37.566 -15.206 -17.007
    6    HG3  GLU 819           HG3      GLU 819  36.907 -13.803 -17.898

  No H/Q in entry =           6
  In of MODEL   36
    1    H    ALA 820           H        ALA 820  38.476 -14.831 -14.075
    2    HA   ALA 820           HA       ALA 820  36.728 -16.947 -14.107
    3    HB2  ALA 820           HB1      ALA 820  38.050 -17.865 -12.235
    4    HB3  ALA 820           HB2      ALA 820  38.807 -16.283 -12.042
    5    HB1  ALA 820           HB3      ALA 820  39.046 -17.204 -13.532

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLY 821           H        GLY 821  37.128 -14.291 -11.817
    2    HA3  GLY 821           HA2      GLY 821  35.365 -15.136  -9.795
    3    HA2  GLY 821           HA3      GLY 821  35.881 -13.479 -10.096

  No H/Q in entry =           3
  In of MODEL   36
    1    H    ALA 822           H        ALA 822  34.843 -13.207 -12.738
    2    HA   ALA 822           HA       ALA 822  32.167 -12.656 -12.106
    3    HB2  ALA 822           HB1      ALA 822  31.913 -12.018 -14.383
    4    HB1  ALA 822           HB2      ALA 822  33.494 -12.701 -14.824
    5    HB3  ALA 822           HB3      ALA 822  33.389 -11.320 -13.730

  No H/Q in entry =           5
  In of MODEL   36
    1    H    LEU 823           H        LEU 823  33.761 -15.302 -13.816
    2    HA   LEU 823           HA       LEU 823  31.410 -16.588 -14.649
    3    HB2  LEU 823           HB2      LEU 823  34.123 -17.718 -13.990
    4    HB3  LEU 823           HB3      LEU 823  32.780 -18.777 -14.343
    5    HG   LEU 823           HG       LEU 823  34.058 -18.621 -16.315
    6   HD13  LEU 823          HD11      LEU 823  32.540 -17.752 -17.942
    7   HD12  LEU 823          HD12      LEU 823  31.764 -16.767 -16.721
    8   HD11  LEU 823          HD13      LEU 823  31.634 -18.525 -16.630
    9   HD21  LEU 823          HD21      LEU 823  33.918 -15.621 -16.118
   10   HD23  LEU 823          HD22      LEU 823  34.598 -16.530 -17.465
   11   HD22  LEU 823          HD23      LEU 823  35.355 -16.612 -15.877

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ARG 824           H        ARG 824  33.153 -16.821 -11.604
    2    HA   ARG 824           HA       ARG 824  31.511 -18.640 -10.218
    3    HB2  ARG 824           HB2      ARG 824  33.088 -16.253  -9.271
    4    HB3  ARG 824           HB3      ARG 824  32.147 -17.228  -8.154
    5    HG2  ARG 824           HG2      ARG 824  33.494 -19.128  -8.559
    6    HG3  ARG 824           HG3      ARG 824  34.318 -18.332  -9.911
    7    HD2  ARG 824           HD2      ARG 824  35.652 -18.425  -7.829
    8    HD3  ARG 824           HD3      ARG 824  35.365 -16.797  -8.418
    9    HE   ARG 824           HE       ARG 824  33.481 -16.829  -6.695
   10   HH11  ARG 824          HH11      ARG 824  36.312 -18.839  -6.166
   11   HH12  ARG 824          HH12      ARG 824  36.622 -18.337  -4.574
   12   HH21  ARG 824          HH21      ARG 824  33.844 -16.096  -4.447
   13   HH22  ARG 824          HH22      ARG 824  35.112 -16.772  -3.544

  No H/Q in entry =          13
  In of MODEL   36
    1    H    CYS 825           H        CYS 825  31.312 -15.156 -10.408
    2    HA   CYS 825           HA       CYS 825  28.999 -14.937  -8.855
    3    HB2  CYS 825           HB2      CYS 825  30.593 -13.092 -10.509
    4    HB3  CYS 825           HB3      CYS 825  29.059 -12.520  -9.886

  No H/Q in entry =           4
  In of MODEL   36
    1    H    ARG 826           H        ARG 826  29.309 -15.407 -12.324
    2    HA   ARG 826           HA       ARG 826  26.537 -14.695 -12.662
    3    HB2  ARG 826           HB2      ARG 826  26.781 -15.483 -14.981
    4    HB3  ARG 826           HB3      ARG 826  27.943 -14.221 -14.558
    5    HG2  ARG 826           HG2      ARG 826  29.650 -15.864 -14.386
    6    HG3  ARG 826           HG3      ARG 826  28.491 -17.168 -14.683
    7    HD2  ARG 826           HD2      ARG 826  29.089 -14.921 -16.605
    8    HD3  ARG 826           HD3      ARG 826  29.792 -16.534 -16.699
    9    HE   ARG 826           HE       ARG 826  27.248 -17.160 -16.710
   10   HH11  ARG 826          HH11      ARG 826  28.664 -14.370 -18.416
   11   HH12  ARG 826          HH12      ARG 826  27.748 -14.605 -19.826
   12   HH21  ARG 826          HH21      ARG 826  25.986 -17.454 -18.641
   13   HH22  ARG 826          HH22      ARG 826  26.159 -16.395 -19.963

  No H/Q in entry =          13
  In of MODEL   36
    1    H    GLY 827           H        GLY 827  28.114 -17.420 -11.580
    2    HA3  GLY 827           HA2      GLY 827  26.762 -19.187 -10.689
    3    HA2  GLY 827           HA3      GLY 827  25.615 -18.863 -11.987

  No H/Q in entry =           3
  In of MODEL   36
    1    H    GLN 828           H        GLN 828  28.593 -18.798 -13.370
    2    HA   GLN 828           HA       GLN 828  28.210 -21.296 -14.658
    3    HB2  GLN 828           HB2      GLN 828  29.313 -19.445 -15.813
    4    HB3  GLN 828           HB3      GLN 828  30.603 -19.440 -14.623
    5    HG2  GLN 828           HG2      GLN 828  31.335 -20.513 -16.706
    6    HG3  GLN 828           HG3      GLN 828  31.306 -21.643 -15.355
    7   HE21  GLN 828          HE21      GLN 828  29.736 -20.713 -18.293
    8   HE22  GLN 828          HE22      GLN 828  28.893 -22.216 -18.509

  No H/Q in entry =           8
  In of MODEL   36
    1    H    SER 829           H        SER 829  29.415 -23.146 -14.502
    2    HA   SER 829           HA       SER 829  30.440 -23.702 -11.881
    3    HB2  SER 829           HB2      SER 829  29.973 -25.489 -14.269
    4    HB3  SER 829           HB3      SER 829  30.311 -26.020 -12.617
    5    HG   SER 829           HG       SER 829  28.402 -24.965 -11.973

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ILE 830           H        ILE 830  32.489 -23.213 -11.593
    2    HA   ILE 830           HA       ILE 830  34.546 -23.927 -13.590
    3    HB   ILE 830           HB       ILE 830  35.779 -21.896 -13.155
    4   HG12  ILE 830          HG12      ILE 830  35.020 -21.551 -10.742
    5   HG13  ILE 830          HG13      ILE 830  35.176 -20.093 -11.700
    6   HG23  ILE 830          HG21      ILE 830  34.391 -20.160 -14.127
    7   HG22  ILE 830          HG22      ILE 830  32.953 -21.125 -13.792
    8   HG21  ILE 830          HG23      ILE 830  34.159 -21.713 -14.933
    9   HD12  ILE 830          HD11      ILE 830  33.180 -20.055 -10.282
   10   HD11  ILE 830          HD12      ILE 830  32.576 -21.492 -11.109
   11   HD13  ILE 830          HD13      ILE 830  32.786 -19.990 -11.993

  No H/Q in entry =          11
  In of MODEL   36
    1    H    SER 831           H        SER 831  36.495 -24.562 -12.517
    2    HA   SER 831           HA       SER 831  36.276 -24.796  -9.615
    3    HB2  SER 831           HB2      SER 831  37.280 -26.762 -11.634
    4    HB3  SER 831           HB3      SER 831  37.399 -26.935  -9.885
    5    HG   SER 831           HG       SER 831  34.874 -26.351 -10.763

  No H/Q in entry =           5
  In of MODEL   36
    1    H    VAL 832           H        VAL 832  37.774 -23.222  -9.023
    2    HA   VAL 832           HA       VAL 832  40.172 -22.769 -10.492
    3    HB   VAL 832           HB       VAL 832  39.568 -21.991  -7.628
    4   HG13  VAL 832          HG11      VAL 832  41.271 -20.235  -7.967
    5   HG12  VAL 832          HG12      VAL 832  41.587 -20.872  -9.582
    6   HG11  VAL 832          HG13      VAL 832  41.943 -21.854  -8.164
    7   HG22  VAL 832          HG21      VAL 832  37.862 -21.086  -9.114
    8   HG21  VAL 832          HG22      VAL 832  39.108 -20.422 -10.168
    9   HG23  VAL 832          HG23      VAL 832  38.909 -19.789  -8.534

  No H/Q in entry =           9
  In of MODEL   36
    1    H    THR 833           H        THR 833  41.596 -24.347 -10.668
    2    HA   THR 833           HA       THR 833  41.925 -26.216  -8.536
    3    HB   THR 833           HB       THR 833  43.446 -27.293 -10.258
    4    HG1  THR 833           HG1      THR 833  43.224 -26.535 -12.357
    5   HG23  THR 833          HG21      THR 833  41.166 -28.084  -9.915
    6   HG22  THR 833          HG22      THR 833  41.542 -28.079 -11.646
    7   HG21  THR 833          HG23      THR 833  40.550 -26.801 -10.957

  No H/Q in entry =           7
  In of MODEL   36
    1    H    SER 834           H        SER 834  43.699 -23.681 -10.184
    2    HA   SER 834           HA       SER 834  45.692 -23.746  -8.062
    3    HB2  SER 834           HB2      SER 834  46.404 -23.700 -11.007
    4    HB3  SER 834           HB3      SER 834  47.540 -23.588  -9.668
    5    HG   SER 834           HG       SER 834  45.977 -25.807 -10.477

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ILE 835           H        ILE 835  46.285 -21.730  -7.463
    2    HA   ILE 835           HA       ILE 835  44.919 -19.557  -8.761
    3    HB   ILE 835           HB       ILE 835  45.711 -18.166  -6.823
    4   HG12  ILE 835          HG12      ILE 835  46.380 -19.552  -4.770
    5   HG13  ILE 835          HG13      ILE 835  46.850 -20.811  -5.904
    6   HG21  ILE 835          HG21      ILE 835  44.183 -20.668  -6.243
    7   HG23  ILE 835          HG22      ILE 835  43.539 -19.137  -6.851
    8   HG22  ILE 835          HG23      ILE 835  44.220 -19.236  -5.215
    9   HD13  ILE 835          HD11      ILE 835  48.468 -19.283  -6.881
   10   HD12  ILE 835          HD12      ILE 835  48.740 -19.505  -5.142
   11   HD11  ILE 835          HD13      ILE 835  47.943 -18.040  -5.746

  No H/Q in entry =          11
  In of MODEL   36
    1    H    ARG 836           H        ARG 836  47.240 -20.885  -9.916
    2    HA   ARG 836           HA       ARG 836  48.982 -18.606 -10.378
    3    HB2  ARG 836           HB2      ARG 836  49.513 -21.550 -10.580
    4    HB3  ARG 836           HB3      ARG 836  50.665 -20.291 -11.037
    5    HG2  ARG 836           HG2      ARG 836  50.729 -19.496  -8.773
    6    HG3  ARG 836           HG3      ARG 836  49.483 -20.656  -8.309
    7    HD2  ARG 836           HD2      ARG 836  52.260 -21.232  -9.256
    8    HD3  ARG 836           HD3      ARG 836  51.545 -21.439  -7.642
    9    HE   ARG 836           HE       ARG 836  50.701 -22.959 -10.024
   10   HH11  ARG 836          HH11      ARG 836  51.405 -22.984  -6.515
   11   HH12  ARG 836          HH12      ARG 836  50.887 -24.603  -6.358
   12   HH21  ARG 836          HH21      ARG 836  50.063 -25.117  -9.736
   13   HH22  ARG 836          HH22      ARG 836  50.131 -25.833  -8.196

  No H/Q in entry =          13
  In of MODEL   36
    1    HA   PRO 837           HA       PRO 837  47.240 -19.131 -14.490
    2    HB2  PRO 837           HB2      PRO 837  49.657 -18.268 -15.847
    3    HB3  PRO 837           HB3      PRO 837  48.144 -17.400 -15.632
    4    HG2  PRO 837           HG2      PRO 837  50.435 -16.643 -14.370
    5    HG3  PRO 837           HG3      PRO 837  48.821 -16.369 -13.704
    6    HD2  PRO 837           HD2      PRO 837  50.797 -18.511 -13.037
    7    HD3  PRO 837           HD3      PRO 837  49.760 -17.549 -11.958

  No H/Q in entry =           7
  In of MODEL   36
    1    H    CYS 838           H        CYS 838  47.150 -20.597 -16.174
    2    HA   CYS 838           HA       CYS 838  49.072 -22.779 -16.054
    3    HB2  CYS 838           HB2      CYS 838  46.558 -23.211 -15.944
    4    HB3  CYS 838           HB3      CYS 838  46.454 -22.559 -17.556

  No H/Q in entry =           4
  In of MODEL   36
    1    H    ALA 839           H        ALA 839  49.255 -23.754 -18.513
    2    HA   ALA 839           HA       ALA 839  50.392 -21.614 -20.113
    3    HB3  ALA 839           HB1      ALA 839  51.361 -23.408 -21.429
    4    HB1  ALA 839           HB2      ALA 839  50.406 -24.590 -20.537
    5    HB2  ALA 839           HB3      ALA 839  51.667 -23.673 -19.708

  No H/Q in entry =           5
  In of MODEL   36
    1    H    ALA 840           H        ALA 840  47.483 -22.024 -19.765
    2    HA   ALA 840           HA       ALA 840  46.349 -23.028 -22.176
    3    HB2  ALA 840           HB1      ALA 840  45.052 -22.797 -20.078
    4    HB3  ALA 840           HB2      ALA 840  44.262 -21.966 -21.415
    5    HB1  ALA 840           HB3      ALA 840  45.172 -21.049 -20.211

  No H/Q in entry =           5
  In of MODEL   36
    1    H    GLU 841           H        GLU 841  47.764 -20.086 -21.221
    2    HA   GLU 841           HA       GLU 841  47.205 -18.939 -23.826
    3    HB2  GLU 841           HB2      GLU 841  48.267 -16.858 -22.853
    4    HB3  GLU 841           HB3      GLU 841  46.746 -17.338 -22.121
    5    HG2  GLU 841           HG2      GLU 841  47.855 -18.160 -20.170
    6    HG3  GLU 841           HG3      GLU 841  49.435 -17.986 -20.933

  No H/Q in entry =           6
  In of MODEL   36
    1    H    THR 842           H        THR 842  48.544 -20.012 -25.104
    2    HA   THR 842           HA       THR 842  51.339 -20.303 -24.323
    3    HB   THR 842           HB       THR 842  49.977 -21.382 -26.784
    4    HG1  THR 842           HG1      THR 842  49.697 -22.099 -24.112
    5   HG22  THR 842          HG21      THR 842  52.337 -22.363 -25.157
    6   HG21  THR 842          HG22      THR 842  52.442 -21.482 -26.679
    7   HG23  THR 842          HG23      THR 842  51.731 -23.095 -26.645

  No H/Q in entry =           7
  In of MODEL   36
    1    H    GLN 843           H        GLN 843  52.579 -18.610 -24.967
    2    HA   GLN 843           HA       GLN 843  51.728 -17.107 -27.321
    3    HB2  GLN 843           HB2      GLN 843  52.146 -15.857 -25.178
    4    HB3  GLN 843           HB3      GLN 843  53.835 -16.330 -25.294
    5    HG2  GLN 843           HG2      GLN 843  54.037 -15.130 -27.416
    6    HG3  GLN 843           HG3      GLN 843  52.346 -14.661 -27.312
    7   HE21  GLN 843          HE21      GLN 843  54.514 -14.730 -24.560
    8   HE22  GLN 843          HE22      GLN 843  54.590 -13.018 -24.346

  No H/Q in entry =           8
  In of MODEL   37
    1    H1   GLY 689           H1       GLY 689  68.755 -10.270 -13.974
    2    H2   GLY 689           H3       GLY 689  68.420 -11.920 -13.835
    3    H3   GLY 689           H2       GLY 689  69.289 -11.128 -12.613
    4    HA2  GLY 689           HA2      GLY 689  70.177 -11.565 -15.391
    5    HA3  GLY 689           HA3      GLY 689  70.767 -12.414 -13.964

  No H/Q in entry =           5
  In of MODEL   37
    1    H    SER 690           H        SER 690  72.775 -11.403 -15.111
    2    HA   SER 690           HA       SER 690  73.741  -9.423 -13.375
    3    HB2  SER 690           HB2      SER 690  75.735  -9.561 -14.939
    4    HB3  SER 690           HB3      SER 690  75.234 -11.085 -14.201
    5    HG   SER 690           HG       SER 690  74.118 -10.370 -16.664

  No H/Q in entry =           5
  In of MODEL   37
    1    H    HIS 691           H        HIS 691  73.390  -7.296 -13.524
    2    HA   HIS 691           HA       HIS 691  72.485  -6.171 -16.008
    3    HB2  HIS 691           HB2      HIS 691  72.392  -3.962 -14.784
    4    HB3  HIS 691           HB3      HIS 691  71.423  -5.212 -14.038
    5    HD1  HIS 691           HD1      HIS 691  71.789  -5.558 -11.564
    6    HD2  HIS 691           HD2      HIS 691  74.857  -3.377 -13.324
    7    HE1  HIS 691           HE1      HIS 691  73.212  -4.739  -9.672
    8    HE2  HIS 691           HE2      HIS 691  74.851  -3.178 -10.763

  No H/Q in entry =           8
  In of MODEL   37
    1    H    MET 692           H        MET 692  73.701  -5.473 -17.532
    2    HA   MET 692           HA       MET 692  76.577  -5.379 -17.012
    3    HB2  MET 692           HB2      MET 692  75.093  -5.559 -19.630
    4    HB3  MET 692           HB3      MET 692  76.834  -5.638 -19.436
    5    HG2  MET 692           HG2      MET 692  76.579  -7.697 -18.129
    6    HG3  MET 692           HG3      MET 692  74.837  -7.615 -18.366
    7    HE3  MET 692           HE1      MET 692  75.747 -10.613 -20.648
    8    HE2  MET 692           HE2      MET 692  74.692 -10.010 -19.372
    9    HE1  MET 692           HE3      MET 692  76.417 -10.214 -19.065

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ASN 693           H        ASN 693  73.923  -3.442 -18.070
    2    HA   ASN 693           HA       ASN 693  75.679  -1.344 -19.058
    3    HB2  ASN 693           HB2      ASN 693  72.651  -1.353 -18.832
    4    HB3  ASN 693           HB3      ASN 693  73.611  -0.135 -19.651
    5   HD21  ASN 693          HD21      ASN 693  71.454  -1.685 -20.697
    6   HD22  ASN 693          HD22      ASN 693  72.073  -2.612 -22.009

  No H/Q in entry =           6
  In of MODEL   37
    1    HA   PRO 694           HA       PRO 694  75.740   0.639 -14.987
    2    HB2  PRO 694           HB2      PRO 694  76.437   3.162 -15.964
    3    HB3  PRO 694           HB3      PRO 694  77.588   1.890 -15.546
    4    HG2  PRO 694           HG2      PRO 694  76.525   2.677 -18.219
    5    HG3  PRO 694           HG3      PRO 694  78.154   2.149 -17.770
    6    HD2  PRO 694           HD2      PRO 694  76.426   0.526 -19.017
    7    HD3  PRO 694           HD3      PRO 694  77.569  -0.095 -17.811

  No H/Q in entry =           7
  In of MODEL   37
    1    H    LEU 695           H        LEU 695  74.516   2.480 -17.747
    2    HA   LEU 695           HA       LEU 695  72.223   3.384 -16.212
    3    HB2  LEU 695           HB2      LEU 695  73.490   4.786 -18.017
    4    HB3  LEU 695           HB3      LEU 695  72.762   3.720 -19.187
    5    HG   LEU 695           HG       LEU 695  71.241   5.591 -17.350
    6   HD13  LEU 695          HD11      LEU 695  72.515   6.828 -18.940
    7   HD12  LEU 695          HD12      LEU 695  70.811   6.862 -19.409
    8   HD11  LEU 695          HD13      LEU 695  71.940   5.810 -20.256
    9   HD21  LEU 695          HD21      LEU 695  69.892   3.646 -18.001
   10   HD23  LEU 695          HD22      LEU 695  70.256   3.960 -19.698
   11   HD22  LEU 695          HD23      LEU 695  69.301   5.117 -18.774

  No H/Q in entry =          11
  In of MODEL   37
    1    H    THR 696           H        THR 696  71.342   1.405 -15.756
    2    HA   THR 696           HA       THR 696  71.120  -0.670 -17.676
    3    HB   THR 696           HB       THR 696  69.588  -0.545 -15.092
    4    HG1  THR 696           HG1      THR 696  72.399  -0.811 -15.530
    5   HG22  THR 696          HG21      THR 696  71.126  -2.739 -16.489
    6   HG21  THR 696          HG22      THR 696  69.390  -2.489 -16.633
    7   HG23  THR 696          HG23      THR 696  70.093  -2.924 -15.069

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLN 697           H        GLN 697  68.991   1.734 -16.259
    2    HA   GLN 697           HA       GLN 697  66.866   2.353 -16.531
    3    HB2  GLN 697           HB2      GLN 697  67.878   3.021 -18.760
    4    HB3  GLN 697           HB3      GLN 697  67.244   1.526 -19.427
    5    HG2  GLN 697           HG2      GLN 697  65.824   3.444 -19.972
    6    HG3  GLN 697           HG3      GLN 697  64.964   2.264 -18.985
    7   HE21  GLN 697          HE21      GLN 697  64.462   5.087 -19.430
    8   HE22  GLN 697          HE22      GLN 697  64.481   5.842 -17.875

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ALA 698           H        ALA 698  67.200  -0.040 -15.497
    2    HA   ALA 698           HA       ALA 698  65.531  -1.960 -16.841
    3    HB3  ALA 698           HB1      ALA 698  66.957  -2.126 -14.190
    4    HB1  ALA 698           HB2      ALA 698  67.543  -2.766 -15.728
    5    HB2  ALA 698           HB3      ALA 698  66.101  -3.446 -14.982

  No H/Q in entry =           5
  In of MODEL   37
    1    H    VAL 699           H        VAL 699  63.517  -1.162 -16.789
    2    HA   VAL 699           HA       VAL 699  62.330  -0.606 -14.205
    3    HB   VAL 699           HB       VAL 699  61.008  -0.863 -16.938
    4   HG13  VAL 699          HG11      VAL 699  59.116   0.321 -15.915
    5   HG12  VAL 699          HG12      VAL 699  59.963   0.324 -14.368
    6   HG11  VAL 699          HG13      VAL 699  59.456  -1.202 -15.092
    7   HG22  VAL 699          HG21      VAL 699  60.944   1.595 -16.991
    8   HG21  VAL 699          HG22      VAL 699  62.600   0.992 -16.945
    9   HG23  VAL 699          HG23      VAL 699  61.857   1.648 -15.483

  No H/Q in entry =           9
  In of MODEL   37
    1    HA   PRO 700           HA       PRO 700  61.914  -5.062 -14.344
    2    HB2  PRO 700           HB2      PRO 700  61.387  -5.197 -11.578
    3    HB3  PRO 700           HB3      PRO 700  62.928  -5.494 -12.383
    4    HG2  PRO 700           HG2      PRO 700  62.293  -3.340 -10.670
    5    HG3  PRO 700           HG3      PRO 700  63.759  -3.535 -11.643
    6    HD2  PRO 700           HD2      PRO 700  61.391  -1.837 -12.142
    7    HD3  PRO 700           HD3      PRO 700  63.051  -1.708 -12.750

  No H/Q in entry =           7
  In of MODEL   37
    1    H    LYS 701           H        LYS 701  60.213  -6.082 -14.849
    2    HA   LYS 701           HA       LYS 701  57.636  -5.133 -14.041
    3    HB2  LYS 701           HB2      LYS 701  58.443  -7.526 -15.692
    4    HB3  LYS 701           HB3      LYS 701  56.788  -6.994 -15.420
    5    HG2  LYS 701           HG2      LYS 701  57.236  -4.900 -16.532
    6    HG3  LYS 701           HG3      LYS 701  58.927  -5.358 -16.744
    7    HD2  LYS 701           HD2      LYS 701  58.263  -7.226 -18.090
    8    HD3  LYS 701           HD3      LYS 701  56.556  -6.801 -17.889
    9    HE2  LYS 701           HE2      LYS 701  58.676  -5.120 -19.255
   10    HE3  LYS 701           HE3      LYS 701  57.368  -5.990 -20.052
   11    HZ2  LYS 701           HZ1      LYS 701  57.043  -3.726 -18.155
   12    HZ1  LYS 701           HZ2      LYS 701  55.788  -4.597 -18.871
   13    HZ3  LYS 701           HZ3      LYS 701  56.819  -3.677 -19.826

  No H/Q in entry =          13
  In of MODEL   37
    1    H    CYS 702           H        CYS 702  56.667  -5.839 -12.326
    2    HA   CYS 702           HA       CYS 702  57.976  -7.945 -10.788
    3    HB2  CYS 702           HB2      CYS 702  55.992  -5.866  -9.849
    4    HB3  CYS 702           HB3      CYS 702  57.080  -6.848  -8.878

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLN 703           H        GLN 703  56.696  -9.631  -9.994
    2    HA   GLN 703           HA       GLN 703  54.418 -10.220 -11.583
    3    HB2  GLN 703           HB2      GLN 703  55.622 -11.618  -9.203
    4    HB3  GLN 703           HB3      GLN 703  54.313 -12.266 -10.181
    5    HG2  GLN 703           HG2      GLN 703  57.058 -11.579 -11.207
    6    HG3  GLN 703           HG3      GLN 703  56.507 -13.201 -10.783
    7   HE21  GLN 703          HE21      GLN 703  55.076 -14.222 -12.102
    8   HE22  GLN 703          HE22      GLN 703  54.710 -13.706 -13.701

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ARG 704           H        ARG 704  52.542 -11.277 -10.235
    2    HA   ARG 704           HA       ARG 704  51.101  -9.014  -9.594
    3    HB2  ARG 704           HB2      ARG 704  50.419 -11.123 -10.704
    4    HB3  ARG 704           HB3      ARG 704  50.377 -11.858  -9.113
    5    HG2  ARG 704           HG2      ARG 704  48.231 -11.309  -9.699
    6    HG3  ARG 704           HG3      ARG 704  48.741 -10.170  -8.456
    7    HD2  ARG 704           HD2      ARG 704  48.894  -9.497 -11.376
    8    HD3  ARG 704           HD3      ARG 704  47.395  -9.276 -10.456
    9    HE   ARG 704           HE       ARG 704  49.873  -7.916  -9.609
   10   HH11  ARG 704          HH11      ARG 704  46.499  -7.721 -10.740
   11   HH12  ARG 704          HH12      ARG 704  46.436  -6.030 -10.612
   12   HH21  ARG 704          HH21      ARG 704  49.770  -5.644  -9.475
   13   HH22  ARG 704          HH22      ARG 704  48.323  -4.819  -9.899

  No H/Q in entry =          13
  In of MODEL   37
    1    H    TRP 705           H        TRP 705  52.961 -11.087  -7.589
    2    HA   TRP 705           HA       TRP 705  51.680 -10.148  -5.123
    3    HB2  TRP 705           HB2      TRP 705  52.958 -12.026  -4.084
    4    HB3  TRP 705           HB3      TRP 705  51.798 -12.503  -5.327
    5    HD1  TRP 705           HD1      TRP 705  55.558 -12.404  -4.659
    6    HE1  TRP 705           HE1      TRP 705  56.758 -13.818  -6.405
    7    HE3  TRP 705           HE3      TRP 705  51.592 -13.407  -7.710
    8    HZ2  TRP 705           HZ2      TRP 705  56.109 -15.215  -8.789
    9    HZ3  TRP 705           HZ3      TRP 705  51.963 -14.783  -9.704
   10    HH2  TRP 705           HH2      TRP 705  54.174 -15.674 -10.235

  No H/Q in entry =          10
  In of MODEL   37
    1    H    GLU 706           H        GLU 706  53.879  -9.044  -7.135
    2    HA   GLU 706           HA       GLU 706  55.802  -8.282  -5.067
    3    HB2  GLU 706           HB2      GLU 706  56.361  -8.562  -8.046
    4    HB3  GLU 706           HB3      GLU 706  57.493  -8.140  -6.783
    5    HG2  GLU 706           HG2      GLU 706  57.301 -10.345  -5.828
    6    HG3  GLU 706           HG3      GLU 706  56.093 -10.780  -7.037

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LYS 707           H        LYS 707  56.838  -6.167  -5.637
    2    HA   LYS 707           HA       LYS 707  55.137  -4.442  -7.229
    3    HB2  LYS 707           HB2      LYS 707  55.054  -2.690  -5.524
    4    HB3  LYS 707           HB3      LYS 707  54.211  -4.135  -4.995
    5    HG2  LYS 707           HG2      LYS 707  55.719  -4.562  -3.323
    6    HG3  LYS 707           HG3      LYS 707  57.053  -3.796  -4.185
    7    HD2  LYS 707           HD2      LYS 707  56.363  -2.498  -2.207
    8    HD3  LYS 707           HD3      LYS 707  56.148  -1.595  -3.702
    9    HE2  LYS 707           HE2      LYS 707  53.739  -2.242  -3.660
   10    HE3  LYS 707           HE3      LYS 707  54.011  -2.981  -2.084
   11    HZ1  LYS 707           HZ1      LYS 707  54.453  -0.110  -2.716
   12    HZ3  LYS 707           HZ2      LYS 707  54.636  -0.812  -1.206
   13    HZ2  LYS 707           HZ3      LYS 707  53.119  -0.738  -1.915

  No H/Q in entry =          13
  In of MODEL   37
    1    H    LEU 708           H        LEU 708  56.107  -2.521  -7.817
    2    HA   LEU 708           HA       LEU 708  58.998  -2.620  -7.960
    3    HB2  LEU 708           HB2      LEU 708  57.828  -2.214 -10.010
    4    HB3  LEU 708           HB3      LEU 708  56.886  -0.922  -9.290
    5    HG   LEU 708           HG       LEU 708  58.965   0.423  -9.089
    6   HD11  LEU 708          HD11      LEU 708  60.165  -1.864 -10.597
    7   HD13  LEU 708          HD12      LEU 708  60.614  -1.290  -8.988
    8   HD12  LEU 708          HD13      LEU 708  60.925  -0.284 -10.407
    9   HD23  LEU 708          HD21      LEU 708  58.333  -0.541 -11.873
   10   HD22  LEU 708          HD22      LEU 708  59.164   0.961 -11.459
   11   HD21  LEU 708          HD23      LEU 708  57.479   0.728 -10.993

  No H/Q in entry =          11
  In of MODEL   37
    1    H    GLN 709           H        GLN 709  60.090  -1.627  -6.397
    2    HA   GLN 709           HA       GLN 709  59.298   1.056  -5.679
    3    HB2  GLN 709           HB2      GLN 709  59.390   0.759  -3.323
    4    HB3  GLN 709           HB3      GLN 709  58.370  -0.554  -3.884
    5    HG2  GLN 709           HG2      GLN 709  60.278  -2.106  -3.700
    6    HG3  GLN 709           HG3      GLN 709  61.288  -0.758  -3.171
    7   HE21  GLN 709          HE21      GLN 709  61.760  -1.794  -1.254
    8   HE22  GLN 709          HE22      GLN 709  60.628  -1.897   0.042

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ASN 710           H        ASN 710  61.152   2.259  -5.104
    2    HA   ASN 710           HA       ASN 710  63.404   2.789  -4.906
    3    HB2  ASN 710           HB2      ASN 710  63.085   1.073  -3.044
    4    HB3  ASN 710           HB3      ASN 710  63.706  -0.140  -4.137
    5   HD21  ASN 710          HD21      ASN 710  64.394   2.467  -2.096
    6   HD22  ASN 710          HD22      ASN 710  66.119   2.337  -2.083

  No H/Q in entry =           6
  In of MODEL   37
    1    H    SER 711           H        SER 711  62.240   1.710  -7.438
    2    HA   SER 711           HA       SER 711  62.814   1.184  -9.532
    3    HB2  SER 711           HB2      SER 711  65.600   1.752  -8.529
    4    HB3  SER 711           HB3      SER 711  65.177   1.569 -10.243
    5    HG   SER 711           HG       SER 711  64.181   3.493  -8.407

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ARG 712           H        ARG 712  62.831  -0.938  -7.345
    2    HA   ARG 712           HA       ARG 712  64.058  -3.019  -8.975
    3    HB2  ARG 712           HB2      ARG 712  64.906  -4.154  -6.982
    4    HB3  ARG 712           HB3      ARG 712  65.621  -2.555  -7.120
    5    HG2  ARG 712           HG2      ARG 712  64.097  -1.708  -5.452
    6    HG3  ARG 712           HG3      ARG 712  63.313  -3.278  -5.336
    7    HD2  ARG 712           HD2      ARG 712  66.189  -2.681  -4.714
    8    HD3  ARG 712           HD3      ARG 712  64.899  -2.903  -3.520
    9    HE   ARG 712           HE       ARG 712  65.672  -5.048  -5.383
   10   HH11  ARG 712          HH11      ARG 712  65.036  -3.978  -2.067
   11   HH12  ARG 712          HH12      ARG 712  65.468  -5.464  -1.374
   12   HH21  ARG 712          HH21      ARG 712  66.251  -7.032  -4.446
   13   HH22  ARG 712          HH22      ARG 712  66.182  -7.269  -2.755

  No H/Q in entry =          13
  In of MODEL   37
    1    H    CYS 713           H        CYS 713  63.328  -5.187  -7.711
    2    HA   CYS 713           HA       CYS 713  60.421  -4.941  -7.482
    3    HB2  CYS 713           HB2      CYS 713  60.980  -6.083  -9.531
    4    HB3  CYS 713           HB3      CYS 713  62.088  -7.167  -8.685

  No H/Q in entry =           4
  In of MODEL   37
    1    H    VAL 714           H        VAL 714  59.631  -5.557  -5.616
    2    HA   VAL 714           HA       VAL 714  61.059  -7.525  -3.981
    3    HB   VAL 714           HB       VAL 714  60.467  -6.274  -1.937
    4   HG11  VAL 714          HG11      VAL 714  62.007  -4.565  -3.880
    5   HG13  VAL 714          HG12      VAL 714  62.664  -5.838  -2.849
    6   HG12  VAL 714          HG13      VAL 714  61.997  -4.375  -2.127
    7   HG21  VAL 714          HG21      VAL 714  59.449  -4.138  -3.806
    8   HG23  VAL 714          HG22      VAL 714  59.614  -3.966  -2.059
    9   HG22  VAL 714          HG23      VAL 714  58.474  -5.133  -2.729

  No H/Q in entry =           9
  In of MODEL   37
    1    H    CYS 715           H        CYS 715  59.358  -8.188  -2.172
    2    HA   CYS 715           HA       CYS 715  56.954  -8.814  -3.640
    3    HB2  CYS 715           HB2      CYS 715  57.790  -9.621  -0.846
    4    HB3  CYS 715           HB3      CYS 715  56.460 -10.306  -1.769

  No H/Q in entry =           4
  In of MODEL   37
    1    H    LYS 716           H        LYS 716  54.832  -8.414  -2.589
    2    HA   LYS 716           HA       LYS 716  54.906  -5.681  -1.625
    3    HB2  LYS 716           HB2      LYS 716  52.469  -5.625  -2.088
    4    HB3  LYS 716           HB3      LYS 716  53.390  -6.129  -3.495
    5    HG2  LYS 716           HG2      LYS 716  52.880  -8.486  -2.851
    6    HG3  LYS 716           HG3      LYS 716  51.781  -7.839  -1.643
    7    HD2  LYS 716           HD2      LYS 716  51.556  -7.294  -4.611
    8    HD3  LYS 716           HD3      LYS 716  50.724  -8.603  -3.794
    9    HE2  LYS 716           HE2      LYS 716  49.126  -6.906  -4.001
   10    HE3  LYS 716           HE3      LYS 716  49.663  -6.808  -2.332
   11    HZ2  LYS 716           HZ1      LYS 716  49.373  -4.706  -3.566
   12    HZ1  LYS 716           HZ2      LYS 716  50.775  -5.066  -4.459
   13    HZ3  LYS 716           HZ3      LYS 716  50.848  -4.832  -2.774

  No H/Q in entry =          13
  In of MODEL   37
    1    H    MET 717           H        MET 717  52.819  -5.328  -0.059
    2    HA   MET 717           HA       MET 717  53.784  -6.646   2.351
    3    HB2  MET 717           HB2      MET 717  51.741  -4.471   1.999
    4    HB3  MET 717           HB3      MET 717  52.434  -4.984   3.520
    5    HG2  MET 717           HG2      MET 717  53.995  -3.687   1.283
    6    HG3  MET 717           HG3      MET 717  53.280  -2.814   2.625
    7    HE1  MET 717           HE1      MET 717  56.245  -4.914   1.315
    8    HE3  MET 717           HE2      MET 717  55.600  -6.198   2.353
    9    HE2  MET 717           HE3      MET 717  57.107  -5.403   2.767

  No H/Q in entry =           9
  In of MODEL   37
    1    HA   PRO 718           HA       PRO 718  50.440  -9.594   2.307
    2    HB2  PRO 718           HB2      PRO 718  50.597 -10.334   4.962
    3    HB3  PRO 718           HB3      PRO 718  51.634 -10.988   3.690
    4    HG2  PRO 718           HG2      PRO 718  52.200  -8.841   5.684
    5    HG3  PRO 718           HG3      PRO 718  53.271 -10.116   5.077
    6    HD2  PRO 718           HD2      PRO 718  53.429  -7.559   4.227
    7    HD3  PRO 718           HD3      PRO 718  53.794  -8.931   3.161

  No H/Q in entry =           7
  In of MODEL   37
    1    H    TYR 719           H        TYR 719  50.681  -6.948   4.462
    2    HA   TYR 719           HA       TYR 719  47.909  -7.111   5.288
    3    HB2  TYR 719           HB2      TYR 719  48.472  -5.075   6.656
    4    HB3  TYR 719           HB3      TYR 719  49.431  -6.501   7.031
    5    HD1  TYR 719           HD1      TYR 719  49.493  -3.065   5.909
    6    HD2  TYR 719           HD2      TYR 719  51.839  -6.611   6.225
    7    HE1  TYR 719           HE1      TYR 719  51.540  -1.741   5.638
    8    HE2  TYR 719           HE2      TYR 719  53.877  -5.286   5.974
    9    HH   TYR 719           HH       TYR 719  54.556  -3.182   5.022

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLU 720           H        GLU 720  49.509  -5.990   2.664
    2    HA   GLU 720           HA       GLU 720  47.832  -3.651   2.173
    3    HB2  GLU 720           HB2      GLU 720  50.136  -3.383   1.594
    4    HB3  GLU 720           HB3      GLU 720  50.167  -4.912   0.722
    5    HG2  GLU 720           HG2      GLU 720  48.712  -3.901  -0.987
    6    HG3  GLU 720           HG3      GLU 720  48.765  -2.378  -0.099

  No H/Q in entry =           6
  In of MODEL   37
    1    H    CYS 721           H        CYS 721  48.100  -6.973   1.536
    2    HA   CYS 721           HA       CYS 721  46.912  -7.422  -0.907
    3    HB2  CYS 721           HB2      CYS 721  46.629  -9.055   1.620
    4    HB3  CYS 721           HB3      CYS 721  46.367  -9.630  -0.024

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLY 722           H        GLY 722  44.930  -6.950  -1.659
    2    HA3  GLY 722           HA2      GLY 722  42.741  -6.900   0.281
    3    HA2  GLY 722           HA3      GLY 722  42.955  -5.575  -0.853

  No H/Q in entry =           3
  In of MODEL   37
    1    HA   PRO 723           HA       PRO 723  40.078  -7.640  -3.449
    2    HB2  PRO 723           HB2      PRO 723  40.879  -6.533  -5.855
    3    HB3  PRO 723           HB3      PRO 723  39.796  -5.749  -4.701
    4    HG2  PRO 723           HG2      PRO 723  42.727  -5.357  -5.125
    5    HG3  PRO 723           HG3      PRO 723  41.471  -4.158  -4.766
    6    HD2  PRO 723           HD2      PRO 723  43.170  -5.049  -2.889
    7    HD3  PRO 723           HD3      PRO 723  41.486  -4.639  -2.504

  No H/Q in entry =           7
  In of MODEL   37
    1    H    SER 724           H        SER 724  40.295  -9.733  -3.817
    2    HA   SER 724           HA       SER 724  41.555 -10.783  -6.040
    3    HB2  SER 724           HB2      SER 724  42.998 -12.373  -4.635
    4    HB3  SER 724           HB3      SER 724  43.652 -10.764  -4.943
    5    HG   SER 724           HG       SER 724  42.569 -10.292  -2.832

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU 725           H        LEU 725  41.274 -13.173  -5.970
    2    HA   LEU 725           HA       LEU 725  38.573 -13.719  -5.176
    3    HB2  LEU 725           HB2      LEU 725  40.735 -15.191  -6.547
    4    HB3  LEU 725           HB3      LEU 725  39.399 -16.139  -5.906
    5    HG   LEU 725           HG       LEU 725  38.996 -13.848  -7.841
    6   HD13  LEU 725          HD11      LEU 725  38.906 -15.553  -9.610
    7   HD12  LEU 725          HD12      LEU 725  39.327 -16.803  -8.446
    8   HD11  LEU 725          HD13      LEU 725  40.503 -15.557  -8.862
    9   HD21  LEU 725          HD21      LEU 725  37.340 -16.261  -7.128
   10   HD23  LEU 725          HD22      LEU 725  36.922 -15.013  -8.305
   11   HD22  LEU 725          HD23      LEU 725  37.046 -14.601  -6.598

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ASP 726           H        ASP 726  37.858 -14.676  -3.391
    2    HA   ASP 726           HA       ASP 726  39.725 -15.352  -1.336
    3    HB2  ASP 726           HB2      ASP 726  36.706 -15.610  -1.441
    4    HB3  ASP 726           HB3      ASP 726  37.682 -15.992  -0.028

  No H/Q in entry =           4
  In of MODEL   37
    1    H    VAL 727           H        VAL 727  40.464 -17.277  -0.820
    2    HA   VAL 727           HA       VAL 727  39.427 -19.586  -2.278
    3    HB   VAL 727           HB       VAL 727  41.744 -20.349  -2.800
    4   HG12  VAL 727          HG11      VAL 727  40.968 -17.714  -4.042
    5   HG11  VAL 727          HG12      VAL 727  40.385 -19.305  -4.526
    6   HG13  VAL 727          HG13      VAL 727  42.079 -18.888  -4.746
    7   HG23  VAL 727          HG21      VAL 727  43.585 -18.709  -2.784
    8   HG22  VAL 727          HG22      VAL 727  42.980 -19.034  -1.160
    9   HG21  VAL 727          HG23      VAL 727  42.526 -17.542  -1.987

  No H/Q in entry =           9
  In of MODEL   37
    1    H    CYS 728           H        CYS 728  40.428 -21.613  -1.543
    2    HA   CYS 728           HA       CYS 728  40.380 -21.767   1.368
    3    HB2  CYS 728           HB2      CYS 728  40.408 -24.228   0.513
    4    HB3  CYS 728           HB3      CYS 728  38.899 -23.368   0.605

  No H/Q in entry =           4
  In of MODEL   37
    1    H    ALA 729           H        ALA 729  42.276 -22.083   2.401
    2    HA   ALA 729           HA       ALA 729  44.212 -23.665   0.986
    3    HB1  ALA 729           HB1      ALA 729  44.852 -21.124   2.449
    4    HB3  ALA 729           HB2      ALA 729  44.875 -21.381   0.693
    5    HB2  ALA 729           HB3      ALA 729  46.017 -22.238   1.718

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLN 730           H        GLN 730  45.726 -24.581   2.352
    2    HA   GLN 730           HA       GLN 730  44.667 -25.155   5.017
    3    HB2  GLN 730           HB2      GLN 730  44.810 -27.091   3.426
    4    HB3  GLN 730           HB3      GLN 730  46.532 -26.797   3.317
    5    HG2  GLN 730           HG2      GLN 730  46.860 -27.266   5.614
    6    HG3  GLN 730           HG3      GLN 730  45.138 -27.419   5.899
    7   HE21  GLN 730          HE21      GLN 730  45.216 -29.535   6.589
    8   HE22  GLN 730          HE22      GLN 730  45.653 -30.844   5.568

  No H/Q in entry =           8
  In of MODEL   37
    1    H    ASP 731           H        ASP 731  45.896 -24.648   6.632
    2    HA   ASP 731           HA       ASP 731  48.387 -23.275   6.244
    3    HB2  ASP 731           HB2      ASP 731  46.877 -22.513   8.028
    4    HB3  ASP 731           HB3      ASP 731  46.922 -24.101   8.742

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLU 732           H        GLU 732  50.404 -24.145   6.458
    2    HA   GLU 732           HA       GLU 732  50.550 -26.974   6.711
    3    HB2  GLU 732           HB2      GLU 732  52.660 -24.886   6.271
    4    HB3  GLU 732           HB3      GLU 732  53.057 -26.580   6.522
    5    HG2  GLU 732           HG2      GLU 732  51.309 -25.487   4.333
    6    HG3  GLU 732           HG3      GLU 732  52.968 -26.063   4.158

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ARG 733           H        ARG 733  50.681 -24.472   8.969
    2    HA   ARG 733           HA       ARG 733  52.261 -25.950  10.874
    3    HB2  ARG 733           HB2      ARG 733  52.304 -23.479  10.855
    4    HB3  ARG 733           HB3      ARG 733  50.588 -23.456  11.209
    5    HG2  ARG 733           HG2      ARG 733  51.838 -22.985  13.215
    6    HG3  ARG 733           HG3      ARG 733  51.034 -24.548  13.369
    7    HD2  ARG 733           HD2      ARG 733  53.317 -24.680  14.209
    8    HD3  ARG 733           HD3      ARG 733  53.107 -25.672  12.761
    9    HE   ARG 733           HE       ARG 733  54.026 -23.052  12.168
   10   HH11  ARG 733          HH11      ARG 733  55.114 -26.278  13.186
   11   HH12  ARG 733          HH12      ARG 733  56.702 -26.071  12.619
   12   HH21  ARG 733          HH21      ARG 733  56.230 -22.778  11.395
   13   HH22  ARG 733          HH22      ARG 733  57.338 -24.079  11.567

  No H/Q in entry =          13
  In of MODEL   37
    1    H    SER 734           H        SER 734  48.923 -24.731  10.853
    2    HA   SER 734           HA       SER 734  48.162 -26.487  13.007
    3    HB2  SER 734           HB2      SER 734  46.414 -24.681  11.362
    4    HB3  SER 734           HB3      SER 734  46.172 -25.196  13.039
    5    HG   SER 734           HG       SER 734  47.935 -23.349  11.923

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LYS 735           H        LYS 735  48.242 -26.719   9.618
    2    HA   LYS 735           HA       LYS 735  47.455 -28.081   8.065
    3    HB2  LYS 735           HB2      LYS 735  47.001 -29.964  10.380
    4    HB3  LYS 735           HB3      LYS 735  46.959 -30.428   8.685
    5    HG2  LYS 735           HG2      LYS 735  49.338 -29.437  10.255
    6    HG3  LYS 735           HG3      LYS 735  49.089 -31.054   9.608
    7    HD2  LYS 735           HD2      LYS 735  49.492 -28.517   8.004
    8    HD3  LYS 735           HD3      LYS 735  50.669 -29.795   8.246
    9    HE2  LYS 735           HE2      LYS 735  48.032 -30.063   6.786
   10    HE3  LYS 735           HE3      LYS 735  49.614 -29.922   6.038
   11    HZ1  LYS 735           HZ1      LYS 735  48.747 -32.145   7.800
   12    HZ3  LYS 735           HZ2      LYS 735  50.233 -32.051   7.005
   13    HZ2  LYS 735           HZ3      LYS 735  48.811 -32.209   6.138

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ARG 736           H        ARG 736  45.552 -26.253   9.292
    2    HA   ARG 736           HA       ARG 736  43.088 -27.756   8.785
    3    HB2  ARG 736           HB2      ARG 736  41.895 -26.072  10.025
    4    HB3  ARG 736           HB3      ARG 736  43.163 -26.788  11.009
    5    HG2  ARG 736           HG2      ARG 736  44.531 -24.864  10.741
    6    HG3  ARG 736           HG3      ARG 736  43.392 -24.165   9.581
    7    HD2  ARG 736           HD2      ARG 736  42.801 -24.802  12.458
    8    HD3  ARG 736           HD3      ARG 736  43.161 -23.220  11.757
    9    HE   ARG 736           HE       ARG 736  41.154 -23.646  10.312
   10   HH11  ARG 736          HH11      ARG 736  41.381 -24.922  13.610
   11   HH12  ARG 736          HH12      ARG 736  39.705 -24.923  13.872
   12   HH21  ARG 736          HH21      ARG 736  38.805 -23.634  10.701
   13   HH22  ARG 736          HH22      ARG 736  38.233 -24.197  12.196

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ILE 737           H        ILE 737  41.360 -26.466   7.795
    2    HA   ILE 737           HA       ILE 737  42.416 -25.098   5.455
    3    HB   ILE 737           HB       ILE 737  39.531 -25.740   6.102
    4   HG12  ILE 737          HG12      ILE 737  40.961 -27.812   6.150
    5   HG13  ILE 737          HG13      ILE 737  39.715 -27.823   4.909
    6   HG23  ILE 737          HG21      ILE 737  39.218 -25.595   3.683
    7   HG22  ILE 737          HG22      ILE 737  40.939 -25.345   3.451
    8   HG21  ILE 737          HG23      ILE 737  39.977 -24.112   4.270
    9   HD12  ILE 737          HD11      ILE 737  42.636 -27.239   4.507
   10   HD11  ILE 737          HD12      ILE 737  41.373 -27.153   3.279
   11   HD13  ILE 737          HD13      ILE 737  41.763 -28.710   4.027

  No H/Q in entry =          11
  In of MODEL   37
    1    H    LEU 738           H        LEU 738  42.360 -22.941   5.344
    2    HA   LEU 738           HA       LEU 738  40.335 -21.551   6.852
    3    HB2  LEU 738           HB2      LEU 738  41.847 -19.724   7.502
    4    HB3  LEU 738           HB3      LEU 738  42.334 -21.238   8.229
    5    HG   LEU 738           HG       LEU 738  43.686 -20.026   5.811
    6   HD11  LEU 738          HD11      LEU 738  43.863 -18.539   7.771
    7   HD13  LEU 738          HD12      LEU 738  45.408 -19.285   7.376
    8   HD12  LEU 738          HD13      LEU 738  44.458 -19.893   8.733
    9   HD22  LEU 738          HD21      LEU 738  45.447 -21.604   6.373
   10   HD21  LEU 738          HD22      LEU 738  43.876 -22.407   6.167
   11   HD23  LEU 738          HD23      LEU 738  44.495 -22.113   7.788

  No H/Q in entry =          11
  In of MODEL   37
    1    HA   PRO 739           HA       PRO 739  39.691 -19.464   3.076
    2    HB2  PRO 739           HB2      PRO 739  38.393 -17.276   3.987
    3    HB3  PRO 739           HB3      PRO 739  37.658 -18.884   4.018
    4    HG2  PRO 739           HG2      PRO 739  38.989 -17.379   6.238
    5    HG3  PRO 739           HG3      PRO 739  37.483 -18.313   6.273
    6    HD2  PRO 739           HD2      PRO 739  39.914 -19.364   7.129
    7    HD3  PRO 739           HD3      PRO 739  38.589 -20.329   6.432

  No H/Q in entry =           7
  In of MODEL   37
    1    H    LEU 740           H        LEU 740  41.258 -18.512   2.003
    2    HA   LEU 740           HA       LEU 740  42.534 -16.119   3.120
    3    HB2  LEU 740           HB2      LEU 740  43.708 -18.258   1.350
    4    HB3  LEU 740           HB3      LEU 740  44.449 -16.694   1.570
    5    HG   LEU 740           HG       LEU 740  44.054 -18.796   3.695
    6   HD13  LEU 740          HD11      LEU 740  45.775 -19.320   2.072
    7   HD12  LEU 740          HD12      LEU 740  46.504 -18.896   3.622
    8   HD11  LEU 740          HD13      LEU 740  46.492 -17.730   2.284
    9   HD22  LEU 740          HD21      LEU 740  43.867 -16.558   4.668
   10   HD21  LEU 740          HD22      LEU 740  45.336 -16.063   3.831
   11   HD23  LEU 740          HD23      LEU 740  45.417 -17.284   5.098

  No H/Q in entry =          11
  In of MODEL   37
    1    H    THR 741           H        THR 741  43.650 -15.091   0.993
    2    HA   THR 741           HA       THR 741  41.644 -15.090  -1.117
    3    HB   THR 741           HB       THR 741  43.086 -12.549  -0.486
    4    HG1  THR 741           HG1      THR 741  41.018 -13.676   1.166
    5   HG23  THR 741          HG21      THR 741  40.908 -11.578  -1.015
    6   HG22  THR 741          HG22      THR 741  40.188 -13.183  -1.051
    7   HG21  THR 741          HG23      THR 741  41.385 -12.725  -2.263

  No H/Q in entry =           7
  In of MODEL   37
    1    H    VAL 742           H        VAL 742  42.644 -14.742  -3.196
    2    HA   VAL 742           HA       VAL 742  45.003 -16.071  -3.672
    3    HB   VAL 742           HB       VAL 742  43.840 -13.899  -5.433
    4   HG13  VAL 742          HG11      VAL 742  46.053 -14.349  -6.088
    5   HG12  VAL 742          HG12      VAL 742  44.901 -14.974  -7.262
    6   HG11  VAL 742          HG13      VAL 742  45.735 -16.091  -6.155
    7   HG22  VAL 742          HG21      VAL 742  42.232 -15.580  -4.957
    8   HG21  VAL 742          HG22      VAL 742  43.391 -16.850  -5.405
    9   HG23  VAL 742          HG23      VAL 742  42.796 -15.710  -6.627

  No H/Q in entry =           9
  In of MODEL   37
    1    H    CYS 743           H        CYS 743  44.651 -12.559  -3.300
    2    HA   CYS 743           HA       CYS 743  47.303 -11.961  -3.938
    3    HB2  CYS 743           HB2      CYS 743  45.471 -10.278  -3.862
    4    HB3  CYS 743           HB3      CYS 743  45.442 -10.413  -2.110

  No H/Q in entry =           4
  In of MODEL   37
    1    H    LYS 744           H        LYS 744  45.648 -12.391  -0.831
    2    HA   LYS 744           HA       LYS 744  47.736 -11.964   0.934
    3    HB2  LYS 744           HB2      LYS 744  45.095 -12.592   1.062
    4    HB3  LYS 744           HB3      LYS 744  45.807 -14.092   1.601
    5    HG2  LYS 744           HG2      LYS 744  46.387 -11.410   2.863
    6    HG3  LYS 744           HG3      LYS 744  45.193 -12.557   3.460
    7    HD2  LYS 744           HD2      LYS 744  46.950 -14.189   3.854
    8    HD3  LYS 744           HD3      LYS 744  48.157 -13.070   3.206
    9    HE2  LYS 744           HE2      LYS 744  47.670 -11.492   4.973
   10    HE3  LYS 744           HE3      LYS 744  46.412 -12.550   5.617
   11    HZ3  LYS 744           HZ1      LYS 744  48.137 -14.189   6.103
   12    HZ2  LYS 744           HZ2      LYS 744  48.464 -12.730   6.859
   13    HZ1  LYS 744           HZ3      LYS 744  49.321 -13.160   5.491

  No H/Q in entry =          13
  In of MODEL   37
    1    H    MET 745           H        MET 745  46.541 -14.999  -0.437
    2    HA   MET 745           HA       MET 745  48.382 -16.812   0.644
    3    HB2  MET 745           HB2      MET 745  46.654 -17.920  -0.324
    4    HB3  MET 745           HB3      MET 745  46.500 -16.799  -1.655
    5    HG2  MET 745           HG2      MET 745  47.182 -18.870  -2.617
    6    HG3  MET 745           HG3      MET 745  48.586 -17.839  -2.622
    7    HE1  MET 745           HE1      MET 745  46.893 -20.935  -1.192
    8    HE3  MET 745           HE2      MET 745  46.985 -19.998   0.301
    9    HE2  MET 745           HE3      MET 745  47.955 -21.468   0.109

  No H/Q in entry =           9
  In of MODEL   37
    1    H    HIS 746           H        HIS 746  48.558 -15.096  -2.489
    2    HA   HIS 746           HA       HIS 746  50.977 -16.391  -3.251
    3    HB2  HIS 746           HB2      HIS 746  49.465 -14.100  -4.276
    4    HB3  HIS 746           HB3      HIS 746  51.197 -14.118  -4.643
    5    HD1  HIS 746           HD1      HIS 746  51.973 -16.454  -5.898
    6    HD2  HIS 746           HD2      HIS 746  47.952 -15.431  -6.012
    7    HE1  HIS 746           HE1      HIS 746  51.030 -17.669  -7.868
    8    HE2  HIS 746           HE2      HIS 746  48.558 -17.148  -7.824

  No H/Q in entry =           8
  In of MODEL   37
    1    H    VAL 747           H        VAL 747  50.347 -13.329  -1.667
    2    HA   VAL 747           HA       VAL 747  53.038 -12.531  -1.661
    3    HB   VAL 747           HB       VAL 747  50.687 -11.593  -0.018
    4   HG11  VAL 747          HG11      VAL 747  52.812 -11.039   1.151
    5   HG13  VAL 747          HG12      VAL 747  52.046  -9.598   0.523
    6   HG12  VAL 747          HG13      VAL 747  53.428 -10.293  -0.320
    7   HG23  VAL 747          HG21      VAL 747  50.717  -9.732  -1.605
    8   HG22  VAL 747          HG22      VAL 747  50.464 -11.292  -2.394
    9   HG21  VAL 747          HG23      VAL 747  52.036 -10.519  -2.477

  No H/Q in entry =           9
  In of MODEL   37
    1    H    LEU 748           H        LEU 748  50.995 -14.057   0.833
    2    HA   LEU 748           HA       LEU 748  53.097 -14.109   2.688
    3    HB2  LEU 748           HB2      LEU 748  51.800 -15.821   3.951
    4    HB3  LEU 748           HB3      LEU 748  50.852 -14.427   3.500
    5    HG   LEU 748           HG       LEU 748  49.837 -15.823   1.680
    6   HD13  LEU 748          HD11      LEU 748  51.497 -17.576   1.499
    7   HD12  LEU 748          HD12      LEU 748  49.917 -18.248   1.911
    8   HD11  LEU 748          HD13      LEU 748  51.158 -18.076   3.155
    9   HD22  LEU 748          HD21      LEU 748  48.322 -16.977   3.197
   10   HD21  LEU 748          HD22      LEU 748  48.692 -15.343   3.753
   11   HD23  LEU 748          HD23      LEU 748  49.465 -16.733   4.514

  No H/Q in entry =          11
  In of MODEL   37
    1    H    HIS 749           H        HIS 749  52.339 -16.145   0.049
    2    HA   HIS 749           HA       HIS 749  53.937 -18.370   0.725
    3    HB2  HIS 749           HB2      HIS 749  52.089 -17.975  -1.142
    4    HB3  HIS 749           HB3      HIS 749  53.491 -17.568  -2.122
    5    HD1  HIS 749           HD1      HIS 749  54.812 -19.510  -3.059
    6    HD2  HIS 749           HD2      HIS 749  52.051 -20.647  -0.186
    7    HE1  HIS 749           HE1      HIS 749  54.724 -22.015  -3.173
    8    HE2  HIS 749           HE2      HIS 749  52.942 -22.673  -1.523

  No H/Q in entry =           8
  In of MODEL   37
    1    H    CYS 750           H        CYS 750  54.543 -15.488  -1.328
    2    HA   CYS 750           HA       CYS 750  57.234 -16.266  -1.854
    3    HB2  CYS 750           HB2      CYS 750  57.477 -14.044  -2.901
    4    HB3  CYS 750           HB3      CYS 750  56.046 -14.892  -3.474

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLN 751           H        GLN 751  55.705 -14.378   0.669
    2    HA   GLN 751           HA       GLN 751  58.145 -13.320   1.632
    3    HB2  GLN 751           HB2      GLN 751  55.380 -13.480   2.818
    4    HB3  GLN 751           HB3      GLN 751  56.722 -12.568   3.522
    5    HG2  GLN 751           HG2      GLN 751  55.847 -12.154   0.691
    6    HG3  GLN 751           HG3      GLN 751  55.102 -11.287   2.034
    7   HE21  GLN 751          HE21      GLN 751  56.011  -9.677   2.725
    8   HE22  GLN 751          HE22      GLN 751  57.579  -9.014   2.343

  No H/Q in entry =           8
  In of MODEL   37
    1    H    GLY 752           H        GLY 752  57.035 -16.419   1.671
    2    HA3  GLY 752           HA2      GLY 752  58.548 -18.057   2.509
    3    HA2  GLY 752           HA3      GLY 752  58.960 -16.960   3.809

  No H/Q in entry =           3
  In of MODEL   37
    1    H    ARG 753           H        ARG 753  55.588 -17.413   3.095
    2    HA   ARG 753           HA       ARG 753  55.374 -19.046   5.518
    3    HB2  ARG 753           HB2      ARG 753  53.192 -17.658   3.951
    4    HB3  ARG 753           HB3      ARG 753  52.986 -18.484   5.486
    5    HG2  ARG 753           HG2      ARG 753  54.575 -15.952   5.025
    6    HG3  ARG 753           HG3      ARG 753  52.962 -16.032   5.712
    7    HD2  ARG 753           HD2      ARG 753  54.451 -15.750   7.534
    8    HD3  ARG 753           HD3      ARG 753  53.948 -17.437   7.573
    9    HE   ARG 753           HE       ARG 753  56.209 -17.660   6.237
   10   HH11  ARG 753          HH11      ARG 753  55.555 -15.759   9.141
   11   HH12  ARG 753          HH12      ARG 753  57.152 -15.814   9.713
   12   HH21  ARG 753          HH21      ARG 753  58.409 -17.758   7.027
   13   HH22  ARG 753          HH22      ARG 753  58.795 -16.988   8.494

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ASN 754           H        ASN 754  53.924 -20.902   5.452
    2    HA   ASN 754           HA       ASN 754  54.111 -22.210   2.825
    3    HB2  ASN 754           HB2      ASN 754  54.336 -23.471   5.568
    4    HB3  ASN 754           HB3      ASN 754  54.409 -24.330   4.037
    5   HD21  ASN 754          HD21      ASN 754  56.054 -22.226   6.216
    6   HD22  ASN 754          HD22      ASN 754  57.629 -22.356   5.524

  No H/Q in entry =           6
  In of MODEL   37
    1    H    TYR 755           H        TYR 755  52.181 -22.519   1.949
    2    HA   TYR 755           HA       TYR 755  50.023 -23.554   3.578
    3    HB2  TYR 755           HB2      TYR 755  49.826 -21.108   1.824
    4    HB3  TYR 755           HB3      TYR 755  48.431 -22.102   2.215
    5    HD1  TYR 755           HD1      TYR 755  51.121 -20.065   3.751
    6    HD2  TYR 755           HD2      TYR 755  47.233 -21.681   4.194
    7    HE1  TYR 755           HE1      TYR 755  50.804 -18.703   5.748
    8    HE2  TYR 755           HE2      TYR 755  46.906 -20.323   6.225
    9    HH   TYR 755           HH       TYR 755  48.231 -19.252   7.913

  No H/Q in entry =           9
  In of MODEL   37
    1    H    THR 756           H        THR 756  48.548 -24.696   2.392
    2    HA   THR 756           HA       THR 756  49.383 -25.491  -0.315
    3    HB   THR 756           HB       THR 756  48.178 -27.105   1.959
    4    HG1  THR 756           HG1      THR 756  50.189 -27.401   2.475
    5   HG23  THR 756          HG21      THR 756  47.390 -27.892  -0.206
    6   HG22  THR 756          HG22      THR 756  48.491 -29.063   0.528
    7   HG21  THR 756          HG23      THR 756  49.057 -28.011  -0.785

  No H/Q in entry =           7
  In of MODEL   37
    1    H    LEU 757           H        LEU 757  47.446 -25.938  -1.760
    2    HA   LEU 757           HA       LEU 757  45.126 -24.608  -0.635
    3    HB2  LEU 757           HB2      LEU 757  45.858 -25.035  -3.501
    4    HB3  LEU 757           HB3      LEU 757  44.267 -24.494  -3.003
    5    HG   LEU 757           HG       LEU 757  45.740 -22.714  -1.708
    6   HD11  LEU 757          HD11      LEU 757  47.421 -23.376  -4.101
    7   HD13  LEU 757          HD12      LEU 757  47.874 -23.498  -2.401
    8   HD12  LEU 757          HD13      LEU 757  47.571 -21.918  -3.123
    9   HD23  LEU 757          HD21      LEU 757  44.926 -22.535  -4.592
   10   HD22  LEU 757          HD22      LEU 757  45.230 -21.172  -3.491
   11   HD21  LEU 757          HD23      LEU 757  43.909 -22.297  -3.169

  No H/Q in entry =          11
  In of MODEL   37
    1    H    THR 758           H        THR 758  43.048 -25.420  -0.934
    2    HA   THR 758           HA       THR 758  43.120 -28.333  -1.268
    3    HB   THR 758           HB       THR 758  41.423 -28.395   0.683
    4    HG1  THR 758           HG1      THR 758  42.432 -26.333   1.962
    5   HG21  THR 758          HG21      THR 758  43.758 -29.234   0.800
    6   HG23  THR 758          HG22      THR 758  43.269 -28.462   2.307
    7   HG22  THR 758          HG23      THR 758  44.313 -27.604   1.175

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLY 759           H        GLY 759  40.219 -26.861  -0.188
    2    HA3  GLY 759           HA2      GLY 759  38.925 -26.898  -2.788
    3    HA2  GLY 759           HA3      GLY 759  38.406 -28.147  -1.652

  No H/Q in entry =           3
  In of MODEL   37
    1    H    ARG 760           H        ARG 760  36.897 -25.828  -2.719
    2    HA   ARG 760           HA       ARG 760  36.968 -23.766  -0.750
    3    HB2  ARG 760           HB2      ARG 760  35.423 -22.554  -2.037
    4    HB3  ARG 760           HB3      ARG 760  36.298 -23.494  -3.228
    5    HG2  ARG 760           HG2      ARG 760  34.143 -23.721  -3.992
    6    HG3  ARG 760           HG3      ARG 760  34.247 -25.126  -2.921
    7    HD2  ARG 760           HD2      ARG 760  33.219 -23.788  -1.103
    8    HD3  ARG 760           HD3      ARG 760  33.052 -22.431  -2.207
    9    HE   ARG 760           HE       ARG 760  31.738 -24.371  -3.494
   10   HH11  ARG 760          HH11      ARG 760  31.485 -23.075  -0.201
   11   HH12  ARG 760          HH12      ARG 760  29.890 -23.566   0.052
   12   HH21  ARG 760          HH21      ARG 760  29.469 -25.038  -3.160
   13   HH22  ARG 760          HH22      ARG 760  28.713 -24.729  -1.670

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ASP 761           H        ASP 761  35.296 -26.694  -0.921
    2    HA   ASP 761           HA       ASP 761  33.097 -25.870   0.772
    3    HB2  ASP 761           HB2      ASP 761  32.717 -27.546  -0.955
    4    HB3  ASP 761           HB3      ASP 761  33.946 -28.581  -0.240

  No H/Q in entry =           4
  In of MODEL   37
    1    H    SER 762           H        SER 762  36.276 -26.955   1.193
    2    HA   SER 762           HA       SER 762  35.966 -28.446   3.584
    3    HB2  SER 762           HB2      SER 762  38.432 -27.129   2.471
    4    HB3  SER 762           HB3      SER 762  38.341 -28.536   3.544
    5    HG   SER 762           HG       SER 762  36.958 -29.395   1.728

  No H/Q in entry =           5
  In of MODEL   37
    1    H    CYS 763           H        CYS 763  35.687 -25.192   3.028
    2    HA   CYS 763           HA       CYS 763  35.768 -24.589   5.844
    3    HB2  CYS 763           HB2      CYS 763  37.127 -22.545   5.483
    4    HB3  CYS 763           HB3      CYS 763  38.052 -23.997   5.118

  No H/Q in entry =           4
  In of MODEL   37
    1    H    THR 764           H        THR 764  34.942 -22.150   5.953
    2    HA   THR 764           HA       THR 764  32.821 -21.929   3.982
    3    HB   THR 764           HB       THR 764  33.268 -20.344   6.535
    4    HG1  THR 764           HG1      THR 764  32.744 -22.838   6.354
    5   HG22  THR 764          HG21      THR 764  30.808 -20.745   4.808
    6   HG21  THR 764          HG22      THR 764  31.789 -19.278   4.862
    7   HG23  THR 764          HG23      THR 764  30.884 -19.789   6.288

  No H/Q in entry =           7
  In of MODEL   37
    1    H    LEU 765           H        LEU 765  33.315 -20.795   2.270
    2    HA   LEU 765           HA       LEU 765  35.575 -19.020   2.373
    3    HB2  LEU 765           HB2      LEU 765  35.016 -20.862   0.622
    4    HB3  LEU 765           HB3      LEU 765  33.919 -19.643  -0.005
    5    HG   LEU 765           HG       LEU 765  35.812 -18.113  -0.331
    6   HD13  LEU 765          HD11      LEU 765  37.262 -18.954   1.419
    7   HD12  LEU 765          HD12      LEU 765  38.094 -19.076  -0.135
    8   HD11  LEU 765          HD13      LEU 765  37.358 -20.504   0.607
    9   HD22  LEU 765          HD21      LEU 765  36.769 -19.263  -2.218
   10   HD21  LEU 765          HD22      LEU 765  35.043 -19.631  -2.135
   11   HD23  LEU 765          HD23      LEU 765  36.235 -20.816  -1.587

  No H/Q in entry =          11
  In of MODEL   37
    1    HA   PRO 766           HA       PRO 766  32.921 -15.462   2.733
    2    HB2  PRO 766           HB2      PRO 766  34.811 -13.750   1.451
    3    HB3  PRO 766           HB3      PRO 766  34.473 -13.893   3.171
    4    HG2  PRO 766           HG2      PRO 766  36.728 -14.860   1.679
    5    HG3  PRO 766           HG3      PRO 766  36.485 -14.889   3.432
    6    HD2  PRO 766           HD2      PRO 766  36.431 -17.052   1.607
    7    HD3  PRO 766           HD3      PRO 766  36.036 -17.117   3.326

  No H/Q in entry =           7
  In of MODEL   37
    1    H    ALA 767           H        ALA 767  34.533 -16.273  -0.229
    2    HA   ALA 767           HA       ALA 767  32.229 -15.166  -1.663
    3    HB3  ALA 767           HB1      ALA 767  33.591 -14.844  -3.594
    4    HB1  ALA 767           HB2      ALA 767  34.979 -15.592  -2.793
    5    HB2  ALA 767           HB3      ALA 767  34.372 -14.027  -2.229

  No H/Q in entry =           5
  In of MODEL   37
    1    H    SER 768           H        SER 768  31.055 -16.797  -1.401
    2    HA   SER 768           HA       SER 768  31.876 -19.272  -2.730
    3    HB2  SER 768           HB2      SER 768  29.619 -18.749  -0.785
    4    HB3  SER 768           HB3      SER 768  29.942 -20.284  -1.584
    5    HG   SER 768           HG       SER 768  31.716 -18.917   0.181

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA 769           H        ALA 769  29.643 -16.625  -2.717
    2    HA   ALA 769           HA       ALA 769  28.605 -17.296  -5.313
    3    HB2  ALA 769           HB1      ALA 769  27.091 -18.529  -3.806
    4    HB1  ALA 769           HB2      ALA 769  26.257 -17.168  -4.550
    5    HB3  ALA 769           HB3      ALA 769  26.807 -17.055  -2.879

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLU 770           H        GLU 770  26.499 -15.431  -5.145
    2    HA   GLU 770           HA       GLU 770  27.706 -12.965  -5.633
    3    HB2  GLU 770           HB2      GLU 770  25.414 -12.127  -5.666
    4    HB3  GLU 770           HB3      GLU 770  25.545 -13.660  -6.524
    5    HG2  GLU 770           HG2      GLU 770  24.696 -14.824  -4.519
    6    HG3  GLU 770           HG3      GLU 770  24.506 -13.266  -3.730

  No H/Q in entry =           6
  In of MODEL   37
    1    H    LYS 771           H        LYS 771  27.310 -10.967  -4.488
    2    HA   LYS 771           HA       LYS 771  27.215 -11.241  -1.566
    3    HB2  LYS 771           HB2      LYS 771  28.408  -9.023  -3.272
    4    HB3  LYS 771           HB3      LYS 771  28.282  -9.017  -1.537
    5    HG2  LYS 771           HG2      LYS 771  29.871 -11.071  -3.065
    6    HG3  LYS 771           HG3      LYS 771  30.543  -9.576  -2.424
    7    HD2  LYS 771           HD2      LYS 771  31.079 -11.066  -0.737
    8    HD3  LYS 771           HD3      LYS 771  29.549 -10.447  -0.151
    9    HE2  LYS 771           HE2      LYS 771  28.433 -12.504  -1.044
   10    HE3  LYS 771           HE3      LYS 771  29.998 -13.051  -1.613
   11    HZ2  LYS 771           HZ1      LYS 771  29.268 -14.001   0.498
   12    HZ1  LYS 771           HZ2      LYS 771  29.400 -12.485   1.230
   13    HZ3  LYS 771           HZ3      LYS 771  30.766 -13.250   0.618

  No H/Q in entry =          13
  In of MODEL   37
    1    H    ALA 772           H        ALA 772  26.367  -8.923  -0.687
    2    HA   ALA 772           HA       ALA 772  23.974  -8.272  -2.244
    3    HB2  ALA 772           HB1      ALA 772  24.208  -8.474   0.767
    4    HB3  ALA 772           HB2      ALA 772  23.365  -9.612  -0.284
    5    HB1  ALA 772           HB3      ALA 772  22.772  -7.960  -0.120

  No H/Q in entry =           5
  In of MODEL   37
    1    H    CYS 773           H        CYS 773  23.063  -6.130  -1.041
    2    HA   CYS 773           HA       CYS 773  24.479  -3.935  -1.792
    3    HB2  CYS 773           HB2      CYS 773  22.736  -4.093   0.658
    4    HB3  CYS 773           HB3      CYS 773  23.127  -2.638  -0.260

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLY 774           H        GLY 774  26.165  -2.759  -1.089
    2    HA3  GLY 774           HA2      GLY 774  27.559  -1.747   0.503
    3    HA2  GLY 774           HA3      GLY 774  26.989  -2.895   1.704

  No H/Q in entry =           3
  In of MODEL   37
    1    H    ALA 775           H        ALA 775  27.564  -5.112  -0.320
    2    HA   ALA 775           HA       ALA 775  30.456  -5.178   0.144
    3    HB2  ALA 775           HB1      ALA 775  28.493  -7.474   0.061
    4    HB3  ALA 775           HB2      ALA 775  29.258  -6.823   1.510
    5    HB1  ALA 775           HB3      ALA 775  30.235  -7.625   0.279

  No H/Q in entry =           5
  In of MODEL   37
    1    H    CYS 776           H        CYS 776  31.309  -4.633  -1.747
    2    HA   CYS 776           HA       CYS 776  30.232  -5.996  -4.099
    3    HB2  CYS 776           HB2      CYS 776  29.606  -3.683  -4.124
    4    HB3  CYS 776           HB3      CYS 776  31.289  -3.178  -3.942

  No H/Q in entry =           4
  In of MODEL   37
    1    HA   PRO 777           HA       PRO 777  34.529  -7.264  -4.268
    2    HB2  PRO 777           HB2      PRO 777  34.167  -9.310  -5.985
    3    HB3  PRO 777           HB3      PRO 777  33.711  -9.442  -4.283
    4    HG2  PRO 777           HG2      PRO 777  31.992  -8.951  -6.672
    5    HG3  PRO 777           HG3      PRO 777  31.668  -9.950  -5.247
    6    HD2  PRO 777           HD2      PRO 777  30.684  -7.406  -5.626
    7    HD3  PRO 777           HD3      PRO 777  30.885  -8.175  -4.040

  No H/Q in entry =           7
  In of MODEL   37
    1    H    LEU 778           H        LEU 778  36.047  -7.509  -6.123
    2    HA   LEU 778           HA       LEU 778  35.687  -5.386  -7.921
    3    HB2  LEU 778           HB2      LEU 778  37.895  -5.934  -8.896
    4    HB3  LEU 778           HB3      LEU 778  37.902  -5.690  -7.172
    5    HG   LEU 778           HG       LEU 778  39.497  -7.377  -7.798
    6   HD11  LEU 778          HD11      LEU 778  38.480  -7.722  -5.662
    7   HD13  LEU 778          HD12      LEU 778  38.918  -9.244  -6.427
    8   HD12  LEU 778          HD13      LEU 778  37.231  -8.738  -6.395
    9   HD22  LEU 778          HD21      LEU 778  38.652  -8.193  -9.865
   10   HD21  LEU 778          HD22      LEU 778  37.202  -8.784  -9.065
   11   HD23  LEU 778          HD23      LEU 778  38.752  -9.567  -8.745

  No H/Q in entry =          11
  In of MODEL   37
    1    H    TRP 779           H        TRP 779  34.478  -8.380  -8.247
    2    HA   TRP 779           HA       TRP 779  34.290  -8.112 -11.167
    3    HB2  TRP 779           HB2      TRP 779  33.525 -10.531 -11.115
    4    HB3  TRP 779           HB3      TRP 779  35.200 -10.276 -10.658
    5    HD1  TRP 779           HD1      TRP 779  31.779 -11.180  -9.068
    6    HE1  TRP 779           HE1      TRP 779  32.250 -12.388  -6.814
    7    HE3  TRP 779           HE3      TRP 779  36.835 -10.662  -8.877
    8    HZ2  TRP 779           HZ2      TRP 779  34.477 -12.987  -5.197
    9    HZ3  TRP 779           HZ3      TRP 779  38.055 -11.566  -6.944
   10    HH2  TRP 779           HH2      TRP 779  36.873 -12.709  -5.145

  No H/Q in entry =          10
  In of MODEL   37
    1    H    GLY 780           H        GLY 780  32.765  -6.921  -8.743
    2    HA3  GLY 780           HA2      GLY 780  30.115  -7.735  -9.669
    3    HA2  GLY 780           HA3      GLY 780  30.474  -7.478  -7.968

  No H/Q in entry =           3
  In of MODEL   37
    1    H    LYS 781           H        LYS 781  28.454  -6.213  -8.807
    2    HA   LYS 781           HA       LYS 781  29.211  -3.405  -8.761
    3    HB2  LYS 781           HB2      LYS 781  28.784  -4.081 -11.145
    4    HB3  LYS 781           HB3      LYS 781  27.174  -4.586 -10.647
    5    HG2  LYS 781           HG2      LYS 781  27.001  -2.444 -11.667
    6    HG3  LYS 781           HG3      LYS 781  26.733  -2.249  -9.936
    7    HD2  LYS 781           HD2      LYS 781  29.067  -1.511  -9.669
    8    HD3  LYS 781           HD3      LYS 781  29.309  -1.690 -11.409
    9    HE2  LYS 781           HE2      LYS 781  27.476  -0.048 -11.765
   10    HE3  LYS 781           HE3      LYS 781  27.406   0.139 -10.013
   11    HZ3  LYS 781           HZ1      LYS 781  28.695   1.888 -11.051
   12    HZ2  LYS 781           HZ2      LYS 781  29.736   0.768 -11.721
   13    HZ1  LYS 781           HZ3      LYS 781  29.693   0.967 -10.051

  No H/Q in entry =          13
  In of MODEL   37
    1    H    CYS 782           H        CYS 782  28.128  -2.664  -7.097
    2    HA   CYS 782           HA       CYS 782  25.799  -4.112  -6.111
    3    HB2  CYS 782           HB2      CYS 782  27.620  -3.625  -4.522
    4    HB3  CYS 782           HB3      CYS 782  27.427  -1.900  -4.822

  No H/Q in entry =           4
  In of MODEL   37
    1    H    ASP 783           H        ASP 783  24.185  -3.456  -7.445
    2    HA   ASP 783           HA       ASP 783  23.947  -0.625  -8.055
    3    HB2  ASP 783           HB2      ASP 783  23.658  -2.501  -9.796
    4    HB3  ASP 783           HB3      ASP 783  22.093  -2.787  -9.033

  No H/Q in entry =           4
  In of MODEL   37
    1    H    ALA 784           H        ALA 784  22.193   0.605  -7.488
    2    HA   ALA 784           HA       ALA 784  21.052  -0.115  -4.961
    3    HB1  ALA 784           HB1      ALA 784  21.926   2.137  -5.363
    4    HB2  ALA 784           HB2      ALA 784  20.230   2.156  -4.884
    5    HB3  ALA 784           HB3      ALA 784  20.671   2.396  -6.575

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLU 785           H        GLU 785  20.005  -0.494  -8.200
    2    HA   GLU 785           HA       GLU 785  17.230  -0.095  -7.652
    3    HB2  GLU 785           HB2      GLU 785  16.756  -1.070  -9.820
    4    HB3  GLU 785           HB3      GLU 785  18.098   0.053  -9.955
    5    HG2  GLU 785           HG2      GLU 785  19.666  -1.737 -10.126
    6    HG3  GLU 785           HG3      GLU 785  18.424  -2.926  -9.738

  No H/Q in entry =           6
  In of MODEL   37
    1    H    SER 786           H        SER 786  19.336  -2.525  -6.771
    2    HA   SER 786           HA       SER 786  17.102  -4.234  -6.082
    3    HB2  SER 786           HB2      SER 786  19.642  -5.186  -7.434
    4    HB3  SER 786           HB3      SER 786  18.383  -6.239  -6.784
    5    HG   SER 786           HG       SER 786  18.285  -5.742  -9.106

  No H/Q in entry =           5
  In of MODEL   37
    1    H    SER 787           H        SER 787  17.671  -5.757  -4.379
    2    HA   SER 787           HA       SER 787  19.522  -4.581  -2.458
    3    HB2  SER 787           HB2      SER 787  17.417  -6.752  -2.166
    4    HB3  SER 787           HB3      SER 787  18.331  -6.017  -0.842
    5    HG   SER 787           HG       SER 787  16.300  -4.920  -2.448

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LYS 788           H        LYS 788  20.804  -5.723  -4.539
    2    HA   LYS 788           HA       LYS 788  21.970  -8.232  -3.558
    3    HB2  LYS 788           HB2      LYS 788  20.138  -8.730  -5.025
    4    HB3  LYS 788           HB3      LYS 788  20.791  -7.663  -6.256
    5    HG2  LYS 788           HG2      LYS 788  22.847  -9.292  -6.145
    6    HG3  LYS 788           HG3      LYS 788  21.671 -10.405  -5.435
    7    HD2  LYS 788           HD2      LYS 788  20.169  -9.955  -7.386
    8    HD3  LYS 788           HD3      LYS 788  21.470  -9.017  -8.103
    9    HE2  LYS 788           HE2      LYS 788  21.544 -11.164  -9.096
   10    HE3  LYS 788           HE3      LYS 788  22.891 -11.085  -7.962
   11    HZ3  LYS 788           HZ1      LYS 788  21.644 -12.382  -6.382
   12    HZ2  LYS 788           HZ2      LYS 788  21.645 -13.182  -7.855
   13    HZ1  LYS 788           HZ3      LYS 788  20.269 -12.352  -7.370

  No H/Q in entry =          13
  In of MODEL   37
    1    H    CYS 789           H        CYS 789  24.174  -8.408  -4.340
    2    HA   CYS 789           HA       CYS 789  25.091  -6.169  -5.958
    3    HB2  CYS 789           HB2      CYS 789  26.402  -6.641  -3.874
    4    HB3  CYS 789           HB3      CYS 789  26.672  -8.283  -4.445

  No H/Q in entry =           4
  In of MODEL   37
    1    H    VAL 790           H        VAL 790  25.464  -6.589  -8.048
    2    HA   VAL 790           HA       VAL 790  25.013  -9.363  -8.859
    3    HB   VAL 790           HB       VAL 790  23.392  -7.580  -9.595
    4   HG13  VAL 790          HG11      VAL 790  23.981  -6.077 -11.424
    5   HG12  VAL 790          HG12      VAL 790  25.669  -6.564 -11.258
    6   HG11  VAL 790          HG13      VAL 790  24.861  -5.729  -9.933
    7   HG23  VAL 790          HG21      VAL 790  24.815  -9.007 -11.840
    8   HG22  VAL 790          HG22      VAL 790  23.172  -8.357 -11.904
    9   HG21  VAL 790          HG23      VAL 790  23.554  -9.682 -10.812

  No H/Q in entry =           9
  In of MODEL   37
    1    H    CYS 791           H        CYS 791  26.242  -9.900 -10.960
    2    HA   CYS 791           HA       CYS 791  28.994  -9.027 -10.556
    3    HB2  CYS 791           HB2      CYS 791  29.533 -11.014 -11.934
    4    HB3  CYS 791           HB3      CYS 791  28.663 -11.389 -10.449

  No H/Q in entry =           4
  In of MODEL   37
    1    H    ARG 792           H        ARG 792  30.283  -8.593 -12.368
    2    HA   ARG 792           HA       ARG 792  28.807  -7.577 -14.693
    3    HB2  ARG 792           HB2      ARG 792  31.619  -6.964 -13.716
    4    HB3  ARG 792           HB3      ARG 792  30.870  -6.304 -15.156
    5    HG2  ARG 792           HG2      ARG 792  29.891  -5.804 -12.351
    6    HG3  ARG 792           HG3      ARG 792  30.955  -4.726 -13.246
    7    HD2  ARG 792           HD2      ARG 792  28.731  -3.866 -13.445
    8    HD3  ARG 792           HD3      ARG 792  29.169  -4.560 -15.001
    9    HE   ARG 792           HE       ARG 792  27.856  -6.561 -13.643
   10   HH11  ARG 792          HH11      ARG 792  27.028  -3.332 -14.819
   11   HH12  ARG 792          HH12      ARG 792  25.368  -3.671 -14.961
   12   HH21  ARG 792          HH21      ARG 792  25.646  -7.040 -13.896
   13   HH22  ARG 792          HH22      ARG 792  24.553  -5.854 -14.444

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLU 793           H        GLU 793  30.299  -7.902 -16.735
    2    HA   GLU 793           HA       GLU 793  31.268 -10.629 -16.499
    3    HB2  GLU 793           HB2      GLU 793  30.692  -9.014 -18.969
    4    HB3  GLU 793           HB3      GLU 793  31.218 -10.698 -18.950
    5    HG2  GLU 793           HG2      GLU 793  29.173 -11.231 -17.628
    6    HG3  GLU 793           HG3      GLU 793  28.637  -9.577 -17.914

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ALA 794           H        ALA 794  33.131 -10.916 -18.388
    2    HA   ALA 794           HA       ALA 794  35.373 -10.115 -16.895
    3    HB1  ALA 794           HB1      ALA 794  35.304 -11.294 -19.661
    4    HB2  ALA 794           HB2      ALA 794  35.186 -12.212 -18.168
    5    HB3  ALA 794           HB3      ALA 794  36.661 -11.306 -18.529

  No H/Q in entry =           5
  In of MODEL   37
    1    H    SER 795           H        SER 795  33.937  -8.950 -19.835
    2    HA   SER 795           HA       SER 795  36.137  -7.271 -20.410
    3    HB2  SER 795           HB2      SER 795  33.370  -7.316 -21.623
    4    HB3  SER 795           HB3      SER 795  34.738  -6.394 -22.257
    5    HG   SER 795           HG       SER 795  35.838  -8.502 -22.205

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLU 796           H        GLU 796  33.601  -6.997 -18.239
    2    HA   GLU 796           HA       GLU 796  33.417  -4.090 -18.409
    3    HB2  GLU 796           HB2      GLU 796  31.979  -6.100 -16.734
    4    HB3  GLU 796           HB3      GLU 796  31.684  -4.367 -16.655
    5    HG2  GLU 796           HG2      GLU 796  30.947  -4.415 -18.982
    6    HG3  GLU 796           HG3      GLU 796  31.244  -6.156 -19.035

  No H/Q in entry =           6
  In of MODEL   37
    1    H    CYS 797           H        CYS 797  34.739  -6.629 -16.428
    2    HA   CYS 797           HA       CYS 797  35.167  -4.881 -14.203
    3    HB2  CYS 797           HB2      CYS 797  36.223  -7.667 -14.681
    4    HB3  CYS 797           HB3      CYS 797  36.275  -6.769 -13.161

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLU 798           H        GLU 798  36.565  -3.341 -14.428
    2    HA   GLU 798           HA       GLU 798  38.879  -3.647 -16.184
    3    HB2  GLU 798           HB2      GLU 798  37.181  -1.857 -16.504
    4    HB3  GLU 798           HB3      GLU 798  37.641  -1.191 -14.954
    5    HG2  GLU 798           HG2      GLU 798  39.880  -0.743 -15.829
    6    HG3  GLU 798           HG3      GLU 798  39.385  -1.395 -17.394

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU 799           H        GLU 799  38.281  -4.025 -12.977
    2    HA   GLU 799           HA       GLU 799  40.200  -2.571 -11.560
    3    HB2  GLU 799           HB2      GLU 799  38.462  -3.867 -10.451
    4    HB3  GLU 799           HB3      GLU 799  39.174  -5.365 -11.034
    5    HG2  GLU 799           HG2      GLU 799  39.701  -5.031  -8.685
    6    HG3  GLU 799           HG3      GLU 799  41.160  -4.939  -9.664

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLU 800           H        GLU 800  40.496  -5.829 -12.844
    2    HA   GLU 800           HA       GLU 800  42.173  -7.169 -13.423
    3    HB2  GLU 800           HB2      GLU 800  43.895  -4.699 -13.411
    4    HB3  GLU 800           HB3      GLU 800  44.431  -6.275 -13.974
    5    HG2  GLU 800           HG2      GLU 800  42.758  -6.210 -15.745
    6    HG3  GLU 800           HG3      GLU 800  42.202  -4.640 -15.158

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLY 801           H        GLY 801  42.032  -8.322 -11.645
    2    HA3  GLY 801           HA2      GLY 801  43.707  -7.769  -9.333
    3    HA2  GLY 801           HA3      GLY 801  42.586  -9.105  -9.552

  No H/Q in entry =           3
  In of MODEL   37
    1    H    PHE 802           H        PHE 802  43.777 -10.757  -9.156
    2    HA   PHE 802           HA       PHE 802  46.381 -11.127 -10.310
    3    HB2  PHE 802           HB2      PHE 802  44.636 -12.774  -8.499
    4    HB3  PHE 802           HB3      PHE 802  46.076 -13.476  -9.233
    5    HD1  PHE 802           HD1      PHE 802  45.358 -10.136  -7.705
    6    HD2  PHE 802           HD2      PHE 802  47.749 -13.657  -7.645
    7    HE1  PHE 802           HE1      PHE 802  46.761  -9.155  -5.990
    8    HE2  PHE 802           HE2      PHE 802  49.143 -12.697  -5.932
    9    HZ   PHE 802           HZ       PHE 802  48.681 -10.423  -5.081

  No H/Q in entry =           9
  In of MODEL   37
    1    H    SER 803           H        SER 803  46.685 -13.558 -11.154
    2    HA   SER 803           HA       SER 803  44.692 -14.045 -13.183
    3    HB2  SER 803           HB2      SER 803  46.754 -14.801 -14.556
    4    HB3  SER 803           HB3      SER 803  46.480 -13.069 -14.364
    5    HG   SER 803           HG       SER 803  48.603 -13.465 -13.946

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ILE 804           H        ILE 804  43.989 -16.093 -13.202
    2    HA   ILE 804           HA       ILE 804  45.479 -18.062 -11.656
    3    HB   ILE 804           HB       ILE 804  43.533 -18.883 -10.487
    4   HG12  ILE 804          HG12      ILE 804  41.786 -18.336 -12.213
    5   HG13  ILE 804          HG13      ILE 804  41.304 -17.917 -10.580
    6   HG23  ILE 804          HG21      ILE 804  43.024 -17.017  -8.973
    7   HG22  ILE 804          HG22      ILE 804  43.731 -15.909 -10.148
    8   HG21  ILE 804          HG23      ILE 804  44.747 -17.121  -9.365
    9   HD13  ILE 804          HD11      ILE 804  40.607 -16.216 -12.142
   10   HD12  ILE 804          HD12      ILE 804  42.248 -16.021 -12.723
   11   HD11  ILE 804          HD13      ILE 804  41.844 -15.559 -11.070

  No H/Q in entry =          11
  In of MODEL   37
    1    H    CYS 805           H        CYS 805  44.551 -20.264 -11.978
    2    HA   CYS 805           HA       CYS 805  43.831 -20.625 -14.808
    3    HB2  CYS 805           HB2      CYS 805  46.035 -21.528 -14.215
    4    HB3  CYS 805           HB3      CYS 805  45.319 -22.413 -12.877

  No H/Q in entry =           4
  In of MODEL   37
    1    H    VAL 806           H        VAL 806  42.030 -21.412 -15.252
    2    HA   VAL 806           HA       VAL 806  40.635 -22.931 -13.210
    3    HB   VAL 806           HB       VAL 806  39.908 -20.639 -13.001
    4   HG11  VAL 806          HG11      VAL 806  39.327 -20.755 -15.896
    5   HG13  VAL 806          HG12      VAL 806  40.539 -19.776 -15.064
    6   HG12  VAL 806          HG13      VAL 806  38.819 -19.452 -14.822
    7   HG23  VAL 806          HG21      VAL 806  37.801 -22.239 -14.430
    8   HG22  VAL 806          HG22      VAL 806  37.512 -20.825 -13.411
    9   HG21  VAL 806          HG23      VAL 806  38.160 -22.305 -12.708

  No H/Q in entry =           9
  In of MODEL   37
    1    H    GLU 807           H        GLU 807  39.636 -24.669 -13.960
    2    HA   GLU 807           HA       GLU 807  40.011 -25.421 -16.720
    3    HB2  GLU 807           HB2      GLU 807  40.475 -26.960 -14.862
    4    HB3  GLU 807           HB3      GLU 807  38.787 -26.884 -14.388
    5    HG2  GLU 807           HG2      GLU 807  38.196 -27.802 -16.607
    6    HG3  GLU 807           HG3      GLU 807  39.916 -28.036 -16.919

  No H/Q in entry =           6
  In of MODEL   37
    1    H    VAL 808           H        VAL 808  38.609 -24.745 -18.098
    2    HA   VAL 808           HA       VAL 808  35.738 -24.841 -17.543
    3    HB   VAL 808           HB       VAL 808  37.175 -22.569 -18.860
    4   HG12  VAL 808          HG11      VAL 808  34.297 -22.781 -18.091
    5   HG11  VAL 808          HG12      VAL 808  34.999 -22.847 -19.718
    6   HG13  VAL 808          HG13      VAL 808  35.103 -21.356 -18.774
    7   HG23  VAL 808          HG21      VAL 808  36.515 -21.216 -16.870
    8   HG22  VAL 808          HG22      VAL 808  37.792 -22.403 -16.651
    9   HG21  VAL 808          HG23      VAL 808  36.171 -22.754 -16.073

  No H/Q in entry =           9
  In of MODEL   37
    1    H    ASN 809           H        ASN 809  34.639 -25.497 -19.370
    2    HA   ASN 809           HA       ASN 809  34.221 -26.245 -21.472
    3    HB2  ASN 809           HB2      ASN 809  36.631 -24.549 -22.067
    4    HB3  ASN 809           HB3      ASN 809  35.959 -25.571 -23.311
    5   HD21  ASN 809          HD21      ASN 809  33.873 -23.978 -20.968
    6   HD22  ASN 809          HD22      ASN 809  33.255 -22.811 -22.067

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLY 810           H        GLY 810  36.416 -27.342 -19.524
    2    HA3  GLY 810           HA2      GLY 810  37.041 -29.665 -19.597
    3    HA2  GLY 810           HA3      GLY 810  37.216 -29.478 -21.346

  No H/Q in entry =           3
  In of MODEL   37
    1    H    LYS 811           H        LYS 811  38.515 -26.763 -20.614
    2    HA   LYS 811           HA       LYS 811  41.127 -27.983 -20.171
    3    HB2  LYS 811           HB2      LYS 811  42.060 -26.354 -21.777
    4    HB3  LYS 811           HB3      LYS 811  40.982 -27.539 -22.499
    5    HG2  LYS 811           HG2      LYS 811  39.190 -25.837 -22.539
    6    HG3  LYS 811           HG3      LYS 811  40.321 -24.661 -21.867
    7    HD2  LYS 811           HD2      LYS 811  40.700 -26.141 -24.462
    8    HD3  LYS 811           HD3      LYS 811  40.081 -24.493 -24.332
    9    HE2  LYS 811           HE2      LYS 811  42.183 -23.758 -23.329
   10    HE3  LYS 811           HE3      LYS 811  42.799 -25.404 -23.354
   11    HZ3  LYS 811           HZ1      LYS 811  42.730 -25.361 -25.764
   12    HZ2  LYS 811           HZ2      LYS 811  43.683 -24.128 -25.168
   13    HZ1  LYS 811           HZ3      LYS 811  42.141 -23.778 -25.751

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLU 812           H        GLU 812  42.726 -26.691 -19.314
    2    HA   GLU 812           HA       GLU 812  41.884 -24.829 -17.245
    3    HB2  GLU 812           HB2      GLU 812  44.631 -25.580 -18.249
    4    HB3  GLU 812           HB3      GLU 812  44.253 -24.776 -16.739
    5    HG2  GLU 812           HG2      GLU 812  43.381 -26.733 -15.798
    6    HG3  GLU 812           HG3      GLU 812  43.309 -27.566 -17.348

  No H/Q in entry =           6
  In of MODEL   37
    1    H    GLN 813           H        GLN 813  41.335 -22.872 -17.853
    2    HA   GLN 813           HA       GLN 813  43.054 -21.572 -19.826
    3    HB2  GLN 813           HB2      GLN 813  40.738 -21.787 -20.520
    4    HB3  GLN 813           HB3      GLN 813  40.190 -20.974 -19.057
    5    HG2  GLN 813           HG2      GLN 813  41.299 -19.001 -19.717
    6    HG3  GLN 813           HG3      GLN 813  41.940 -19.727 -21.192
    7   HE21  GLN 813          HE21      GLN 813  39.347 -18.197 -19.687
    8   HE22  GLN 813          HE22      GLN 813  38.194 -18.232 -20.964

  No H/Q in entry =           8
  In of MODEL   37
    1    H    THR 814           H        THR 814  43.847 -19.549 -19.296
    2    HA   THR 814           HA       THR 814  43.937 -18.968 -16.456
    3    HB   THR 814           HB       THR 814  45.143 -17.456 -18.755
    4    HG1  THR 814           HG1      THR 814  46.714 -18.736 -18.793
    5   HG23  THR 814          HG21      THR 814  45.118 -16.213 -16.669
    6   HG22  THR 814          HG22      THR 814  46.772 -16.698 -17.054
    7   HG21  THR 814          HG23      THR 814  45.853 -17.573 -15.827

  No H/Q in entry =           7
  In of MODEL   37
    1    H    MET 815           H        MET 815  42.768 -17.408 -15.591
    2    HA   MET 815           HA       MET 815  41.522 -15.488 -17.396
    3    HB2  MET 815           HB2      MET 815  40.216 -16.675 -14.956
    4    HB3  MET 815           HB3      MET 815  39.523 -15.457 -16.019
    5    HG2  MET 815           HG2      MET 815  39.790 -17.219 -17.867
    6    HG3  MET 815           HG3      MET 815  40.095 -18.296 -16.523
    7    HE2  MET 815           HE1      MET 815  36.657 -19.430 -17.629
    8    HE1  MET 815           HE2      MET 815  38.373 -19.838 -17.346
    9    HE3  MET 815           HE3      MET 815  37.933 -18.778 -18.661

  No H/Q in entry =           9
  In of MODEL   37
    1    H    SER 816           H        SER 816  41.115 -13.526 -16.420
    2    HA   SER 816           HA       SER 816  43.012 -12.858 -14.368
    3    HB2  SER 816           HB2      SER 816  40.744 -11.203 -15.502
    4    HB3  SER 816           HB3      SER 816  42.195 -10.612 -14.687
    5    HG   SER 816           HG       SER 816  43.239 -11.912 -16.564

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLU 817           H        GLU 817  42.366 -12.173 -12.317
    2    HA   GLU 817           HA       GLU 817  40.657 -13.740 -10.904
    3    HB2  GLU 817           HB2      GLU 817  42.512 -12.079 -10.235
    4    HB3  GLU 817           HB3      GLU 817  41.215 -10.921 -10.259
    5    HG2  GLU 817           HG2      GLU 817  40.189 -11.748  -8.457
    6    HG3  GLU 817           HG3      GLU 817  40.876 -13.366  -8.679

  No H/Q in entry =           6
  In of MODEL   37
    1    H    CYS 818           H        CYS 818  40.039 -10.563 -12.238
    2    HA   CYS 818           HA       CYS 818  37.430 -10.124 -11.329
    3    HB2  CYS 818           HB2      CYS 818  38.543  -9.228 -13.978
    4    HB3  CYS 818           HB3      CYS 818  37.326  -8.439 -12.982

  No H/Q in entry =           4
  In of MODEL   37
    1    H    GLU 819           H        GLU 819  38.706 -11.869 -14.099
    2    HA   GLU 819           HA       GLU 819  36.265 -12.133 -15.538
    3    HB2  GLU 819           HB2      GLU 819  38.444 -12.095 -16.635
    4    HB3  GLU 819           HB3      GLU 819  38.932 -13.506 -15.723
    5    HG2  GLU 819           HG2      GLU 819  37.333 -14.871 -16.930
    6    HG3  GLU 819           HG3      GLU 819  36.772 -13.457 -17.822

  No H/Q in entry =           6
  In of MODEL   37
    1    H    ALA 820           H        ALA 820  38.360 -14.476 -13.828
    2    HA   ALA 820           HA       ALA 820  36.661 -16.638 -14.035
    3    HB2  ALA 820           HB1      ALA 820  37.905 -17.638 -12.188
    4    HB3  ALA 820           HB2      ALA 820  38.589 -16.064 -11.805
    5    HB1  ALA 820           HB3      ALA 820  38.980 -16.846 -13.342

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLY 821           H        GLY 821  36.921 -14.143 -11.524
    2    HA3  GLY 821           HA2      GLY 821  35.031 -15.187  -9.712
    3    HA2  GLY 821           HA3      GLY 821  35.548 -13.509  -9.812

  No H/Q in entry =           3
  In of MODEL   37
    1    H    ALA 822           H        ALA 822  34.739 -12.972 -12.449
    2    HA   ALA 822           HA       ALA 822  32.050 -12.310 -12.058
    3    HB2  ALA 822           HB1      ALA 822  33.551 -11.059 -13.540
    4    HB3  ALA 822           HB2      ALA 822  32.066 -11.547 -14.351
    5    HB1  ALA 822           HB3      ALA 822  33.573 -12.421 -14.665

  No H/Q in entry =           5
  In of MODEL   37
    1    H    LEU 823           H        LEU 823  33.567 -14.823 -14.063
    2    HA   LEU 823           HA       LEU 823  31.119 -15.905 -14.937
    3    HB2  LEU 823           HB2      LEU 823  33.879 -17.093 -14.817
    4    HB3  LEU 823           HB3      LEU 823  32.518 -18.082 -15.280
    5    HG   LEU 823           HG       LEU 823  33.589 -17.421 -17.276
    6   HD11  LEU 823          HD11      LEU 823  31.194 -17.357 -17.421
    7   HD13  LEU 823          HD12      LEU 823  31.938 -16.166 -18.486
    8   HD12  LEU 823          HD13      LEU 823  31.191 -15.647 -16.981
    9   HD21  LEU 823          HD21      LEU 823  33.462 -14.553 -16.353
   10   HD23  LEU 823          HD22      LEU 823  34.029 -15.098 -17.931
   11   HD22  LEU 823          HD23      LEU 823  34.917 -15.537 -16.475

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ARG 824           H        ARG 824  33.014 -16.608 -12.071
    2    HA   ARG 824           HA       ARG 824  31.527 -18.772 -11.004
    3    HB2  ARG 824           HB2      ARG 824  33.058 -16.533  -9.750
    4    HB3  ARG 824           HB3      ARG 824  32.126 -17.641  -8.758
    5    HG2  ARG 824           HG2      ARG 824  34.458 -18.357 -10.536
    6    HG3  ARG 824           HG3      ARG 824  34.534 -18.131  -8.791
    7    HD2  ARG 824           HD2      ARG 824  33.315 -20.408 -10.347
    8    HD3  ARG 824           HD3      ARG 824  34.402 -20.414  -8.978
    9    HE   ARG 824           HE       ARG 824  32.085 -19.320  -8.028
   10   HH11  ARG 824          HH11      ARG 824  33.157 -22.444  -9.305
   11   HH12  ARG 824          HH12      ARG 824  31.790 -23.298  -8.769
   12   HH21  ARG 824          HH21      ARG 824  30.197 -20.466  -7.322
   13   HH22  ARG 824          HH22      ARG 824  30.026 -22.134  -7.608

  No H/Q in entry =          13
  In of MODEL   37
    1    H    CYS 825           H        CYS 825  30.959 -15.287 -10.782
    2    HA   CYS 825           HA       CYS 825  28.747 -15.715  -8.975
    3    HB2  CYS 825           HB2      CYS 825  30.380 -13.815  -8.769
    4    HB3  CYS 825           HB3      CYS 825  29.748 -13.176 -10.267

  No H/Q in entry =           4
  In of MODEL   37
    1    H    ARG 826           H        ARG 826  29.323 -15.385 -12.307
    2    HA   ARG 826           HA       ARG 826  26.730 -14.472 -13.089
    3    HB2  ARG 826           HB2      ARG 826  29.159 -14.683 -14.331
    4    HB3  ARG 826           HB3      ARG 826  28.261 -16.011 -15.060
    5    HG2  ARG 826           HG2      ARG 826  26.429 -14.379 -15.494
    6    HG3  ARG 826           HG3      ARG 826  27.589 -13.137 -14.974
    7    HD2  ARG 826           HD2      ARG 826  27.589 -13.297 -17.430
    8    HD3  ARG 826           HD3      ARG 826  29.131 -13.850 -16.773
    9    HE   ARG 826           HE       ARG 826  27.515 -16.062 -16.955
   10   HH11  ARG 826          HH11      ARG 826  28.723 -13.720 -19.364
   11   HH12  ARG 826          HH12      ARG 826  28.914 -14.892 -20.571
   12   HH21  ARG 826          HH21      ARG 826  27.698 -17.603 -18.630
   13   HH22  ARG 826          HH22      ARG 826  28.300 -17.155 -20.170

  No H/Q in entry =          13
  In of MODEL   37
    1    H    GLY 827           H        GLY 827  28.217 -17.474 -12.438
    2    HA3  GLY 827           HA2      GLY 827  26.921 -19.401 -11.811
    3    HA2  GLY 827           HA3      GLY 827  25.633 -18.808 -12.855

  No H/Q in entry =           3
  In of MODEL   37
    1    H    GLN 828           H        GLN 828  28.891 -18.790 -14.005
    2    HA   GLN 828           HA       GLN 828  28.222 -20.693 -16.069
    3    HB2  GLN 828           HB2      GLN 828  29.465 -18.613 -16.579
    4    HB3  GLN 828           HB3      GLN 828  30.737 -19.116 -15.479
    5    HG2  GLN 828           HG2      GLN 828  31.379 -19.477 -17.808
    6    HG3  GLN 828           HG3      GLN 828  31.257 -21.006 -16.941
    7   HE21  GLN 828          HE21      GLN 828  29.847 -18.973 -19.332
    8   HE22  GLN 828          HE22      GLN 828  28.797 -20.172 -20.004

  No H/Q in entry =           8
  In of MODEL   37
    1    H    SER 829           H        SER 829  29.583 -22.593 -16.438
    2    HA   SER 829           HA       SER 829  30.491 -23.742 -13.947
    3    HB2  SER 829           HB2      SER 829  30.260 -24.913 -16.731
    4    HB3  SER 829           HB3      SER 829  30.648 -25.820 -15.270
    5    HG   SER 829           HG       SER 829  28.680 -25.274 -14.436

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ILE 830           H        ILE 830  32.424 -23.105 -13.382
    2    HA   ILE 830           HA       ILE 830  34.690 -23.479 -15.179
    3    HB   ILE 830           HB       ILE 830  35.758 -21.410 -14.520
    4   HG12  ILE 830          HG12      ILE 830  34.804 -21.216 -12.175
    5   HG13  ILE 830          HG13      ILE 830  34.913 -19.711 -13.058
    6   HG23  ILE 830          HG21      ILE 830  34.353 -21.157 -16.418
    7   HG22  ILE 830          HG22      ILE 830  34.325 -19.660 -15.478
    8   HG21  ILE 830          HG23      ILE 830  32.968 -20.791 -15.392
    9   HD11  ILE 830          HD11      ILE 830  32.476 -20.005 -13.633
   10   HD13  ILE 830          HD12      ILE 830  32.886 -19.617 -11.988
   11   HD12  ILE 830          HD13      ILE 830  32.443 -21.291 -12.408

  No H/Q in entry =          11
  In of MODEL   37
    1    H    SER 831           H        SER 831  36.403 -24.359 -14.013
    2    HA   SER 831           HA       SER 831  35.859 -24.800 -11.180
    3    HB2  SER 831           HB2      SER 831  37.127 -26.586 -13.230
    4    HB3  SER 831           HB3      SER 831  37.024 -26.947 -11.514
    5    HG   SER 831           HG       SER 831  34.869 -27.099 -11.658

  No H/Q in entry =           5
  In of MODEL   37
    1    H    VAL 832           H        VAL 832  37.237 -23.323 -10.218
    2    HA   VAL 832           HA       VAL 832  39.784 -22.652 -11.277
    3    HB   VAL 832           HB       VAL 832  38.757 -22.290  -8.445
    4   HG13  VAL 832          HG11      VAL 832  40.549 -20.594  -8.200
    5   HG12  VAL 832          HG12      VAL 832  41.114 -20.962  -9.826
    6   HG11  VAL 832          HG13      VAL 832  41.241 -22.178  -8.566
    7   HG21  VAL 832          HG21      VAL 832  37.393 -21.112 -10.087
    8   HG23  VAL 832          HG22      VAL 832  38.838 -20.356 -10.762
    9   HG22  VAL 832          HG23      VAL 832  38.324 -19.963  -9.124

  No H/Q in entry =           9
  In of MODEL   37
    1    H    THR 833           H        THR 833  41.531 -23.867 -11.336
    2    HA   THR 833           HA       THR 833  41.642 -26.191  -9.610
    3    HB   THR 833           HB       THR 833  43.461 -26.881 -11.142
    4    HG1  THR 833           HG1      THR 833  43.977 -25.649 -12.864
    5   HG21  THR 833          HG21      THR 833  40.885 -26.079 -12.507
    6   HG23  THR 833          HG22      THR 833  41.171 -27.585 -11.633
    7   HG22  THR 833          HG23      THR 833  42.038 -27.253 -13.135

  No H/Q in entry =           7
  In of MODEL   37
    1    H    SER 834           H        SER 834  43.367 -23.230 -10.441
    2    HA   SER 834           HA       SER 834  44.955 -23.520  -8.077
    3    HB2  SER 834           HB2      SER 834  47.033 -23.099  -9.486
    4    HB3  SER 834           HB3      SER 834  46.337 -24.731  -9.489
    5    HG   SER 834           HG       SER 834  45.236 -24.121 -11.409

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ILE 835           H        ILE 835  46.085 -21.619  -7.523
    2    HA   ILE 835           HA       ILE 835  44.763 -19.279  -8.547
    3    HB   ILE 835           HB       ILE 835  45.705 -18.105  -6.530
    4   HG12  ILE 835          HG12      ILE 835  46.243 -19.713  -4.582
    5   HG13  ILE 835          HG13      ILE 835  46.660 -20.886  -5.820
    6   HG22  ILE 835          HG21      ILE 835  44.169 -19.151  -4.958
    7   HG21  ILE 835          HG22      ILE 835  43.965 -20.493  -6.083
    8   HG23  ILE 835          HG23      ILE 835  43.449 -18.864  -6.550
    9   HD12  ILE 835          HD11      ILE 835  48.568 -19.765  -4.890
   10   HD11  ILE 835          HD12      ILE 835  47.877 -18.207  -5.378
   11   HD13  ILE 835          HD13      ILE 835  48.390 -19.368  -6.612

  No H/Q in entry =          11
  In of MODEL   37
    1    H    ARG 836           H        ARG 836  47.028 -20.710  -9.877
    2    HA   ARG 836           HA       ARG 836  48.804 -18.394 -10.222
    3    HB2  ARG 836           HB2      ARG 836  49.441 -21.256 -11.018
    4    HB3  ARG 836           HB3      ARG 836  50.513 -19.888 -11.140
    5    HG2  ARG 836           HG2      ARG 836  51.335 -21.002  -9.307
    6    HG3  ARG 836           HG3      ARG 836  50.270 -19.809  -8.554
    7    HD2  ARG 836           HD2      ARG 836  50.008 -22.001  -7.569
    8    HD3  ARG 836           HD3      ARG 836  48.531 -21.462  -8.353
    9    HE   ARG 836           HE       ARG 836  49.253 -22.864 -10.306
   10   HH11  ARG 836          HH11      ARG 836  50.456 -23.786  -7.088
   11   HH12  ARG 836          HH12      ARG 836  50.413 -25.453  -7.431
   12   HH21  ARG 836          HH21      ARG 836  49.211 -25.111 -10.740
   13   HH22  ARG 836          HH22      ARG 836  49.712 -26.231  -9.564

  No H/Q in entry =          13
  In of MODEL   37
    1    HA   PRO 837           HA       PRO 837  47.025 -18.417 -14.364
    2    HB2  PRO 837           HB2      PRO 837  49.113 -17.492 -15.875
    3    HB3  PRO 837           HB3      PRO 837  48.108 -16.445 -14.870
    4    HG2  PRO 837           HG2      PRO 837  50.804 -17.599 -14.298
    5    HG3  PRO 837           HG3      PRO 837  50.183 -15.971 -13.967
    6    HD2  PRO 837           HD2      PRO 837  50.356 -17.866 -12.050
    7    HD3  PRO 837           HD3      PRO 837  49.074 -16.638 -12.061

  No H/Q in entry =           7
  In of MODEL   37
    1    H    CYS 838           H        CYS 838  47.153 -19.593 -16.426
    2    HA   CYS 838           HA       CYS 838  48.958 -21.908 -16.313
    3    HB2  CYS 838           HB2      CYS 838  46.494 -22.338 -16.272
    4    HB3  CYS 838           HB3      CYS 838  46.342 -21.491 -17.797

  No H/Q in entry =           4
  In of MODEL   37
    1    H    ALA 839           H        ALA 839  49.555 -22.673 -18.611
    2    HA   ALA 839           HA       ALA 839  50.419 -20.398 -20.219
    3    HB3  ALA 839           HB1      ALA 839  51.727 -22.076 -21.461
    4    HB1  ALA 839           HB2      ALA 839  50.961 -23.364 -20.537
    5    HB2  ALA 839           HB3      ALA 839  52.032 -22.215 -19.727

  No H/Q in entry =           5
  In of MODEL   37
    1    H    ALA 840           H        ALA 840  47.746 -20.682 -20.115
    2    HA   ALA 840           HA       ALA 840  46.790 -22.162 -22.443
    3    HB1  ALA 840           HB1      ALA 840  45.303 -20.606 -20.342
    4    HB2  ALA 840           HB2      ALA 840  45.550 -22.352 -20.359
    5    HB3  ALA 840           HB3      ALA 840  44.569 -21.584 -21.610

  No H/Q in entry =           5
  In of MODEL   37
    1    H    GLU 841           H        GLU 841  48.363 -19.517 -22.295
    2    HA   GLU 841           HA       GLU 841  46.578 -17.575 -23.426
    3    HB2  GLU 841           HB2      GLU 841  49.599 -17.521 -23.519
    4    HB3  GLU 841           HB3      GLU 841  48.508 -16.160 -23.629
    5    HG2  GLU 841           HG2      GLU 841  49.113 -17.821 -21.198
    6    HG3  GLU 841           HG3      GLU 841  49.533 -16.135 -21.482

  No H/Q in entry =           6
  In of MODEL   37
    1    H    THR 842           H        THR 842  48.365 -20.181 -24.429
    2    HA   THR 842           HA       THR 842  49.117 -21.101 -26.259
    3    HB   THR 842           HB       THR 842  47.740 -20.916 -28.312
    4    HG1  THR 842           HG1      THR 842  46.643 -18.857 -26.936
    5   HG22  THR 842          HG21      THR 842  46.327 -21.636 -25.752
    6   HG21  THR 842          HG22      THR 842  47.375 -22.683 -26.708
    7   HG23  THR 842          HG23      THR 842  45.820 -22.159 -27.360

  No H/Q in entry =           7
  In of MODEL   37
    1    H    GLN 843           H        GLN 843  50.522 -19.189 -25.594
    2    HA   GLN 843           HA       GLN 843  51.499 -18.002 -28.072
    3    HB2  GLN 843           HB2      GLN 843  50.390 -16.275 -26.681
    4    HB3  GLN 843           HB3      GLN 843  51.418 -16.718 -25.329
    5    HG2  GLN 843           HG2      GLN 843  53.383 -16.007 -26.620
    6    HG3  GLN 843           HG3      GLN 843  52.319 -15.534 -27.942
    7   HE21  GLN 843          HE21      GLN 843  54.152 -13.974 -26.320
    8   HE22  GLN 843          HE22      GLN 843  53.244 -12.666 -25.669

  No H/Q in entry =           8
  In of MODEL   38
    1    H1   GLY 689           H2       GLY 689  50.740  -1.846 -32.099
    2    H2   GLY 689           H1       GLY 689  49.556  -2.924 -32.591
    3    H3   GLY 689           H3       GLY 689  49.605  -2.423 -30.969
    4    HA2  GLY 689           HA2      GLY 689  50.505  -4.643 -31.202
    5    HA3  GLY 689           HA3      GLY 689  51.734  -3.487 -30.692

  No H/Q in entry =           5
  In of MODEL   38
    1    H    SER 690           H        SER 690  53.010  -2.457 -32.504
    2    HA   SER 690           HA       SER 690  53.131  -3.972 -34.938
    3    HB2  SER 690           HB2      SER 690  54.883  -1.726 -33.905
    4    HB3  SER 690           HB3      SER 690  54.830  -2.338 -35.557
    5    HG   SER 690           HG       SER 690  53.435  -0.828 -35.788

  No H/Q in entry =           5
  In of MODEL   38
    1    H    HIS 691           H        HIS 691  54.218  -5.890 -34.953
    2    HA   HIS 691           HA       HIS 691  56.166  -6.401 -32.894
    3    HB2  HIS 691           HB2      HIS 691  55.035  -8.182 -35.046
    4    HB3  HIS 691           HB3      HIS 691  56.380  -8.673 -34.032
    5    HD1  HIS 691           HD1      HIS 691  52.688  -8.332 -34.004
    6    HD2  HIS 691           HD2      HIS 691  55.754  -8.981 -31.278
    7    HE1  HIS 691           HE1      HIS 691  51.571  -9.109 -31.905
    8    HE2  HIS 691           HE2      HIS 691  53.428  -9.122 -30.211

  No H/Q in entry =           8
  In of MODEL   38
    1    H    MET 692           H        MET 692  56.576  -4.601 -35.310
    2    HA   MET 692           HA       MET 692  58.875  -5.603 -36.662
    3    HB2  MET 692           HB2      MET 692  58.069  -2.725 -36.161
    4    HB3  MET 692           HB3      MET 692  59.318  -3.240 -37.280
    5    HG2  MET 692           HG2      MET 692  56.371  -3.788 -37.483
    6    HG3  MET 692           HG3      MET 692  57.319  -2.681 -38.471
    7    HE1  MET 692           HE1      MET 692  59.189  -3.466 -40.215
    8    HE3  MET 692           HE2      MET 692  59.608  -5.158 -40.500
    9    HE2  MET 692           HE3      MET 692  60.004  -4.403 -38.962

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ASN 693           H        ASN 693  58.410  -3.447 -33.907
    2    HA   ASN 693           HA       ASN 693  61.254  -3.587 -33.298
    3    HB2  ASN 693           HB2      ASN 693  59.054  -1.757 -32.287
    4    HB3  ASN 693           HB3      ASN 693  60.680  -1.764 -31.625
    5   HD21  ASN 693          HD21      ASN 693  59.220   0.340 -32.979
    6   HD22  ASN 693          HD22      ASN 693  60.185   0.832 -34.324

  No H/Q in entry =           6
  In of MODEL   38
    1    HA   PRO 694           HA       PRO 694  60.192  -6.162 -29.797
    2    HB2  PRO 694           HB2      PRO 694  62.475  -6.085 -28.431
    3    HB3  PRO 694           HB3      PRO 694  62.442  -6.799 -30.050
    4    HG2  PRO 694           HG2      PRO 694  63.403  -4.095 -29.197
    5    HG3  PRO 694           HG3      PRO 694  64.124  -5.220 -30.361
    6    HD2  PRO 694           HD2      PRO 694  62.519  -3.051 -31.017
    7    HD3  PRO 694           HD3      PRO 694  62.820  -4.446 -32.069

  No H/Q in entry =           7
  In of MODEL   38
    1    H    LEU 695           H        LEU 695  60.756  -5.903 -27.202
    2    HA   LEU 695           HA       LEU 695  59.439  -3.482 -26.388
    3    HB2  LEU 695           HB2      LEU 695  59.501  -5.940 -25.295
    4    HB3  LEU 695           HB3      LEU 695  60.872  -5.267 -24.447
    5    HG   LEU 695           HG       LEU 695  58.007  -4.332 -24.303
    6   HD11  LEU 695          HD11      LEU 695  58.430  -6.350 -23.072
    7   HD13  LEU 695          HD12      LEU 695  58.144  -5.002 -21.971
    8   HD12  LEU 695          HD13      LEU 695  59.787  -5.586 -22.240
    9   HD23  LEU 695          HD21      LEU 695  60.396  -3.188 -22.853
   10   HD22  LEU 695          HD22      LEU 695  58.709  -2.707 -22.634
   11   HD21  LEU 695          HD23      LEU 695  59.525  -2.398 -24.164

  No H/Q in entry =          11
  In of MODEL   38
    1    H    THR 696           H        THR 696  60.780  -1.872 -27.069
    2    HA   THR 696           HA       THR 696  63.545  -1.790 -26.977
    3    HB   THR 696           HB       THR 696  63.147   0.717 -27.278
    4    HG1  THR 696           HG1      THR 696  61.074   1.365 -27.444
    5   HG21  THR 696          HG21      THR 696  61.763  -1.244 -29.129
    6   HG23  THR 696          HG22      THR 696  63.480  -0.838 -29.164
    7   HG22  THR 696          HG23      THR 696  62.276   0.385 -29.564

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLN 697           H        GLN 697  61.209  -0.591 -24.666
    2    HA   GLN 697           HA       GLN 697  63.116   0.811 -23.075
    3    HB2  GLN 697           HB2      GLN 697  60.821   1.532 -23.075
    4    HB3  GLN 697           HB3      GLN 697  60.273  -0.043 -22.538
    5    HG2  GLN 697           HG2      GLN 697  60.170   1.608 -20.741
    6    HG3  GLN 697           HG3      GLN 697  61.300   0.315 -20.364
    7   HE21  GLN 697          HE21      GLN 697  62.348   1.571 -18.869
    8   HE22  GLN 697          HE22      GLN 697  63.412   2.843 -19.310

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ALA 698           H        ALA 698  62.065  -2.416 -23.197
    2    HA   ALA 698           HA       ALA 698  62.262  -4.274 -21.897
    3    HB2  ALA 698           HB1      ALA 698  64.414  -4.679 -20.812
    4    HB3  ALA 698           HB2      ALA 698  64.799  -2.962 -20.885
    5    HB1  ALA 698           HB3      ALA 698  64.681  -3.898 -22.373

  No H/Q in entry =           5
  In of MODEL   38
    1    H    VAL 699           H        VAL 699  60.402  -3.723 -20.742
    2    HA   VAL 699           HA       VAL 699  60.768  -2.302 -18.245
    3    HB   VAL 699           HB       VAL 699  58.230  -3.295 -19.541
    4   HG11  VAL 699          HG11      VAL 699  57.971  -3.064 -17.130
    5   HG13  VAL 699          HG12      VAL 699  57.067  -1.797 -17.958
    6   HG12  VAL 699          HG13      VAL 699  58.613  -1.423 -17.197
    7   HG21  VAL 699          HG21      VAL 699  59.299  -1.566 -20.881
    8   HG23  VAL 699          HG22      VAL 699  59.395  -0.515 -19.470
    9   HG22  VAL 699          HG23      VAL 699  57.823  -0.949 -20.139

  No H/Q in entry =           9
  In of MODEL   38
    1    HA   PRO 700           HA       PRO 700  60.691  -6.276 -16.230
    2    HB2  PRO 700           HB2      PRO 700  61.191  -5.308 -13.725
    3    HB3  PRO 700           HB3      PRO 700  62.452  -5.660 -14.909
    4    HG2  PRO 700           HG2      PRO 700  61.350  -3.053 -14.030
    5    HG3  PRO 700           HG3      PRO 700  62.958  -3.433 -14.659
    6    HD2  PRO 700           HD2      PRO 700  60.870  -2.232 -16.079
    7    HD3  PRO 700           HD3      PRO 700  62.333  -2.946 -16.780

  No H/Q in entry =           7
  In of MODEL   38
    1    H    LYS 701           H        LYS 701  59.028  -7.240 -15.309
    2    HA   LYS 701           HA       LYS 701  56.890  -5.546 -14.226
    3    HB2  LYS 701           HB2      LYS 701  56.609  -8.107 -15.821
    4    HB3  LYS 701           HB3      LYS 701  55.293  -7.324 -14.975
    5    HG2  LYS 701           HG2      LYS 701  56.859  -6.089 -17.238
    6    HG3  LYS 701           HG3      LYS 701  55.300  -6.893 -17.411
    7    HD2  LYS 701           HD2      LYS 701  54.346  -5.243 -15.813
    8    HD3  LYS 701           HD3      LYS 701  55.898  -4.403 -15.813
    9    HE2  LYS 701           HE2      LYS 701  54.404  -3.286 -17.341
   10    HE3  LYS 701           HE3      LYS 701  55.681  -4.090 -18.252
   11    HZ3  LYS 701           HZ1      LYS 701  53.540  -4.416 -19.300
   12    HZ2  LYS 701           HZ2      LYS 701  52.893  -5.074 -17.900
   13    HZ1  LYS 701           HZ3      LYS 701  54.100  -5.899 -18.736

  No H/Q in entry =          13
  In of MODEL   38
    1    H    CYS 702           H        CYS 702  55.761  -6.420 -12.494
    2    HA   CYS 702           HA       CYS 702  57.237  -8.489 -11.052
    3    HB2  CYS 702           HB2      CYS 702  55.662  -7.626  -9.184
    4    HB3  CYS 702           HB3      CYS 702  57.045  -6.637  -9.545

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLN 703           H        GLN 703  55.817 -10.011  -9.814
    2    HA   GLN 703           HA       GLN 703  53.624 -10.850 -11.478
    3    HB2  GLN 703           HB2      GLN 703  54.375 -11.833  -8.714
    4    HB3  GLN 703           HB3      GLN 703  53.385 -12.667  -9.892
    5    HG2  GLN 703           HG2      GLN 703  56.351 -12.169 -10.049
    6    HG3  GLN 703           HG3      GLN 703  55.549 -13.703  -9.744
    7   HE21  GLN 703          HE21      GLN 703  56.433 -11.362 -12.088
    8   HE22  GLN 703          HE22      GLN 703  56.047 -12.288 -13.488

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ARG 704           H        ARG 704  51.477 -11.218 -10.286
    2    HA   ARG 704           HA       ARG 704  50.365  -8.794  -9.499
    3    HB2  ARG 704           HB2      ARG 704  49.439 -11.599  -9.049
    4    HB3  ARG 704           HB3      ARG 704  48.502 -10.219  -8.525
    5    HG2  ARG 704           HG2      ARG 704  49.347 -10.816 -11.328
    6    HG3  ARG 704           HG3      ARG 704  47.754 -11.137 -10.674
    7    HD2  ARG 704           HD2      ARG 704  47.835  -8.560 -10.069
    8    HD3  ARG 704           HD3      ARG 704  49.070  -8.551 -11.333
    9    HE   ARG 704           HE       ARG 704  46.227  -9.107 -11.648
   10   HH11  ARG 704          HH11      ARG 704  49.385  -8.595 -13.183
   11   HH12  ARG 704          HH12      ARG 704  48.750  -8.304 -14.724
   12   HH21  ARG 704          HH21      ARG 704  45.349  -8.694 -13.852
   13   HH22  ARG 704          HH22      ARG 704  46.445  -8.394 -15.086

  No H/Q in entry =          13
  In of MODEL   38
    1    H    TRP 705           H        TRP 705  52.078 -11.025  -7.525
    2    HA   TRP 705           HA       TRP 705  51.133  -9.779  -5.052
    3    HB2  TRP 705           HB2      TRP 705  52.117 -11.816  -3.984
    4    HB3  TRP 705           HB3      TRP 705  50.771 -12.135  -5.073
    5    HD1  TRP 705           HD1      TRP 705  54.476 -12.806  -4.623
    6    HE1  TRP 705           HE1      TRP 705  55.268 -14.459  -6.384
    7    HE3  TRP 705           HE3      TRP 705  50.265 -12.966  -7.523
    8    HZ2  TRP 705           HZ2      TRP 705  54.234 -15.719  -8.722
    9    HZ3  TRP 705           HZ3      TRP 705  50.250 -14.425  -9.503
   10    HH2  TRP 705           HH2      TRP 705  52.193 -15.774 -10.088

  No H/Q in entry =          10
  In of MODEL   38
    1    H    GLU 706           H        GLU 706  53.391  -9.002  -7.162
    2    HA   GLU 706           HA       GLU 706  55.397  -8.591  -5.112
    3    HB2  GLU 706           HB2      GLU 706  55.754  -9.179  -8.051
    4    HB3  GLU 706           HB3      GLU 706  57.057  -8.640  -6.969
    5    HG2  GLU 706           HG2      GLU 706  56.805 -10.711  -5.748
    6    HG3  GLU 706           HG3      GLU 706  55.478 -11.187  -6.814

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LYS 707           H        LYS 707  56.714  -6.664  -5.733
    2    HA   LYS 707           HA       LYS 707  55.275  -4.729  -7.322
    3    HB2  LYS 707           HB2      LYS 707  55.419  -3.018  -5.503
    4    HB3  LYS 707           HB3      LYS 707  54.310  -4.329  -5.150
    5    HG2  LYS 707           HG2      LYS 707  56.192  -5.364  -3.784
    6    HG3  LYS 707           HG3      LYS 707  57.034  -3.825  -3.967
    7    HD2  LYS 707           HD2      LYS 707  54.311  -4.220  -2.698
    8    HD3  LYS 707           HD3      LYS 707  55.819  -3.922  -1.838
    9    HE2  LYS 707           HE2      LYS 707  55.983  -1.734  -2.886
   10    HE3  LYS 707           HE3      LYS 707  54.519  -2.059  -3.811
   11    HZ1  LYS 707           HZ1      LYS 707  54.646  -1.876  -0.845
   12    HZ3  LYS 707           HZ2      LYS 707  53.259  -2.150  -1.770
   13    HZ2  LYS 707           HZ3      LYS 707  54.086  -0.680  -1.889

  No H/Q in entry =          13
  In of MODEL   38
    1    H    LEU 708           H        LEU 708  56.555  -3.348  -8.348
    2    HA   LEU 708           HA       LEU 708  59.391  -3.931  -8.289
    3    HB2  LEU 708           HB2      LEU 708  58.189  -3.853 -10.425
    4    HB3  LEU 708           HB3      LEU 708  57.724  -2.195 -10.115
    5    HG   LEU 708           HG       LEU 708  60.168  -1.587 -10.189
    6   HD12  LEU 708          HD11      LEU 708  61.698  -3.131 -11.280
    7   HD11  LEU 708          HD12      LEU 708  60.460  -4.387 -11.240
    8   HD13  LEU 708          HD13      LEU 708  61.126  -3.754  -9.734
    9   HD22  LEU 708          HD21      LEU 708  60.298  -1.641 -12.620
   10   HD21  LEU 708          HD22      LEU 708  58.675  -1.205 -12.081
   11   HD23  LEU 708          HD23      LEU 708  59.006  -2.835 -12.670

  No H/Q in entry =          11
  In of MODEL   38
    1    H    GLN 709           H        GLN 709  60.631  -2.804  -6.907
    2    HA   GLN 709           HA       GLN 709  60.512   0.087  -6.960
    3    HB2  GLN 709           HB2      GLN 709  60.236   0.451  -4.637
    4    HB3  GLN 709           HB3      GLN 709  59.046  -0.792  -4.993
    5    HG2  GLN 709           HG2      GLN 709  60.469  -2.464  -4.060
    6    HG3  GLN 709           HG3      GLN 709  61.759  -1.289  -3.829
    7   HE21  GLN 709          HE21      GLN 709  60.512  -2.840  -1.878
    8   HE22  GLN 709          HE22      GLN 709  59.773  -1.793  -0.718

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ASN 710           H        ASN 710  62.469   1.001  -6.355
    2    HA   ASN 710           HA       ASN 710  64.741   1.120  -6.122
    3    HB2  ASN 710           HB2      ASN 710  64.108  -0.058  -3.973
    4    HB3  ASN 710           HB3      ASN 710  64.376  -1.577  -4.777
    5   HD21  ASN 710          HD21      ASN 710  65.804  -2.054  -3.173
    6   HD22  ASN 710          HD22      ASN 710  67.387  -1.391  -3.122

  No H/Q in entry =           6
  In of MODEL   38
    1    H    SER 711           H        SER 711  63.518  -0.034  -8.460
    2    HA   SER 711           HA       SER 711  63.979  -0.994 -10.434
    3    HB2  SER 711           HB2      SER 711  66.114   0.276 -10.277
    4    HB3  SER 711           HB3      SER 711  66.852  -1.077  -9.429
    5    HG   SER 711           HG       SER 711  66.179  -2.300 -11.360

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ARG 712           H        ARG 712  63.475  -2.698  -7.912
    2    HA   ARG 712           HA       ARG 712  64.169  -5.200  -9.210
    3    HB2  ARG 712           HB2      ARG 712  64.782  -6.204  -7.078
    4    HB3  ARG 712           HB3      ARG 712  65.837  -4.860  -7.474
    5    HG2  ARG 712           HG2      ARG 712  64.652  -3.457  -5.888
    6    HG3  ARG 712           HG3      ARG 712  63.549  -4.790  -5.528
    7    HD2  ARG 712           HD2      ARG 712  65.495  -6.141  -4.818
    8    HD3  ARG 712           HD3      ARG 712  66.538  -4.758  -5.125
    9    HE   ARG 712           HE       ARG 712  64.447  -4.174  -3.257
   10   HH11  ARG 712          HH11      ARG 712  67.745  -5.408  -3.626
   11   HH12  ARG 712          HH12      ARG 712  68.111  -5.379  -1.971
   12   HH21  ARG 712          HH21      ARG 712  64.948  -4.109  -0.916
   13   HH22  ARG 712          HH22      ARG 712  66.488  -4.608  -0.397

  No H/Q in entry =          13
  In of MODEL   38
    1    H    CYS 713           H        CYS 713  62.860  -6.983  -8.419
    2    HA   CYS 713           HA       CYS 713  60.183  -6.017  -7.801
    3    HB2  CYS 713           HB2      CYS 713  61.108  -8.697  -8.875
    4    HB3  CYS 713           HB3      CYS 713  59.433  -8.256  -8.565

  No H/Q in entry =           4
  In of MODEL   38
    1    H    VAL 714           H        VAL 714  59.633  -6.106  -5.785
    2    HA   VAL 714           HA       VAL 714  60.715  -8.252  -4.127
    3    HB   VAL 714           HB       VAL 714  60.220  -6.779  -2.149
    4   HG11  VAL 714          HG11      VAL 714  62.489  -6.859  -3.034
    5   HG13  VAL 714          HG12      VAL 714  62.115  -5.247  -2.430
    6   HG12  VAL 714          HG13      VAL 714  62.101  -5.565  -4.168
    7   HG22  VAL 714          HG21      VAL 714  59.800  -4.388  -2.487
    8   HG21  VAL 714          HG22      VAL 714  58.511  -5.356  -3.199
    9   HG23  VAL 714          HG23      VAL 714  59.740  -4.630  -4.229

  No H/Q in entry =           9
  In of MODEL   38
    1    H    CYS 715           H        CYS 715  59.002  -8.526  -2.184
    2    HA   CYS 715           HA       CYS 715  56.637  -9.372  -3.628
    3    HB2  CYS 715           HB2      CYS 715  57.475  -9.815  -0.753
    4    HB3  CYS 715           HB3      CYS 715  56.154 -10.626  -1.585

  No H/Q in entry =           4
  In of MODEL   38
    1    H    LYS 716           H        LYS 716  54.493  -8.779  -2.906
    2    HA   LYS 716           HA       LYS 716  54.378  -6.125  -1.847
    3    HB2  LYS 716           HB2      LYS 716  52.190  -8.068  -2.609
    4    HB3  LYS 716           HB3      LYS 716  51.871  -6.473  -1.943
    5    HG2  LYS 716           HG2      LYS 716  52.953  -5.430  -3.838
    6    HG3  LYS 716           HG3      LYS 716  53.385  -7.010  -4.490
    7    HD2  LYS 716           HD2      LYS 716  51.457  -6.167  -5.672
    8    HD3  LYS 716           HD3      LYS 716  50.966  -7.533  -4.677
    9    HE2  LYS 716           HE2      LYS 716  49.312  -5.772  -4.555
   10    HE3  LYS 716           HE3      LYS 716  50.091  -5.957  -2.989
   11    HZ1  LYS 716           HZ1      LYS 716  50.848  -3.886  -4.980
   12    HZ3  LYS 716           HZ2      LYS 716  51.296  -3.899  -3.324
   13    HZ2  LYS 716           HZ3      LYS 716  49.727  -3.652  -3.788

  No H/Q in entry =          13
  In of MODEL   38
    1    H    MET 717           H        MET 717  52.693  -5.723  -0.125
    2    HA   MET 717           HA       MET 717  53.413  -7.440   2.131
    3    HB2  MET 717           HB2      MET 717  52.364  -4.626   2.062
    4    HB3  MET 717           HB3      MET 717  52.912  -5.483   3.488
    5    HG2  MET 717           HG2      MET 717  54.591  -4.607   1.140
    6    HG3  MET 717           HG3      MET 717  54.583  -3.899   2.752
    7    HE3  MET 717           HE1      MET 717  56.203  -6.791   4.881
    8    HE2  MET 717           HE2      MET 717  54.484  -6.539   4.592
    9    HE1  MET 717           HE3      MET 717  55.535  -5.160   4.916

  No H/Q in entry =           9
  In of MODEL   38
    1    HA   PRO 718           HA       PRO 718  49.310  -9.009   2.353
    2    HB2  PRO 718           HB2      PRO 718  48.901  -9.142   5.064
    3    HB3  PRO 718           HB3      PRO 718  49.857 -10.303   4.137
    4    HG2  PRO 718           HG2      PRO 718  50.776  -7.945   5.735
    5    HG3  PRO 718           HG3      PRO 718  51.457  -9.580   5.661
    6    HD2  PRO 718           HD2      PRO 718  52.577  -7.564   4.325
    7    HD3  PRO 718           HD3      PRO 718  52.494  -9.190   3.617

  No H/Q in entry =           7
  In of MODEL   38
    1    H    TYR 719           H        TYR 719  49.912  -5.915   3.629
    2    HA   TYR 719           HA       TYR 719  47.112  -5.479   4.268
    3    HB2  TYR 719           HB2      TYR 719  47.821  -3.207   5.008
    4    HB3  TYR 719           HB3      TYR 719  48.609  -4.512   5.875
    5    HD1  TYR 719           HD1      TYR 719  49.050  -1.747   3.548
    6    HD2  TYR 719           HD2      TYR 719  51.010  -4.905   5.601
    7    HE1  TYR 719           HE1      TYR 719  51.212  -0.680   3.104
    8    HE2  TYR 719           HE2      TYR 719  53.180  -3.833   5.181
    9    HH   TYR 719           HH       TYR 719  53.437  -0.641   4.033

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLU 720           H        GLU 720  49.022  -5.421   1.650
    2    HA   GLU 720           HA       GLU 720  47.547  -3.370   0.199
    3    HB2  GLU 720           HB2      GLU 720  49.710  -5.320  -0.539
    4    HB3  GLU 720           HB3      GLU 720  49.054  -4.140  -1.679
    5    HG2  GLU 720           HG2      GLU 720  49.917  -2.360  -0.187
    6    HG3  GLU 720           HG3      GLU 720  50.603  -3.610   0.853

  No H/Q in entry =           6
  In of MODEL   38
    1    H    CYS 721           H        CYS 721  47.043  -6.335   1.311
    2    HA   CYS 721           HA       CYS 721  45.849  -7.484  -1.088
    3    HB2  CYS 721           HB2      CYS 721  46.602  -8.785   1.519
    4    HB3  CYS 721           HB3      CYS 721  45.998  -9.590   0.069

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLY 722           H        GLY 722  43.794  -8.260  -1.012
    2    HA3  GLY 722           HA2      GLY 722  42.106  -8.465   1.154
    3    HA2  GLY 722           HA3      GLY 722  41.892  -6.850   0.461

  No H/Q in entry =           3
  In of MODEL   38
    1    HA   PRO 723           HA       PRO 723  39.328  -8.538  -2.646
    2    HB2  PRO 723           HB2      PRO 723  39.855  -6.923  -4.778
    3    HB3  PRO 723           HB3      PRO 723  38.900  -6.402  -3.386
    4    HG2  PRO 723           HG2      PRO 723  41.754  -5.846  -4.047
    5    HG3  PRO 723           HG3      PRO 723  40.545  -4.779  -3.315
    6    HD2  PRO 723           HD2      PRO 723  42.494  -6.069  -1.895
    7    HD3  PRO 723           HD3      PRO 723  40.926  -5.601  -1.209

  No H/Q in entry =           7
  In of MODEL   38
    1    H    SER 724           H        SER 724  39.824 -10.538  -3.319
    2    HA   SER 724           HA       SER 724  41.052 -10.993  -5.785
    3    HB2  SER 724           HB2      SER 724  42.886 -12.453  -4.930
    4    HB3  SER 724           HB3      SER 724  43.095 -10.789  -4.471
    5    HG   SER 724           HG       SER 724  42.018 -11.355  -2.515

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU 725           H        LEU 725  41.194 -13.565  -5.820
    2    HA   LEU 725           HA       LEU 725  38.442 -14.277  -5.461
    3    HB2  LEU 725           HB2      LEU 725  40.485 -14.953  -7.152
    4    HB3  LEU 725           HB3      LEU 725  40.329 -16.390  -6.166
    5    HG   LEU 725           HG       LEU 725  37.851 -16.278  -6.763
    6   HD11  LEU 725          HD11      LEU 725  37.741 -14.066  -7.582
    7   HD13  LEU 725          HD12      LEU 725  37.287 -15.218  -8.834
    8   HD12  LEU 725          HD13      LEU 725  38.869 -14.457  -8.878
    9   HD22  LEU 725          HD21      LEU 725  39.351 -17.984  -7.656
   10   HD21  LEU 725          HD22      LEU 725  39.870 -16.855  -8.913
   11   HD23  LEU 725          HD23      LEU 725  38.206 -17.439  -8.886

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ASP 726           H        ASP 726  37.669 -15.117  -3.586
    2    HA   ASP 726           HA       ASP 726  39.387 -16.170  -1.578
    3    HB2  ASP 726           HB2      ASP 726  36.394 -16.094  -1.813
    4    HB3  ASP 726           HB3      ASP 726  37.194 -16.956  -0.509

  No H/Q in entry =           4
  In of MODEL   38
    1    H    VAL 727           H        VAL 727  40.087 -17.976  -1.098
    2    HA   VAL 727           HA       VAL 727  39.224 -20.371  -2.548
    3    HB   VAL 727           HB       VAL 727  41.623 -20.990  -2.934
    4   HG11  VAL 727          HG11      VAL 727  40.741 -18.458  -4.319
    5   HG13  VAL 727          HG12      VAL 727  40.333 -20.104  -4.803
    6   HG12  VAL 727          HG13      VAL 727  42.001 -19.544  -4.902
    7   HG23  VAL 727          HG21      VAL 727  43.351 -19.228  -2.892
    8   HG22  VAL 727          HG22      VAL 727  42.685 -19.544  -1.288
    9   HG21  VAL 727          HG23      VAL 727  42.178 -18.114  -2.187

  No H/Q in entry =           9
  In of MODEL   38
    1    H    CYS 728           H        CYS 728  40.164 -22.377  -1.511
    2    HA   CYS 728           HA       CYS 728  40.287 -21.964   1.379
    3    HB2  CYS 728           HB2      CYS 728  39.959 -24.544  -0.146
    4    HB3  CYS 728           HB3      CYS 728  39.699 -24.281   1.571

  No H/Q in entry =           4
  In of MODEL   38
    1    H    ALA 729           H        ALA 729  42.140 -22.356   2.476
    2    HA   ALA 729           HA       ALA 729  44.284 -23.717   1.028
    3    HB2  ALA 729           HB1      ALA 729  45.857 -22.140   2.020
    4    HB1  ALA 729           HB2      ALA 729  44.513 -21.297   2.781
    5    HB3  ALA 729           HB3      ALA 729  44.663 -21.304   1.024

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLN 730           H        GLN 730  45.840 -24.640   2.456
    2    HA   GLN 730           HA       GLN 730  44.687 -25.285   5.054
    3    HB2  GLN 730           HB2      GLN 730  44.850 -27.250   3.570
    4    HB3  GLN 730           HB3      GLN 730  46.562 -26.946   3.378
    5    HG2  GLN 730           HG2      GLN 730  46.967 -27.338   5.706
    6    HG3  GLN 730           HG3      GLN 730  45.253 -27.538   6.019
    7   HE21  GLN 730          HE21      GLN 730  45.451 -29.627   6.796
    8   HE22  GLN 730          HE22      GLN 730  45.941 -30.935   5.805

  No H/Q in entry =           8
  In of MODEL   38
    1    H    ASP 731           H        ASP 731  45.695 -24.669   6.670
    2    HA   ASP 731           HA       ASP 731  48.123 -23.192   6.712
    3    HB2  ASP 731           HB2      ASP 731  46.265 -22.935   8.328
    4    HB3  ASP 731           HB3      ASP 731  46.545 -24.575   8.882

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLU 732           H        GLU 732  50.166 -24.101   6.652
    2    HA   GLU 732           HA       GLU 732  50.489 -26.924   6.703
    3    HB2  GLU 732           HB2      GLU 732  52.413 -24.648   6.393
    4    HB3  GLU 732           HB3      GLU 732  52.979 -26.279   6.671
    5    HG2  GLU 732           HG2      GLU 732  51.110 -25.527   4.468
    6    HG3  GLU 732           HG3      GLU 732  52.866 -25.656   4.296

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ARG 733           H        ARG 733  50.901 -24.441   9.115
    2    HA   ARG 733           HA       ARG 733  52.653 -26.127  10.623
    3    HB2  ARG 733           HB2      ARG 733  51.639 -23.333  11.041
    4    HB3  ARG 733           HB3      ARG 733  52.810 -24.148  12.062
    5    HG2  ARG 733           HG2      ARG 733  53.157 -23.394   9.151
    6    HG3  ARG 733           HG3      ARG 733  53.970 -22.654  10.532
    7    HD2  ARG 733           HD2      ARG 733  55.113 -24.769  10.997
    8    HD3  ARG 733           HD3      ARG 733  54.270 -25.536   9.657
    9    HE   ARG 733           HE       ARG 733  55.816 -23.231   8.924
   10   HH11  ARG 733          HH11      ARG 733  55.837 -26.753   9.350
   11   HH12  ARG 733          HH12      ARG 733  57.210 -27.020   8.396
   12   HH21  ARG 733          HH21      ARG 733  57.754 -23.603   7.627
   13   HH22  ARG 733          HH22      ARG 733  58.335 -25.195   7.430

  No H/Q in entry =          13
  In of MODEL   38
    1    H    SER 734           H        SER 734  49.387 -24.904  10.708
    2    HA   SER 734           HA       SER 734  48.971 -26.302  13.246
    3    HB2  SER 734           HB2      SER 734  46.947 -24.704  11.681
    4    HB3  SER 734           HB3      SER 734  46.898 -25.136  13.393
    5    HG   SER 734           HG       SER 734  48.268 -23.145  12.068

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LYS 735           H        LYS 735  48.305 -26.651   9.833
    2    HA   LYS 735           HA       LYS 735  47.076 -27.987   8.592
    3    HB2  LYS 735           HB2      LYS 735  47.444 -29.901  10.894
    4    HB3  LYS 735           HB3      LYS 735  46.662 -30.341   9.384
    5    HG2  LYS 735           HG2      LYS 735  49.502 -29.441   9.763
    6    HG3  LYS 735           HG3      LYS 735  48.963 -31.066   9.317
    7    HD2  LYS 735           HD2      LYS 735  47.853 -29.907   7.282
    8    HD3  LYS 735           HD3      LYS 735  48.858 -28.535   7.693
    9    HE2  LYS 735           HE2      LYS 735  49.840 -31.290   6.996
   10    HE3  LYS 735           HE3      LYS 735  49.916 -29.866   5.965
   11    HZ3  LYS 735           HZ1      LYS 735  52.013 -30.243   6.976
   12    HZ2  LYS 735           HZ2      LYS 735  51.355 -30.283   8.520
   13    HZ1  LYS 735           HZ3      LYS 735  51.390 -28.841   7.668

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ARG 736           H        ARG 736  45.504 -26.658   8.459
    2    HA   ARG 736           HA       ARG 736  42.968 -27.609   9.317
    3    HB2  ARG 736           HB2      ARG 736  42.292 -25.414  10.326
    4    HB3  ARG 736           HB3      ARG 736  43.510 -26.242  11.281
    5    HG2  ARG 736           HG2      ARG 736  45.236 -24.811  10.373
    6    HG3  ARG 736           HG3      ARG 736  44.053 -23.986   9.359
    7    HD2  ARG 736           HD2      ARG 736  42.919 -23.187  11.368
    8    HD3  ARG 736           HD3      ARG 736  44.086 -24.054  12.371
    9    HE   ARG 736           HE       ARG 736  45.677 -22.474  10.860
   10   HH11  ARG 736          HH11      ARG 736  42.888 -21.757  12.908
   11   HH12  ARG 736          HH12      ARG 736  43.379 -20.155  13.218
   12   HH21  ARG 736          HH21      ARG 736  46.333 -20.325  11.282
   13   HH22  ARG 736          HH22      ARG 736  45.406 -19.325  12.291

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ILE 737           H        ILE 737  41.458 -26.942   7.718
    2    HA   ILE 737           HA       ILE 737  42.516 -25.458   5.506
    3    HB   ILE 737           HB       ILE 737  39.654 -26.309   6.013
    4   HG12  ILE 737          HG12      ILE 737  41.105 -28.309   6.091
    5   HG13  ILE 737          HG13      ILE 737  40.093 -28.312   4.651
    6   HG21  ILE 737          HG21      ILE 737  39.982 -24.609   4.280
    7   HG23  ILE 737          HG22      ILE 737  39.416 -26.125   3.595
    8   HG22  ILE 737          HG23      ILE 737  41.112 -25.677   3.443
    9   HD13  ILE 737          HD11      ILE 737  42.314 -29.069   4.127
   10   HD12  ILE 737          HD12      ILE 737  43.004 -27.597   4.810
   11   HD11  ILE 737          HD13      ILE 737  42.007 -27.510   3.353

  No H/Q in entry =          11
  In of MODEL   38
    1    H    LEU 738           H        LEU 738  42.355 -23.307   5.381
    2    HA   LEU 738           HA       LEU 738  40.184 -22.071   6.822
    3    HB2  LEU 738           HB2      LEU 738  41.467 -20.222   7.630
    4    HB3  LEU 738           HB3      LEU 738  42.211 -21.692   8.221
    5    HG   LEU 738           HG       LEU 738  43.237 -19.921   5.990
    6   HD11  LEU 738          HD11      LEU 738  43.432 -18.905   8.191
    7   HD13  LEU 738          HD12      LEU 738  45.017 -19.357   7.567
    8   HD12  LEU 738          HD13      LEU 738  44.238 -20.349   8.800
    9   HD23  LEU 738          HD21      LEU 738  45.252 -21.316   6.090
   10   HD22  LEU 738          HD22      LEU 738  43.789 -22.212   5.635
   11   HD21  LEU 738          HD23      LEU 738  44.426 -22.356   7.274

  No H/Q in entry =          11
  In of MODEL   38
    1    HA   PRO 739           HA       PRO 739  39.383 -20.071   3.054
    2    HB2  PRO 739           HB2      PRO 739  38.024 -17.920   3.987
    3    HB3  PRO 739           HB3      PRO 739  37.343 -19.556   4.000
    4    HG2  PRO 739           HG2      PRO 739  38.672 -18.055   6.222
    5    HG3  PRO 739           HG3      PRO 739  37.162 -18.987   6.258
    6    HD2  PRO 739           HD2      PRO 739  39.529 -20.059   7.105
    7    HD3  PRO 739           HD3      PRO 739  38.274 -21.021   6.261

  No H/Q in entry =           7
  In of MODEL   38
    1    H    LEU 740           H        LEU 740  40.937 -19.121   1.969
    2    HA   LEU 740           HA       LEU 740  41.989 -16.613   3.011
    3    HB2  LEU 740           HB2      LEU 740  43.465 -18.759   1.509
    4    HB3  LEU 740           HB3      LEU 740  44.049 -17.118   1.613
    5    HG   LEU 740           HG       LEU 740  43.681 -19.021   3.931
    6   HD11  LEU 740          HD11      LEU 740  45.547 -19.529   2.477
    7   HD13  LEU 740          HD12      LEU 740  46.095 -18.925   4.042
    8   HD12  LEU 740          HD13      LEU 740  46.132 -17.872   2.622
    9   HD21  LEU 740          HD21      LEU 740  44.699 -16.182   3.845
   10   HD23  LEU 740          HD22      LEU 740  44.830 -17.267   5.227
   11   HD22  LEU 740          HD23      LEU 740  43.241 -16.757   4.660

  No H/Q in entry =          11
  In of MODEL   38
    1    H    THR 741           H        THR 741  43.156 -15.589   0.968
    2    HA   THR 741           HA       THR 741  41.265 -15.727  -1.233
    3    HB   THR 741           HB       THR 741  42.342 -13.088  -0.316
    4    HG1  THR 741           HG1      THR 741  39.972 -14.219   0.795
    5   HG23  THR 741          HG21      THR 741  40.934 -13.255  -2.299
    6   HG22  THR 741          HG22      THR 741  40.150 -12.298  -1.049
    7   HG21  THR 741          HG23      THR 741  39.638 -13.965  -1.336

  No H/Q in entry =           7
  In of MODEL   38
    1    H    VAL 742           H        VAL 742  42.327 -15.277  -3.195
    2    HA   VAL 742           HA       VAL 742  44.781 -16.316  -3.625
    3    HB   VAL 742           HB       VAL 742  43.350 -14.243  -5.259
    4   HG11  VAL 742          HG11      VAL 742  45.672 -14.160  -5.860
    5   HG13  VAL 742          HG12      VAL 742  44.675 -14.845  -7.131
    6   HG12  VAL 742          HG13      VAL 742  45.691 -15.915  -6.136
    7   HG21  VAL 742          HG21      VAL 742  42.205 -16.293  -4.964
    8   HG23  VAL 742          HG22      VAL 742  43.619 -17.198  -5.576
    9   HG22  VAL 742          HG23      VAL 742  42.740 -16.064  -6.627

  No H/Q in entry =           9
  In of MODEL   38
    1    H    CYS 743           H        CYS 743  44.267 -12.790  -3.296
    2    HA   CYS 743           HA       CYS 743  46.981 -12.222  -3.829
    3    HB2  CYS 743           HB2      CYS 743  46.496  -9.924  -3.190
    4    HB3  CYS 743           HB3      CYS 743  45.169 -10.569  -4.131

  No H/Q in entry =           4
  In of MODEL   38
    1    H    LYS 744           H        LYS 744  45.137 -12.677  -0.919
    2    HA   LYS 744           HA       LYS 744  47.098 -11.925   0.943
    3    HB2  LYS 744           HB2      LYS 744  44.609 -13.599   1.097
    4    HB3  LYS 744           HB3      LYS 744  45.646 -13.323   2.497
    5    HG2  LYS 744           HG2      LYS 744  45.144 -11.055   2.592
    6    HG3  LYS 744           HG3      LYS 744  44.717 -10.993   0.887
    7    HD2  LYS 744           HD2      LYS 744  42.776 -10.695   2.337
    8    HD3  LYS 744           HD3      LYS 744  42.625 -12.118   1.331
    9    HE2  LYS 744           HE2      LYS 744  43.288 -13.509   3.263
   10    HE3  LYS 744           HE3      LYS 744  43.366 -12.049   4.252
   11    HZ2  LYS 744           HZ1      LYS 744  41.240 -13.202   4.498
   12    HZ1  LYS 744           HZ2      LYS 744  40.937 -13.030   2.839
   13    HZ3  LYS 744           HZ3      LYS 744  41.023 -11.668   3.828

  No H/Q in entry =          13
  In of MODEL   38
    1    H    MET 745           H        MET 745  46.028 -15.125  -0.129
    2    HA   MET 745           HA       MET 745  47.932 -16.712   1.182
    3    HB2  MET 745           HB2      MET 745  46.393 -18.029   0.283
    4    HB3  MET 745           HB3      MET 745  46.101 -17.001  -1.119
    5    HG2  MET 745           HG2      MET 745  46.939 -19.077  -1.923
    6    HG3  MET 745           HG3      MET 745  48.214 -17.897  -2.086
    7    HE3  MET 745           HE1      MET 745  47.097 -19.937   1.147
    8    HE2  MET 745           HE2      MET 745  48.125 -21.363   0.902
    9    HE1  MET 745           HE3      MET 745  46.888 -20.945  -0.280

  No H/Q in entry =           9
  In of MODEL   38
    1    H    HIS 746           H        HIS 746  48.100 -15.260  -2.091
    2    HA   HIS 746           HA       HIS 746  50.611 -16.310  -2.765
    3    HB2  HIS 746           HB2      HIS 746  48.896 -14.236  -3.790
    4    HB3  HIS 746           HB3      HIS 746  50.613 -13.917  -4.077
    5    HD1  HIS 746           HD1      HIS 746  51.807 -16.359  -5.052
    6    HD2  HIS 746           HD2      HIS 746  47.817 -15.497  -5.827
    7    HE1  HIS 746           HE1      HIS 746  51.244 -17.671  -7.053
    8    HE2  HIS 746           HE2      HIS 746  48.817 -17.031  -7.598

  No H/Q in entry =           8
  In of MODEL   38
    1    H    VAL 747           H        VAL 747  49.869 -13.103  -1.437
    2    HA   VAL 747           HA       VAL 747  52.550 -12.344  -1.280
    3    HB   VAL 747           HB       VAL 747  50.020 -11.289  -0.013
    4   HG12  VAL 747          HG11      VAL 747  52.790 -10.095   0.325
    5   HG11  VAL 747          HG12      VAL 747  51.859 -10.855   1.607
    6   HG13  VAL 747          HG13      VAL 747  51.285  -9.371   0.879
    7   HG23  VAL 747          HG21      VAL 747  51.939 -10.212  -2.078
    8   HG22  VAL 747          HG22      VAL 747  50.479  -9.397  -1.519
    9   HG21  VAL 747          HG23      VAL 747  50.360 -10.917  -2.396

  No H/Q in entry =           9
  In of MODEL   38
    1    H    LEU 748           H        LEU 748  50.385 -13.755   1.068
    2    HA   LEU 748           HA       LEU 748  52.089 -13.919   3.246
    3    HB2  LEU 748           HB2      LEU 748  49.853 -14.337   3.649
    4    HB3  LEU 748           HB3      LEU 748  49.671 -15.327   2.238
    5    HG   LEU 748           HG       LEU 748  51.076 -16.360   4.709
    6   HD11  LEU 748          HD11      LEU 748  48.826 -15.485   5.299
    7   HD13  LEU 748          HD12      LEU 748  48.898 -17.245   5.367
    8   HD12  LEU 748          HD13      LEU 748  48.135 -16.444   3.989
    9   HD21  LEU 748          HD21      LEU 748  51.274 -17.628   2.584
   10   HD23  LEU 748          HD22      LEU 748  49.510 -17.691   2.483
   11   HD22  LEU 748          HD23      LEU 748  50.349 -18.497   3.809

  No H/Q in entry =          11
  In of MODEL   38
    1    H    HIS 749           H        HIS 749  51.785 -15.985   0.451
    2    HA   HIS 749           HA       HIS 749  53.463 -18.082   1.375
    3    HB2  HIS 749           HB2      HIS 749  51.653 -17.928  -0.575
    4    HB3  HIS 749           HB3      HIS 749  53.078 -17.578  -1.539
    5    HD1  HIS 749           HD1      HIS 749  54.703 -19.551  -1.983
    6    HD2  HIS 749           HD2      HIS 749  51.474 -20.499   0.446
    7    HE1  HIS 749           HE1      HIS 749  54.681 -22.049  -1.836
    8    HE2  HIS 749           HE2      HIS 749  52.563 -22.585  -0.609

  No H/Q in entry =           8
  In of MODEL   38
    1    H    CYS 750           H        CYS 750  53.973 -15.156  -0.595
    2    HA   CYS 750           HA       CYS 750  56.695 -15.916  -1.091
    3    HB2  CYS 750           HB2      CYS 750  56.899 -13.745  -2.318
    4    HB3  CYS 750           HB3      CYS 750  55.548 -14.712  -2.861

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLN 751           H        GLN 751  55.001 -14.180   1.291
    2    HA   GLN 751           HA       GLN 751  57.230 -12.906   2.527
    3    HB2  GLN 751           HB2      GLN 751  54.552 -13.798   3.620
    4    HB3  GLN 751           HB3      GLN 751  55.730 -12.928   4.581
    5    HG2  GLN 751           HG2      GLN 751  54.546 -11.879   2.030
    6    HG3  GLN 751           HG3      GLN 751  53.867 -11.534   3.609
    7   HE21  GLN 751          HE21      GLN 751  54.919  -9.652   1.641
    8   HE22  GLN 751          HE22      GLN 751  56.229  -8.853   2.394

  No H/Q in entry =           8
  In of MODEL   38
    1    H    GLY 752           H        GLY 752  56.310 -16.122   2.163
    2    HA3  GLY 752           HA2      GLY 752  57.913 -17.800   2.625
    3    HA2  GLY 752           HA3      GLY 752  58.414 -16.891   4.041

  No H/Q in entry =           3
  In of MODEL   38
    1    H    ARG 753           H        ARG 753  55.011 -17.064   3.736
    2    HA   ARG 753           HA       ARG 753  55.031 -18.909   5.968
    3    HB2  ARG 753           HB2      ARG 753  52.663 -17.633   4.611
    4    HB3  ARG 753           HB3      ARG 753  52.640 -18.470   6.151
    5    HG2  ARG 753           HG2      ARG 753  53.747 -15.737   5.504
    6    HG3  ARG 753           HG3      ARG 753  52.442 -16.148   6.606
    7    HD2  ARG 753           HD2      ARG 753  54.101 -15.784   8.128
    8    HD3  ARG 753           HD3      ARG 753  54.407 -17.492   7.794
    9    HE   ARG 753           HE       ARG 753  55.791 -15.578   6.126
   10   HH11  ARG 753          HH11      ARG 753  56.086 -17.680   8.962
   11   HH12  ARG 753          HH12      ARG 753  57.787 -17.707   8.909
   12   HH21  ARG 753          HH21      ARG 753  58.107 -15.585   6.090
   13   HH22  ARG 753          HH22      ARG 753  58.945 -16.479   7.265

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ASN 754           H        ASN 754  54.762 -21.034   5.696
    2    HA   ASN 754           HA       ASN 754  54.153 -22.010   3.064
    3    HB2  ASN 754           HB2      ASN 754  54.718 -23.569   5.601
    4    HB3  ASN 754           HB3      ASN 754  54.479 -24.276   4.015
    5   HD21  ASN 754          HD21      ASN 754  56.687 -24.550   5.694
    6   HD22  ASN 754          HD22      ASN 754  58.086 -23.950   4.903

  No H/Q in entry =           6
  In of MODEL   38
    1    H    TYR 755           H        TYR 755  52.243 -22.290   2.384
    2    HA   TYR 755           HA       TYR 755  50.188 -23.452   4.080
    3    HB2  TYR 755           HB2      TYR 755  49.884 -20.966   2.378
    4    HB3  TYR 755           HB3      TYR 755  48.542 -22.014   2.722
    5    HD1  TYR 755           HD1      TYR 755  51.264 -20.539   4.867
    6    HD2  TYR 755           HD2      TYR 755  47.113 -21.045   4.175
    7    HE1  TYR 755           HE1      TYR 755  50.777 -19.198   6.858
    8    HE2  TYR 755           HE2      TYR 755  46.611 -19.709   6.149
    9    HH   TYR 755           HH       TYR 755  48.929 -17.813   7.681

  No H/Q in entry =           9
  In of MODEL   38
    1    H    THR 756           H        THR 756  48.743 -24.688   2.854
    2    HA   THR 756           HA       THR 756  49.738 -25.422   0.197
    3    HB   THR 756           HB       THR 756  48.147 -26.990   2.253
    4    HG1  THR 756           HG1      THR 756  50.067 -27.469   3.033
    5   HG22  THR 756          HG21      THR 756  48.585 -28.932   0.825
    6   HG21  THR 756          HG22      THR 756  49.384 -27.872  -0.351
    7   HG23  THR 756          HG23      THR 756  47.655 -27.692  -0.025

  No H/Q in entry =           7
  In of MODEL   38
    1    H    LEU 757           H        LEU 757  48.117 -25.683  -1.486
    2    HA   LEU 757           HA       LEU 757  45.662 -24.219  -0.945
    3    HB2  LEU 757           HB2      LEU 757  46.960 -25.130  -3.507
    4    HB3  LEU 757           HB3      LEU 757  45.298 -24.586  -3.479
    5    HG   LEU 757           HG       LEU 757  46.672 -22.816  -4.277
    6   HD13  LEU 757          HD11      LEU 757  44.824 -22.136  -2.937
    7   HD12  LEU 757          HD12      LEU 757  46.175 -21.033  -2.689
    8   HD11  LEU 757          HD13      LEU 757  45.791 -22.243  -1.468
    9   HD21  LEU 757          HD21      LEU 757  48.296 -23.072  -1.739
   10   HD23  LEU 757          HD22      LEU 757  48.484 -21.803  -2.947
   11   HD22  LEU 757          HD23      LEU 757  48.836 -23.480  -3.367

  No H/Q in entry =          11
  In of MODEL   38
    1    H    THR 758           H        THR 758  43.605 -25.085  -1.295
    2    HA   THR 758           HA       THR 758  43.534 -27.963  -1.630
    3    HB   THR 758           HB       THR 758  41.720 -27.997   0.209
    4    HG1  THR 758           HG1      THR 758  42.488 -25.389   0.287
    5   HG23  THR 758          HG21      THR 758  43.387 -28.240   2.006
    6   HG22  THR 758          HG22      THR 758  44.577 -27.397   1.022
    7   HG21  THR 758          HG23      THR 758  43.970 -28.974   0.512

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLY 759           H        GLY 759  40.816 -28.374  -1.419
    2    HA3  GLY 759           HA2      GLY 759  40.027 -27.299  -3.979
    3    HA2  GLY 759           HA3      GLY 759  39.138 -28.476  -3.019

  No H/Q in entry =           3
  In of MODEL   38
    1    H    ARG 760           H        ARG 760  37.828 -26.423  -4.280
    2    HA   ARG 760           HA       ARG 760  37.498 -24.118  -2.595
    3    HB2  ARG 760           HB2      ARG 760  35.959 -23.304  -4.156
    4    HB3  ARG 760           HB3      ARG 760  36.927 -24.369  -5.155
    5    HG2  ARG 760           HG2      ARG 760  34.265 -25.087  -3.940
    6    HG3  ARG 760           HG3      ARG 760  34.477 -24.533  -5.604
    7    HD2  ARG 760           HD2      ARG 760  35.771 -26.549  -6.093
    8    HD3  ARG 760           HD3      ARG 760  35.689 -27.001  -4.379
    9    HE   ARG 760           HE       ARG 760  33.089 -26.702  -5.326
   10   HH11  ARG 760          HH11      ARG 760  35.816 -28.841  -5.984
   11   HH12  ARG 760          HH12      ARG 760  34.872 -30.239  -6.182
   12   HH21  ARG 760          HH21      ARG 760  31.777 -28.628  -5.585
   13   HH22  ARG 760          HH22      ARG 760  32.510 -30.118  -5.935

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ASP 761           H        ASP 761  36.548 -27.220  -2.236
    2    HA   ASP 761           HA       ASP 761  34.023 -26.601  -0.935
    3    HB2  ASP 761           HB2      ASP 761  34.007 -28.306  -2.710
    4    HB3  ASP 761           HB3      ASP 761  35.165 -29.257  -1.797

  No H/Q in entry =           4
  In of MODEL   38
    1    H    SER 762           H        SER 762  37.244 -26.998  -0.187
    2    HA   SER 762           HA       SER 762  37.131 -28.750   2.020
    3    HB2  SER 762           HB2      SER 762  39.172 -26.586   1.443
    4    HB3  SER 762           HB3      SER 762  39.386 -27.938   2.551
    5    HG   SER 762           HG       SER 762  38.762 -29.183   0.471

  No H/Q in entry =           5
  In of MODEL   38
    1    H    CYS 763           H        CYS 763  36.728 -25.224   1.775
    2    HA   CYS 763           HA       CYS 763  35.411 -25.312   4.329
    3    HB2  CYS 763           HB2      CYS 763  36.566 -23.358   5.217
    4    HB3  CYS 763           HB3      CYS 763  37.730 -24.652   4.913

  No H/Q in entry =           4
  In of MODEL   38
    1    H    THR 764           H        THR 764  34.497 -22.889   4.653
    2    HA   THR 764           HA       THR 764  33.056 -22.368   2.167
    3    HB   THR 764           HB       THR 764  32.635 -21.227   4.948
    4    HG1  THR 764           HG1      THR 764  31.582 -23.597   3.747
    5   HG23  THR 764          HG21      THR 764  30.328 -20.908   4.168
    6   HG22  THR 764          HG22      THR 764  30.747 -21.624   2.612
    7   HG21  THR 764          HG23      THR 764  31.462 -20.086   3.093

  No H/Q in entry =           7
  In of MODEL   38
    1    H    LEU 765           H        LEU 765  32.990 -20.274   1.221
    2    HA   LEU 765           HA       LEU 765  35.096 -18.549   2.200
    3    HB2  LEU 765           HB2      LEU 765  34.193 -19.056  -0.561
    4    HB3  LEU 765           HB3      LEU 765  35.021 -17.556  -0.204
    5    HG   LEU 765           HG       LEU 765  36.693 -18.849  -1.060
    6   HD12  LEU 765          HD11      LEU 765  36.865 -19.582   1.837
    7   HD11  LEU 765          HD12      LEU 765  37.447 -18.086   1.121
    8   HD13  LEU 765          HD13      LEU 765  38.174 -19.630   0.668
    9   HD23  LEU 765          HD21      LEU 765  36.990 -21.159  -0.655
   10   HD22  LEU 765          HD22      LEU 765  35.410 -20.727  -1.377
   11   HD21  LEU 765          HD23      LEU 765  35.525 -21.136   0.365

  No H/Q in entry =          11
  In of MODEL   38
    1    HA   PRO 766           HA       PRO 766  32.304 -15.221   2.940
    2    HB2  PRO 766           HB2      PRO 766  34.049 -13.236   2.086
    3    HB3  PRO 766           HB3      PRO 766  34.042 -13.967   3.696
    4    HG2  PRO 766           HG2      PRO 766  35.700 -14.770   1.300
    5    HG3  PRO 766           HG3      PRO 766  36.246 -14.499   2.980
    6    HD2  PRO 766           HD2      PRO 766  35.903 -16.838   2.021
    7    HD3  PRO 766           HD3      PRO 766  35.244 -16.510   3.638

  No H/Q in entry =           7
  In of MODEL   38
    1    H    ALA 767           H        ALA 767  34.235 -14.703  -0.093
    2    HA   ALA 767           HA       ALA 767  31.762 -13.717  -1.296
    3    HB3  ALA 767           HB1      ALA 767  33.136 -12.322  -2.732
    4    HB2  ALA 767           HB2      ALA 767  34.596 -12.968  -1.980
    5    HB1  ALA 767           HB3      ALA 767  33.470 -11.997  -1.033

  No H/Q in entry =           5
  In of MODEL   38
    1    H    SER 768           H        SER 768  30.995 -14.712  -2.946
    2    HA   SER 768           HA       SER 768  32.560 -15.947  -4.973
    3    HB2  SER 768           HB2      SER 768  32.580 -17.721  -3.153
    4    HB3  SER 768           HB3      SER 768  30.828 -17.813  -3.312
    5    HG   SER 768           HG       SER 768  31.116 -19.076  -4.961

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA 769           H        ALA 769  29.413 -15.373  -3.444
    2    HA   ALA 769           HA       ALA 769  28.163 -15.479  -6.087
    3    HB1  ALA 769           HB1      ALA 769  26.071 -15.935  -4.932
    4    HB3  ALA 769           HB2      ALA 769  26.884 -15.809  -3.378
    5    HB2  ALA 769           HB3      ALA 769  27.291 -17.122  -4.479

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLU 770           H        GLU 770  25.911 -14.151  -5.656
    2    HA   GLU 770           HA       GLU 770  26.721 -11.424  -5.684
    3    HB2  GLU 770           HB2      GLU 770  24.349 -11.008  -6.215
    4    HB3  GLU 770           HB3      GLU 770  25.047 -12.256  -7.235
    5    HG2  GLU 770           HG2      GLU 770  24.034 -13.950  -5.661
    6    HG3  GLU 770           HG3      GLU 770  23.177 -12.609  -4.921

  No H/Q in entry =           6
  In of MODEL   38
    1    H    LYS 771           H        LYS 771  26.094  -9.816  -4.296
    2    HA   LYS 771           HA       LYS 771  25.244 -10.726  -1.653
    3    HB2  LYS 771           HB2      LYS 771  27.399  -8.705  -2.291
    4    HB3  LYS 771           HB3      LYS 771  26.794  -9.040  -0.685
    5    HG2  LYS 771           HG2      LYS 771  28.028 -11.184  -2.396
    6    HG3  LYS 771           HG3      LYS 771  29.001 -10.120  -1.393
    7    HD2  LYS 771           HD2      LYS 771  28.595 -12.270  -0.293
    8    HD3  LYS 771           HD3      LYS 771  27.844 -10.957   0.617
    9    HE2  LYS 771           HE2      LYS 771  25.697 -11.633  -0.074
   10    HE3  LYS 771           HE3      LYS 771  26.341 -12.733  -1.312
   11    HZ1  LYS 771           HZ1      LYS 771  26.628 -13.035   1.634
   12    HZ3  LYS 771           HZ2      LYS 771  27.138 -14.137   0.483
   13    HZ2  LYS 771           HZ3      LYS 771  25.497 -13.838   0.689

  No H/Q in entry =          13
  In of MODEL   38
    1    H    ALA 772           H        ALA 772  24.924  -8.391  -0.376
    2    HA   ALA 772           HA       ALA 772  23.083  -6.879  -2.082
    3    HB3  ALA 772           HB1      ALA 772  23.031  -7.269   0.921
    4    HB2  ALA 772           HB2      ALA 772  21.930  -8.009  -0.245
    5    HB1  ALA 772           HB3      ALA 772  21.910  -6.266   0.006

  No H/Q in entry =           5
  In of MODEL   38
    1    H    CYS 773           H        CYS 773  22.823  -4.544  -0.954
    2    HA   CYS 773           HA       CYS 773  25.262  -3.214  -1.224
    3    HB2  CYS 773           HB2      CYS 773  22.762  -2.321   0.240
    4    HB3  CYS 773           HB3      CYS 773  24.098  -1.269  -0.226

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLY 774           H        GLY 774  26.920  -2.952   0.097
    2    HA3  GLY 774           HA2      GLY 774  27.594  -2.430   2.424
    3    HA2  GLY 774           HA3      GLY 774  26.594  -3.804   2.895

  No H/Q in entry =           3
  In of MODEL   38
    1    H    ALA 775           H        ALA 775  27.394  -5.178   0.364
    2    HA   ALA 775           HA       ALA 775  30.205  -5.734   0.852
    3    HB1  ALA 775           HB1      ALA 775  29.765  -8.160   0.757
    4    HB2  ALA 775           HB2      ALA 775  28.031  -7.834   0.717
    5    HB3  ALA 775           HB3      ALA 775  28.975  -7.409   2.144

  No H/Q in entry =           5
  In of MODEL   38
    1    H    CYS 776           H        CYS 776  31.057  -5.238  -1.062
    2    HA   CYS 776           HA       CYS 776  29.608  -6.137  -3.441
    3    HB2  CYS 776           HB2      CYS 776  29.583  -3.726  -3.311
    4    HB3  CYS 776           HB3      CYS 776  31.329  -3.672  -3.094

  No H/Q in entry =           4
  In of MODEL   38
    1    HA   PRO 777           HA       PRO 777  33.411  -8.605  -3.762
    2    HB2  PRO 777           HB2      PRO 777  31.863  -9.721  -6.027
    3    HB3  PRO 777           HB3      PRO 777  32.616 -10.569  -4.674
    4    HG2  PRO 777           HG2      PRO 777  29.956 -10.314  -4.845
    5    HG3  PRO 777           HG3      PRO 777  30.797 -10.242  -3.285
    6    HD2  PRO 777           HD2      PRO 777  29.708  -8.011  -4.954
    7    HD3  PRO 777           HD3      PRO 777  29.676  -8.226  -3.190

  No H/Q in entry =           7
  In of MODEL   38
    1    H    LEU 778           H        LEU 778  35.049  -8.406  -5.280
    2    HA   LEU 778           HA       LEU 778  34.852  -6.103  -6.865
    3    HB2  LEU 778           HB2      LEU 778  37.225  -6.402  -7.429
    4    HB3  LEU 778           HB3      LEU 778  36.895  -6.449  -5.731
    5    HG   LEU 778           HG       LEU 778  38.684  -7.950  -6.278
    6   HD11  LEU 778          HD11      LEU 778  37.294  -8.626  -4.437
    7   HD13  LEU 778          HD12      LEU 778  37.991 -10.001  -5.285
    8   HD12  LEU 778          HD13      LEU 778  36.298  -9.594  -5.533
    9   HD21  LEU 778          HD21      LEU 778  36.771  -9.339  -8.125
   10   HD23  LEU 778          HD22      LEU 778  38.340  -9.978  -7.652
   11   HD22  LEU 778          HD23      LEU 778  38.243  -8.476  -8.583

  No H/Q in entry =          11
  In of MODEL   38
    1    H    TRP 779           H        TRP 779  33.901  -9.106  -7.655
    2    HA   TRP 779           HA       TRP 779  34.225  -8.679 -10.531
    3    HB2  TRP 779           HB2      TRP 779  33.255 -11.067 -10.620
    4    HB3  TRP 779           HB3      TRP 779  34.908 -10.865 -10.054
    5    HD1  TRP 779           HD1      TRP 779  31.359 -11.589  -8.644
    6    HE1  TRP 779           HE1      TRP 779  31.659 -12.863  -6.416
    7    HE3  TRP 779           HE3      TRP 779  36.421 -11.373  -8.281
    8    HZ2  TRP 779           HZ2      TRP 779  33.810 -13.654  -4.725
    9    HZ3  TRP 779           HZ3      TRP 779  37.532 -12.375  -6.355
   10    HH2  TRP 779           HH2      TRP 779  36.282 -13.508  -4.622

  No H/Q in entry =          10
  In of MODEL   38
    1    H    GLY 780           H        GLY 780  32.273  -7.650  -8.310
    2    HA3  GLY 780           HA2      GLY 780  29.931  -7.873 -10.008
    3    HA2  GLY 780           HA3      GLY 780  29.816  -8.011  -8.248

  No H/Q in entry =           3
  In of MODEL   38
    1    H    LYS 781           H        LYS 781  28.354  -6.100  -9.137
    2    HA   LYS 781           HA       LYS 781  29.629  -3.778  -8.095
    3    HB2  LYS 781           HB2      LYS 781  30.356  -3.836 -10.525
    4    HB3  LYS 781           HB3      LYS 781  28.669  -3.621 -10.964
    5    HG2  LYS 781           HG2      LYS 781  28.624  -1.482  -9.781
    6    HG3  LYS 781           HG3      LYS 781  30.302  -1.703  -9.308
    7    HD2  LYS 781           HD2      LYS 781  29.257  -1.376 -12.129
    8    HD3  LYS 781           HD3      LYS 781  30.179  -0.191 -11.209
    9    HE2  LYS 781           HE2      LYS 781  32.043  -1.846 -11.099
   10    HE3  LYS 781           HE3      LYS 781  31.125  -2.877 -12.192
   11    HZ2  LYS 781           HZ1      LYS 781  32.375  -0.262 -12.728
   12    HZ1  LYS 781           HZ2      LYS 781  31.120  -0.831 -13.709
   13    HZ3  LYS 781           HZ3      LYS 781  32.544  -1.708 -13.585

  No H/Q in entry =          13
  In of MODEL   38
    1    H    CYS 782           H        CYS 782  28.096  -2.330  -7.404
    2    HA   CYS 782           HA       CYS 782  25.339  -3.143  -7.882
    3    HB2  CYS 782           HB2      CYS 782  26.079  -2.975  -5.483
    4    HB3  CYS 782           HB3      CYS 782  26.451  -1.279  -5.754

  No H/Q in entry =           4
  In of MODEL   38
    1    H    ASP 783           H        ASP 783  25.381  -2.250  -9.959
    2    HA   ASP 783           HA       ASP 783  25.364   0.694  -9.949
    3    HB2  ASP 783           HB2      ASP 783  26.430   0.784 -12.075
    4    HB3  ASP 783           HB3      ASP 783  27.388  -0.309 -11.091

  No H/Q in entry =           4
  In of MODEL   38
    1    H    ALA 784           H        ALA 784  24.103  -2.232 -11.454
    2    HA   ALA 784           HA       ALA 784  22.307  -0.824 -13.133
    3    HB2  ALA 784           HB1      ALA 784  22.313  -3.735 -12.384
    4    HB1  ALA 784           HB2      ALA 784  23.208  -3.013 -13.720
    5    HB3  ALA 784           HB3      ALA 784  21.444  -3.004 -13.731

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLU 785           H        GLU 785  22.074  -2.183  -9.966
    2    HA   GLU 785           HA       GLU 785  19.179  -1.718 -10.034
    3    HB2  GLU 785           HB2      GLU 785  20.767  -3.545  -8.265
    4    HB3  GLU 785           HB3      GLU 785  19.048  -3.240  -8.091
    5    HG2  GLU 785           HG2      GLU 785  18.660  -4.134 -10.320
    6    HG3  GLU 785           HG3      GLU 785  20.388  -4.441 -10.497

  No H/Q in entry =           6
  In of MODEL   38
    1    H    SER 786           H        SER 786  21.906  -1.479  -7.742
    2    HA   SER 786           HA       SER 786  22.172  -0.422  -5.827
    3    HB2  SER 786           HB2      SER 786  20.160   1.621  -6.873
    4    HB3  SER 786           HB3      SER 786  21.319   1.879  -5.565
    5    HG   SER 786           HG       SER 786  21.658   1.892  -8.276

  No H/Q in entry =           5
  In of MODEL   38
    1    H    SER 787           H        SER 787  21.315  -2.248  -4.998
    2    HA   SER 787           HA       SER 787  19.209  -2.087  -3.168
    3    HB2  SER 787           HB2      SER 787  17.813  -2.222  -5.262
    4    HB3  SER 787           HB3      SER 787  18.639  -3.713  -5.691
    5    HG   SER 787           HG       SER 787  17.108  -4.605  -4.672

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LYS 788           H        LYS 788  20.889  -4.254  -5.457
    2    HA   LYS 788           HA       LYS 788  22.247  -5.447  -3.227
    3    HB2  LYS 788           HB2      LYS 788  21.883  -7.717  -3.939
    4    HB3  LYS 788           HB3      LYS 788  20.309  -6.971  -3.787
    5    HG2  LYS 788           HG2      LYS 788  20.134  -6.765  -6.200
    6    HG3  LYS 788           HG3      LYS 788  21.776  -7.388  -6.390
    7    HD2  LYS 788           HD2      LYS 788  21.047  -9.485  -5.261
    8    HD3  LYS 788           HD3      LYS 788  19.402  -8.863  -5.251
    9    HE2  LYS 788           HE2      LYS 788  21.076  -9.408  -7.705
   10    HE3  LYS 788           HE3      LYS 788  19.781 -10.431  -7.100
   11    HZ2  LYS 788           HZ1      LYS 788  19.521  -7.682  -8.213
   12    HZ1  LYS 788           HZ2      LYS 788  18.264  -8.514  -7.465
   13    HZ3  LYS 788           HZ3      LYS 788  18.938  -9.118  -8.867

  No H/Q in entry =          13
  In of MODEL   38
    1    H    CYS 789           H        CYS 789  24.015  -6.958  -4.273
    2    HA   CYS 789           HA       CYS 789  25.244  -5.343  -6.376
    3    HB2  CYS 789           HB2      CYS 789  26.504  -5.572  -4.237
    4    HB3  CYS 789           HB3      CYS 789  26.457  -7.318  -4.416

  No H/Q in entry =           4
  In of MODEL   38
    1    H    VAL 790           H        VAL 790  25.374  -6.252  -8.335
    2    HA   VAL 790           HA       VAL 790  24.655  -9.085  -8.557
    3    HB   VAL 790           HB       VAL 790  23.156  -7.328  -9.615
    4   HG13  VAL 790          HG11      VAL 790  23.812  -6.284 -11.723
    5   HG12  VAL 790          HG12      VAL 790  25.455  -6.874 -11.482
    6   HG11  VAL 790          HG13      VAL 790  24.758  -5.723 -10.342
    7   HG22  VAL 790          HG21      VAL 790  22.780  -8.501 -11.717
    8   HG21  VAL 790          HG22      VAL 790  23.083  -9.653 -10.414
    9   HG23  VAL 790          HG23      VAL 790  24.347  -9.285 -11.590

  No H/Q in entry =           9
  In of MODEL   38
    1    H    CYS 791           H        CYS 791  25.783 -10.011 -10.727
    2    HA   CYS 791           HA       CYS 791  28.594  -9.389 -10.355
    3    HB2  CYS 791           HB2      CYS 791  28.947 -11.499 -11.637
    4    HB3  CYS 791           HB3      CYS 791  28.054 -11.731 -10.139

  No H/Q in entry =           4
  In of MODEL   38
    1    H    ARG 792           H        ARG 792  29.829  -8.659 -12.001
    2    HA   ARG 792           HA       ARG 792  28.337  -7.775 -14.342
    3    HB2  ARG 792           HB2      ARG 792  30.531  -6.567 -12.754
    4    HB3  ARG 792           HB3      ARG 792  30.552  -6.296 -14.487
    5    HG2  ARG 792           HG2      ARG 792  28.255  -5.627 -12.642
    6    HG3  ARG 792           HG3      ARG 792  29.436  -4.472 -13.274
    7    HD2  ARG 792           HD2      ARG 792  28.754  -5.156 -15.581
    8    HD3  ARG 792           HD3      ARG 792  27.474  -6.124 -14.872
    9    HE   ARG 792           HE       ARG 792  27.115  -3.588 -13.884
   10   HH11  ARG 792          HH11      ARG 792  27.316  -5.082 -17.133
   11   HH12  ARG 792          HH12      ARG 792  26.243  -3.989 -17.854
   12   HH21  ARG 792          HH21      ARG 792  25.650  -2.111 -14.881
   13   HH22  ARG 792          HH22      ARG 792  25.250  -2.246 -16.540

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLU 793           H        GLU 793  29.809  -7.367 -16.176
    2    HA   GLU 793           HA       GLU 793  30.792  -9.900 -17.029
    3    HB2  GLU 793           HB2      GLU 793  30.871  -7.161 -18.346
    4    HB3  GLU 793           HB3      GLU 793  31.235  -8.679 -19.146
    5    HG2  GLU 793           HG2      GLU 793  29.015  -8.012 -19.809
    6    HG3  GLU 793           HG3      GLU 793  28.887  -9.394 -18.725

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ALA 794           H        ALA 794  33.137  -9.942 -18.030
    2    HA   ALA 794           HA       ALA 794  34.866  -9.428 -15.864
    3    HB3  ALA 794           HB1      ALA 794  36.630 -10.275 -17.303
    4    HB1  ALA 794           HB2      ALA 794  35.593 -10.110 -18.712
    5    HB2  ALA 794           HB3      ALA 794  35.191 -11.286 -17.457

  No H/Q in entry =           5
  In of MODEL   38
    1    H    SER 795           H        SER 795  34.283  -7.826 -18.900
    2    HA   SER 795           HA       SER 795  36.359  -5.956 -18.546
    3    HB2  SER 795           HB2      SER 795  33.979  -5.818 -20.398
    4    HB3  SER 795           HB3      SER 795  35.480  -4.903 -20.552
    5    HG   SER 795           HG       SER 795  35.111  -7.014 -21.747

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLU 796           H        GLU 796  33.490  -6.268 -16.923
    2    HA   GLU 796           HA       GLU 796  33.137  -3.383 -16.560
    3    HB2  GLU 796           HB2      GLU 796  31.169  -5.634 -16.298
    4    HB3  GLU 796           HB3      GLU 796  30.839  -3.997 -15.749
    5    HG2  GLU 796           HG2      GLU 796  31.399  -4.889 -18.569
    6    HG3  GLU 796           HG3      GLU 796  29.831  -4.432 -17.901

  No H/Q in entry =           6
  In of MODEL   38
    1    H    CYS 797           H        CYS 797  34.526  -5.974 -15.140
    2    HA   CYS 797           HA       CYS 797  33.653  -5.654 -12.453
    3    HB2  CYS 797           HB2      CYS 797  36.210  -6.810 -13.561
    4    HB3  CYS 797           HB3      CYS 797  35.678  -6.942 -11.887

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLU 798           H        GLU 798  34.769  -4.545 -10.747
    2    HA   GLU 798           HA       GLU 798  36.004  -2.170 -11.872
    3    HB2  GLU 798           HB2      GLU 798  33.924  -2.252 -10.280
    4    HB3  GLU 798           HB3      GLU 798  35.148  -2.350  -9.020
    5    HG2  GLU 798           HG2      GLU 798  34.444  -0.053  -9.388
    6    HG3  GLU 798           HG3      GLU 798  36.145  -0.270  -9.806

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU 799           H        GLU 799  37.326  -4.816 -11.214
    2    HA   GLU 799           HA       GLU 799  39.728  -3.710 -10.095
    3    HB2  GLU 799           HB2      GLU 799  38.468  -4.528  -8.089
    4    HB3  GLU 799           HB3      GLU 799  38.323  -6.082  -8.911
    5    HG2  GLU 799           HG2      GLU 799  40.047  -6.001  -7.098
    6    HG3  GLU 799           HG3      GLU 799  40.620  -6.549  -8.671

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLU 800           H        GLU 800  41.556  -5.075 -10.682
    2    HA   GLU 800           HA       GLU 800  41.141  -6.594 -13.036
    3    HB2  GLU 800           HB2      GLU 800  42.734  -4.875 -12.938
    4    HB3  GLU 800           HB3      GLU 800  43.307  -5.389 -11.370
    5    HG2  GLU 800           HG2      GLU 800  44.879  -5.836 -12.902
    6    HG3  GLU 800           HG3      GLU 800  44.165  -7.367 -12.385

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLY 801           H        GLY 801  42.213  -6.854  -9.646
    2    HA3  GLY 801           HA2      GLY 801  42.839  -8.475  -8.329
    3    HA2  GLY 801           HA3      GLY 801  41.852  -9.540  -9.310

  No H/Q in entry =           3
  In of MODEL   38
    1    H    PHE 802           H        PHE 802  43.472 -11.022  -8.815
    2    HA   PHE 802           HA       PHE 802  46.030 -10.749 -10.043
    3    HB2  PHE 802           HB2      PHE 802  44.690 -12.896  -8.462
    4    HB3  PHE 802           HB3      PHE 802  46.150 -13.269  -9.370
    5    HD1  PHE 802           HD1      PHE 802  47.513 -13.764  -7.505
    6    HD2  PHE 802           HD2      PHE 802  45.532 -10.011  -7.727
    7    HE1  PHE 802           HE1      PHE 802  48.904 -12.948  -5.733
    8    HE2  PHE 802           HE2      PHE 802  46.937  -9.162  -5.923
    9    HZ   PHE 802           HZ       PHE 802  48.645 -10.624  -4.901

  No H/Q in entry =           9
  In of MODEL   38
    1    H    SER 803           H        SER 803  46.731 -12.871 -11.295
    2    HA   SER 803           HA       SER 803  44.706 -13.442 -13.313
    3    HB2  SER 803           HB2      SER 803  47.715 -13.535 -13.652
    4    HB3  SER 803           HB3      SER 803  46.436 -13.577 -14.899
    5    HG   SER 803           HG       SER 803  45.902 -11.422 -13.942

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ILE 804           H        ILE 804  44.180 -15.587 -13.315
    2    HA   ILE 804           HA       ILE 804  46.017 -17.380 -11.927
    3    HB   ILE 804           HB       ILE 804  44.243 -18.506 -10.709
    4   HG12  ILE 804          HG12      ILE 804  42.396 -18.016 -12.357
    5   HG13  ILE 804          HG13      ILE 804  41.922 -17.859 -10.670
    6   HG23  ILE 804          HG21      ILE 804  43.622 -16.764  -9.085
    7   HG22  ILE 804          HG22      ILE 804  44.155 -15.543 -10.242
    8   HG21  ILE 804          HG23      ILE 804  45.322 -16.683  -9.566
    9   HD13  ILE 804          HD11      ILE 804  40.931 -16.117 -12.003
   10   HD12  ILE 804          HD12      ILE 804  42.505 -15.655 -12.637
   11   HD11  ILE 804          HD13      ILE 804  42.136 -15.402 -10.930

  No H/Q in entry =          11
  In of MODEL   38
    1    H    CYS 805           H        CYS 805  45.248 -19.711 -12.176
    2    HA   CYS 805           HA       CYS 805  44.770 -20.162 -15.025
    3    HB2  CYS 805           HB2      CYS 805  46.879 -21.037 -14.143
    4    HB3  CYS 805           HB3      CYS 805  45.995 -21.851 -12.856

  No H/Q in entry =           4
  In of MODEL   38
    1    H    VAL 806           H        VAL 806  42.699 -20.782 -15.439
    2    HA   VAL 806           HA       VAL 806  41.412 -22.450 -13.408
    3    HB   VAL 806           HB       VAL 806  40.167 -20.231 -15.011
    4   HG13  VAL 806          HG11      VAL 806  38.571 -22.032 -14.854
    5   HG12  VAL 806          HG12      VAL 806  38.117 -20.711 -13.755
    6   HG11  VAL 806          HG13      VAL 806  38.865 -22.175 -13.116
    7   HG23  VAL 806          HG21      VAL 806  40.494 -20.525 -12.038
    8   HG22  VAL 806          HG22      VAL 806  39.697 -19.184 -12.873
    9   HG21  VAL 806          HG23      VAL 806  41.422 -19.485 -13.110

  No H/Q in entry =           9
  In of MODEL   38
    1    H    GLU 807           H        GLU 807  40.539 -24.244 -14.106
    2    HA   GLU 807           HA       GLU 807  40.836 -24.963 -16.870
    3    HB2  GLU 807           HB2      GLU 807  41.427 -26.484 -14.999
    4    HB3  GLU 807           HB3      GLU 807  39.746 -26.493 -14.510
    5    HG2  GLU 807           HG2      GLU 807  39.145 -27.496 -16.664
    6    HG3  GLU 807           HG3      GLU 807  40.854 -27.536 -17.101

  No H/Q in entry =           6
  In of MODEL   38
    1    H    VAL 808           H        VAL 808  39.378 -24.473 -18.200
    2    HA   VAL 808           HA       VAL 808  36.577 -24.571 -17.482
    3    HB   VAL 808           HB       VAL 808  37.209 -22.219 -17.319
    4   HG13  VAL 808          HG11      VAL 808  39.206 -22.180 -18.679
    5   HG12  VAL 808          HG12      VAL 808  38.078 -20.940 -19.233
    6   HG11  VAL 808          HG13      VAL 808  38.247 -22.446 -20.133
    7   HG21  VAL 808          HG21      VAL 808  35.707 -22.762 -19.846
    8   HG23  VAL 808          HG22      VAL 808  35.727 -21.219 -18.982
    9   HG22  VAL 808          HG23      VAL 808  35.012 -22.654 -18.222

  No H/Q in entry =           9
  In of MODEL   38
    1    H    ASN 809           H        ASN 809  35.433 -25.616 -18.944
    2    HA   ASN 809           HA       ASN 809  34.837 -26.776 -20.774
    3    HB2  ASN 809           HB2      ASN 809  36.397 -24.566 -21.859
    4    HB3  ASN 809           HB3      ASN 809  36.142 -25.912 -22.987
    5   HD21  ASN 809          HD21      ASN 809  34.774 -23.197 -21.348
    6   HD22  ASN 809          HD22      ASN 809  33.199 -23.302 -22.022

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLY 810           H        GLY 810  37.393 -27.356 -19.254
    2    HA3  GLY 810           HA2      GLY 810  38.483 -29.439 -19.294
    3    HA2  GLY 810           HA3      GLY 810  38.225 -29.506 -21.045

  No H/Q in entry =           3
  In of MODEL   38
    1    H    LYS 811           H        LYS 811  39.213 -26.483 -20.596
    2    HA   LYS 811           HA       LYS 811  42.062 -27.207 -20.908
    3    HB2  LYS 811           HB2      LYS 811  40.505 -24.883 -22.002
    4    HB3  LYS 811           HB3      LYS 811  42.236 -25.120 -22.154
    5    HG2  LYS 811           HG2      LYS 811  41.919 -27.050 -23.523
    6    HG3  LYS 811           HG3      LYS 811  40.173 -27.012 -23.244
    7    HD2  LYS 811           HD2      LYS 811  40.787 -26.071 -25.423
    8    HD3  LYS 811           HD3      LYS 811  39.997 -24.898 -24.370
    9    HE2  LYS 811           HE2      LYS 811  42.174 -23.946 -23.768
   10    HE3  LYS 811           HE3      LYS 811  42.992 -25.111 -24.800
   11    HZ1  LYS 811           HZ1      LYS 811  41.069 -23.027 -25.675
   12    HZ3  LYS 811           HZ2      LYS 811  41.835 -24.083 -26.713
   13    HZ2  LYS 811           HZ3      LYS 811  42.729 -22.926 -25.867

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLU 812           H        GLU 812  43.566 -25.922 -19.819
    2    HA   GLU 812           HA       GLU 812  42.463 -24.279 -17.685
    3    HB2  GLU 812           HB2      GLU 812  45.330 -25.008 -18.303
    4    HB3  GLU 812           HB3      GLU 812  44.794 -24.109 -16.895
    5    HG2  GLU 812           HG2      GLU 812  43.475 -26.076 -16.201
    6    HG3  GLU 812           HG3      GLU 812  44.167 -26.978 -17.544

  No H/Q in entry =           6
  In of MODEL   38
    1    H    GLN 813           H        GLN 813  42.084 -22.238 -18.053
    2    HA   GLN 813           HA       GLN 813  43.814 -20.907 -19.996
    3    HB2  GLN 813           HB2      GLN 813  41.553 -21.169 -20.806
    4    HB3  GLN 813           HB3      GLN 813  40.908 -20.370 -19.371
    5    HG2  GLN 813           HG2      GLN 813  42.010 -18.384 -19.958
    6    HG3  GLN 813           HG3      GLN 813  42.741 -19.113 -21.398
    7   HE21  GLN 813          HE21      GLN 813  39.949 -17.601 -20.090
    8   HE22  GLN 813          HE22      GLN 813  38.963 -17.680 -21.497

  No H/Q in entry =           8
  In of MODEL   38
    1    H    THR 814           H        THR 814  44.590 -18.920 -19.474
    2    HA   THR 814           HA       THR 814  44.639 -18.255 -16.662
    3    HB   THR 814           HB       THR 814  45.769 -16.827 -19.001
    4    HG1  THR 814           HG1      THR 814  46.419 -19.157 -18.083
    5   HG21  THR 814          HG21      THR 814  46.485 -16.665 -16.069
    6   HG23  THR 814          HG22      THR 814  45.684 -15.421 -17.029
    7   HG22  THR 814          HG23      THR 814  47.366 -15.839 -17.357

  No H/Q in entry =           7
  In of MODEL   38
    1    H    MET 815           H        MET 815  43.247 -16.929 -15.872
    2    HA   MET 815           HA       MET 815  42.037 -14.938 -17.597
    3    HB2  MET 815           HB2      MET 815  39.880 -15.359 -16.331
    4    HB3  MET 815           HB3      MET 815  40.357 -16.561 -17.523
    5    HG2  MET 815           HG2      MET 815  41.299 -17.899 -15.768
    6    HG3  MET 815           HG3      MET 815  40.701 -16.769 -14.553
    7    HE1  MET 815           HE1      MET 815  39.787 -19.378 -17.236
    8    HE3  MET 815           HE2      MET 815  38.941 -17.973 -17.893
    9    HE2  MET 815           HE3      MET 815  38.023 -19.354 -17.276

  No H/Q in entry =           9
  In of MODEL   38
    1    H    SER 816           H        SER 816  41.033 -13.244 -16.347
    2    HA   SER 816           HA       SER 816  42.814 -12.443 -14.249
    3    HB2  SER 816           HB2      SER 816  40.356 -11.025 -15.272
    4    HB3  SER 816           HB3      SER 816  41.776 -10.336 -14.476
    5    HG   SER 816           HG       SER 816  42.706 -10.194 -16.327

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLU 817           H        GLU 817  42.073 -11.933 -12.216
    2    HA   GLU 817           HA       GLU 817  40.519 -13.849 -10.991
    3    HB2  GLU 817           HB2      GLU 817  42.354 -12.351 -10.154
    4    HB3  GLU 817           HB3      GLU 817  41.126 -11.120 -10.085
    5    HG2  GLU 817           HG2      GLU 817  39.988 -12.076  -8.355
    6    HG3  GLU 817           HG3      GLU 817  40.696 -13.666  -8.682

  No H/Q in entry =           6
  In of MODEL   38
    1    H    CYS 818           H        CYS 818  39.780 -10.548 -11.944
    2    HA   CYS 818           HA       CYS 818  37.222 -10.343 -10.880
    3    HB2  CYS 818           HB2      CYS 818  36.887  -8.657 -12.677
    4    HB3  CYS 818           HB3      CYS 818  38.351  -8.420 -11.727

  No H/Q in entry =           4
  In of MODEL   38
    1    H    GLU 819           H        GLU 819  38.301 -11.583 -13.997
    2    HA   GLU 819           HA       GLU 819  35.789 -12.129 -15.133
    3    HB2  GLU 819           HB2      GLU 819  37.814 -11.935 -16.460
    4    HB3  GLU 819           HB3      GLU 819  38.517 -13.307 -15.629
    5    HG2  GLU 819           HG2      GLU 819  36.984 -14.802 -16.667
    6    HG3  GLU 819           HG3      GLU 819  36.067 -13.460 -17.351

  No H/Q in entry =           6
  In of MODEL   38
    1    H    ALA 820           H        ALA 820  38.175 -14.258 -13.619
    2    HA   ALA 820           HA       ALA 820  36.702 -16.595 -13.680
    3    HB3  ALA 820           HB1      ALA 820  38.684 -15.772 -11.564
    4    HB1  ALA 820           HB2      ALA 820  39.069 -16.533 -13.111
    5    HB2  ALA 820           HB3      ALA 820  38.153 -17.422 -11.892

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLY 821           H        GLY 821  36.760 -14.076 -11.203
    2    HA3  GLY 821           HA2      GLY 821  35.065 -15.380  -9.354
    3    HA2  GLY 821           HA3      GLY 821  35.400 -13.655  -9.414

  No H/Q in entry =           3
  In of MODEL   38
    1    H    ALA 822           H        ALA 822  34.450 -13.084 -11.958
    2    HA   ALA 822           HA       ALA 822  31.717 -12.750 -11.492
    3    HB3  ALA 822           HB1      ALA 822  31.617 -11.929 -13.801
    4    HB1  ALA 822           HB2      ALA 822  33.216 -12.609 -14.112
    5    HB2  ALA 822           HB3      ALA 822  33.033 -11.287 -12.961

  No H/Q in entry =           5
  In of MODEL   38
    1    H    LEU 823           H        LEU 823  33.523 -15.044 -13.419
    2    HA   LEU 823           HA       LEU 823  31.363 -16.435 -14.510
    3    HB2  LEU 823           HB2      LEU 823  34.114 -17.453 -13.806
    4    HB3  LEU 823           HB3      LEU 823  32.969 -18.316 -14.816
    5    HG   LEU 823           HG       LEU 823  34.186 -15.626 -15.461
    6   HD13  LEU 823          HD11      LEU 823  35.424 -16.764 -17.188
    7   HD12  LEU 823          HD12      LEU 823  34.759 -18.318 -16.674
    8   HD11  LEU 823          HD13      LEU 823  35.826 -17.403 -15.597
    9   HD21  LEU 823          HD21      LEU 823  32.341 -17.401 -17.061
   10   HD23  LEU 823          HD22      LEU 823  33.195 -15.988 -17.694
   11   HD22  LEU 823          HD23      LEU 823  31.992 -15.791 -16.427

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ARG 824           H        ARG 824  33.118 -16.990 -11.450
    2    HA   ARG 824           HA       ARG 824  31.661 -19.231 -10.575
    3    HB2  ARG 824           HB2      ARG 824  32.945 -17.022  -8.937
    4    HB3  ARG 824           HB3      ARG 824  32.401 -18.566  -8.299
    5    HG2  ARG 824           HG2      ARG 824  34.077 -19.730  -9.582
    6    HG3  ARG 824           HG3      ARG 824  34.580 -18.222 -10.358
    7    HD2  ARG 824           HD2      ARG 824  36.106 -18.872  -8.589
    8    HD3  ARG 824           HD3      ARG 824  35.275 -17.371  -8.176
    9    HE   ARG 824           HE       ARG 824  33.838 -19.538  -7.195
   10   HH11  ARG 824          HH11      ARG 824  36.924 -17.926  -6.500
   11   HH12  ARG 824          HH12      ARG 824  36.954 -18.342  -4.840
   12   HH21  ARG 824          HH21      ARG 824  33.871 -20.091  -4.916
   13   HH22  ARG 824          HH22      ARG 824  35.160 -19.586  -3.913

  No H/Q in entry =          13
  In of MODEL   38
    1    H    CYS 825           H        CYS 825  31.109 -15.792 -10.205
    2    HA   CYS 825           HA       CYS 825  28.890 -16.051  -8.462
    3    HB2  CYS 825           HB2      CYS 825  30.407 -14.095  -8.547
    4    HB3  CYS 825           HB3      CYS 825  29.729 -13.675 -10.111

  No H/Q in entry =           4
  In of MODEL   38
    1    H    ARG 826           H        ARG 826  29.154 -15.746 -11.982
    2    HA   ARG 826           HA       ARG 826  26.332 -15.324 -12.270
    3    HB2  ARG 826           HB2      ARG 826  26.689 -15.611 -14.688
    4    HB3  ARG 826           HB3      ARG 826  27.737 -14.375 -13.981
    5    HG2  ARG 826           HG2      ARG 826  29.573 -15.916 -14.063
    6    HG3  ARG 826           HG3      ARG 826  28.521 -17.189 -14.693
    7    HD2  ARG 826           HD2      ARG 826  29.092 -14.551 -16.041
    8    HD3  ARG 826           HD3      ARG 826  29.807 -16.103 -16.476
    9    HE   ARG 826           HE       ARG 826  27.579 -16.877 -17.004
   10   HH11  ARG 826          HH11      ARG 826  28.091 -13.360 -16.926
   11   HH12  ARG 826          HH12      ARG 826  26.809 -13.011 -17.984
   12   HH21  ARG 826          HH21      ARG 826  25.808 -16.382 -18.476
   13   HH22  ARG 826          HH22      ARG 826  25.488 -14.777 -18.906

  No H/Q in entry =          13
  In of MODEL   38
    1    H    GLY 827           H        GLY 827  28.369 -18.147 -12.264
    2    HA3  GLY 827           HA2      GLY 827  27.077 -20.184 -11.637
    3    HA2  GLY 827           HA3      GLY 827  25.936 -19.693 -12.884

  No H/Q in entry =           3
  In of MODEL   38
    1    H    GLN 828           H        GLN 828  28.938 -18.972 -13.998
    2    HA   GLN 828           HA       GLN 828  28.987 -21.071 -15.911
    3    HB2  GLN 828           HB2      GLN 828  29.980 -18.832 -16.309
    4    HB3  GLN 828           HB3      GLN 828  31.176 -19.161 -15.069
    5    HG2  GLN 828           HG2      GLN 828  32.185 -19.488 -17.237
    6    HG3  GLN 828           HG3      GLN 828  32.029 -21.039 -16.428
    7   HE21  GLN 828          HE21      GLN 828  29.400 -19.320 -18.034
    8   HE22  GLN 828          HE22      GLN 828  29.182 -20.467 -19.280

  No H/Q in entry =           8
  In of MODEL   38
    1    H    SER 829           H        SER 829  30.181 -23.005 -15.863
    2    HA   SER 829           HA       SER 829  31.191 -23.824 -13.276
    3    HB2  SER 829           HB2      SER 829  31.079 -25.359 -15.891
    4    HB3  SER 829           HB3      SER 829  31.447 -26.039 -14.307
    5    HG   SER 829           HG       SER 829  29.227 -24.999 -13.816

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ILE 830           H        ILE 830  33.194 -23.240 -12.730
    2    HA   ILE 830           HA       ILE 830  35.317 -23.634 -14.674
    3    HB   ILE 830           HB       ILE 830  36.454 -21.584 -14.121
    4   HG12  ILE 830          HG12      ILE 830  35.543 -21.300 -11.803
    5   HG13  ILE 830          HG13      ILE 830  35.595 -19.786 -12.684
    6   HG22  ILE 830          HG21      ILE 830  35.010 -19.906 -15.192
    7   HG21  ILE 830          HG22      ILE 830  33.666 -21.045 -15.038
    8   HG23  ILE 830          HG23      ILE 830  35.057 -21.458 -16.038
    9   HD11  ILE 830          HD11      ILE 830  33.158 -20.099 -13.146
   10   HD13  ILE 830          HD12      ILE 830  33.564 -19.891 -11.452
   11   HD12  ILE 830          HD13      ILE 830  33.191 -21.498 -12.074

  No H/Q in entry =          11
  In of MODEL   38
    1    H    SER 831           H        SER 831  37.200 -24.356 -13.797
    2    HA   SER 831           HA       SER 831  37.091 -24.781 -10.919
    3    HB2  SER 831           HB2      SER 831  38.193 -26.479 -13.121
    4    HB3  SER 831           HB3      SER 831  38.440 -26.802 -11.408
    5    HG   SER 831           HG       SER 831  35.955 -26.607 -12.783

  No H/Q in entry =           5
  In of MODEL   38
    1    H    VAL 832           H        VAL 832  38.445 -23.244 -10.092
    2    HA   VAL 832           HA       VAL 832  40.816 -22.457 -11.426
    3    HB   VAL 832           HB       VAL 832  39.786 -20.859  -9.913
    4   HG13  VAL 832          HG11      VAL 832  39.747 -21.136  -7.473
    5   HG12  VAL 832          HG12      VAL 832  40.347 -22.782  -7.661
    6   HG11  VAL 832          HG13      VAL 832  38.759 -22.345  -8.294
    7   HG22  VAL 832          HG21      VAL 832  42.184 -20.635 -10.171
    8   HG21  VAL 832          HG22      VAL 832  42.460 -21.750  -8.836
    9   HG23  VAL 832          HG23      VAL 832  41.717 -20.180  -8.532

  No H/Q in entry =           9
  In of MODEL   38
    1    H    THR 833           H        THR 833  42.490 -23.665 -11.748
    2    HA   THR 833           HA       THR 833  42.929 -25.911  -9.983
    3    HB   THR 833           HB       THR 833  44.647 -26.516 -11.763
    4    HG1  THR 833           HG1      THR 833  44.563 -25.378 -13.667
    5   HG21  THR 833          HG21      THR 833  41.754 -26.192 -12.550
    6   HG23  THR 833          HG22      THR 833  42.448 -27.563 -11.677
    7   HG22  THR 833          HG23      THR 833  42.909 -27.250 -13.354

  No H/Q in entry =           7
  In of MODEL   38
    1    H    SER 834           H        SER 834  44.400 -22.903 -10.881
    2    HA   SER 834           HA       SER 834  46.260 -23.239  -8.682
    3    HB2  SER 834           HB2      SER 834  47.183 -22.403 -11.451
    4    HB3  SER 834           HB3      SER 834  48.171 -22.526 -10.008
    5    HG   SER 834           HG       SER 834  47.138 -24.812 -10.098

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ILE 835           H        ILE 835  46.680 -21.343  -7.654
    2    HA   ILE 835           HA       ILE 835  45.095 -19.023  -8.353
    3    HB   ILE 835           HB       ILE 835  46.042 -18.009  -6.326
    4   HG12  ILE 835          HG12      ILE 835  47.817 -20.466  -6.233
    5   HG13  ILE 835          HG13      ILE 835  48.310 -18.815  -6.594
    6   HG22  ILE 835          HG21      ILE 835  45.256 -19.657  -4.664
    7   HG21  ILE 835          HG22      ILE 835  45.274 -20.904  -5.911
    8   HG23  ILE 835          HG23      ILE 835  44.160 -19.543  -6.045
    9   HD11  ILE 835          HD11      ILE 835  47.709 -18.142  -4.390
   10   HD13  ILE 835          HD12      ILE 835  48.929 -19.426  -4.439
   11   HD12  ILE 835          HD13      ILE 835  47.249 -19.813  -4.008

  No H/Q in entry =          11
  In of MODEL   38
    1    H    ARG 836           H        ARG 836  47.838 -20.257  -9.400
    2    HA   ARG 836           HA       ARG 836  49.275 -17.776 -10.005
    3    HB2  ARG 836           HB2      ARG 836  49.960 -20.659 -10.588
    4    HB3  ARG 836           HB3      ARG 836  50.999 -19.270 -10.859
    5    HG2  ARG 836           HG2      ARG 836  51.123 -18.864  -8.506
    6    HG3  ARG 836           HG3      ARG 836  50.026 -20.215  -8.173
    7    HD2  ARG 836           HD2      ARG 836  51.595 -21.690  -9.269
    8    HD3  ARG 836           HD3      ARG 836  52.726 -20.343  -9.480
    9    HE   ARG 836           HE       ARG 836  51.802 -21.201  -6.841
   10   HH11  ARG 836          HH11      ARG 836  54.490 -20.493  -9.051
   11   HH12  ARG 836          HH12      ARG 836  55.704 -20.778  -7.897
   12   HH21  ARG 836          HH21      ARG 836  53.469 -21.660  -5.272
   13   HH22  ARG 836          HH22      ARG 836  55.112 -21.472  -5.683

  No H/Q in entry =          13
  In of MODEL   38
    1    HA   PRO 837           HA       PRO 837  47.419 -18.072 -14.088
    2    HB2  PRO 837           HB2      PRO 837  49.269 -16.741 -15.572
    3    HB3  PRO 837           HB3      PRO 837  48.149 -15.904 -14.493
    4    HG2  PRO 837           HG2      PRO 837  51.006 -16.637 -14.062
    5    HG3  PRO 837           HG3      PRO 837  50.152 -15.144 -13.631
    6    HD2  PRO 837           HD2      PRO 837  50.706 -17.116 -11.838
    7    HD3  PRO 837           HD3      PRO 837  49.297 -16.047 -11.699

  No H/Q in entry =           7
  In of MODEL   38
    1    H    CYS 838           H        CYS 838  47.898 -19.062 -16.229
    2    HA   CYS 838           HA       CYS 838  50.071 -20.998 -15.965
    3    HB2  CYS 838           HB2      CYS 838  48.655 -22.300 -17.704
    4    HB3  CYS 838           HB3      CYS 838  48.078 -22.291 -16.042

  No H/Q in entry =           4
  In of MODEL   38
    1    H    ALA 839           H        ALA 839  50.506 -21.860 -18.449
    2    HA   ALA 839           HA       ALA 839  51.584 -19.521 -19.785
    3    HB3  ALA 839           HB1      ALA 839  52.712 -21.185 -21.209
    4    HB1  ALA 839           HB2      ALA 839  51.797 -22.470 -20.427
    5    HB2  ALA 839           HB3      ALA 839  52.963 -21.527 -19.496

  No H/Q in entry =           5
  In of MODEL   38
    1    H    ALA 840           H        ALA 840  48.701 -20.135 -19.674
    2    HA   ALA 840           HA       ALA 840  47.978 -20.851 -22.405
    3    HB1  ALA 840           HB1      ALA 840  45.711 -21.020 -21.498
    4    HB2  ALA 840           HB2      ALA 840  46.314 -20.458 -19.931
    5    HB3  ALA 840           HB3      ALA 840  46.859 -21.989 -20.575

  No H/Q in entry =           5
  In of MODEL   38
    1    H    GLU 841           H        GLU 841  49.213 -18.245 -21.726
    2    HA   GLU 841           HA       GLU 841  47.020 -16.407 -22.195
    3    HB2  GLU 841           HB2      GLU 841  49.999 -15.837 -21.949
    4    HB3  GLU 841           HB3      GLU 841  48.749 -14.620 -22.122
    5    HG2  GLU 841           HG2      GLU 841  47.776 -15.337 -19.973
    6    HG3  GLU 841           HG3      GLU 841  49.079 -16.509 -19.798

  No H/Q in entry =           6
  In of MODEL   38
    1    H    THR 842           H        THR 842  48.850 -18.461 -23.949
    2    HA   THR 842           HA       THR 842  48.384 -16.981 -26.412
    3    HB   THR 842           HB       THR 842  50.127 -18.633 -27.343
    4    HG1  THR 842           HG1      THR 842  51.537 -18.991 -25.139
    5   HG23  THR 842          HG21      THR 842  50.661 -16.265 -26.956
    6   HG22  THR 842          HG22      THR 842  52.044 -17.287 -26.560
    7   HG21  THR 842          HG23      THR 842  51.039 -16.623 -25.273

  No H/Q in entry =           7
  In of MODEL   38
    1    H    GLN 843           H        GLN 843  46.931 -17.934 -27.784
    2    HA   GLN 843           HA       GLN 843  46.106 -20.691 -27.175
    3    HB2  GLN 843           HB2      GLN 843  44.401 -18.386 -28.158
    4    HB3  GLN 843           HB3      GLN 843  43.853 -20.051 -28.070
    5    HG2  GLN 843           HG2      GLN 843  44.717 -18.378 -25.716
    6    HG3  GLN 843           HG3      GLN 843  43.051 -18.669 -26.197
    7   HE21  GLN 843          HE21      GLN 843  44.354 -19.283 -23.725
    8   HE22  GLN 843          HE22      GLN 843  44.220 -20.988 -23.476

  No H/Q in entry =           8
  In of MODEL   39
    1    H1   GLY 689           H2       GLY 689  79.038  -7.477 -25.586
    2    H2   GLY 689           H1       GLY 689  78.744  -5.838 -25.948
    3    H3   GLY 689           H3       GLY 689  80.308  -6.396 -25.682
    4    HA2  GLY 689           HA2      GLY 689  78.192  -6.211 -23.656
    5    HA3  GLY 689           HA3      GLY 689  79.662  -5.254 -23.755

  No H/Q in entry =           5
  In of MODEL   39
    1    H    SER 690           H        SER 690  80.243  -5.997 -21.666
    2    HA   SER 690           HA       SER 690  81.267  -8.732 -21.710
    3    HB2  SER 690           HB2      SER 690  82.326  -6.323 -20.204
    4    HB3  SER 690           HB3      SER 690  83.073  -7.922 -20.284
    5    HG   SER 690           HG       SER 690  83.264  -7.623 -22.554

  No H/Q in entry =           5
  In of MODEL   39
    1    H    HIS 691           H        HIS 691  80.705 -10.021 -20.008
    2    HA   HIS 691           HA       HIS 691  78.313  -9.228 -18.701
    3    HB2  HIS 691           HB2      HIS 691  78.117 -11.488 -17.829
    4    HB3  HIS 691           HB3      HIS 691  78.543 -11.512 -19.522
    5    HD1  HIS 691           HD1      HIS 691  79.820 -13.635 -19.783
    6    HD2  HIS 691           HD2      HIS 691  81.027 -11.522 -16.433
    7    HE1  HIS 691           HE1      HIS 691  81.713 -14.958 -18.792
    8    HE2  HIS 691           HE2      HIS 691  82.259 -13.758 -16.644

  No H/Q in entry =           8
  In of MODEL   39
    1    H    MET 692           H        MET 692  81.290  -8.482 -17.813
    2    HA   MET 692           HA       MET 692  81.350  -8.844 -15.032
    3    HB2  MET 692           HB2      MET 692  82.928  -6.948 -14.962
    4    HB3  MET 692           HB3      MET 692  83.342  -8.075 -16.241
    5    HG2  MET 692           HG2      MET 692  82.255  -6.559 -17.872
    6    HG3  MET 692           HG3      MET 692  81.950  -5.421 -16.567
    7    HE1  MET 692           HE1      MET 692  84.622  -5.620 -14.838
    8    HE3  MET 692           HE2      MET 692  83.877  -4.084 -15.277
    9    HE2  MET 692           HE3      MET 692  85.597  -4.345 -15.566

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ASN 693           H        ASN 693  79.567  -6.618 -17.018
    2    HA   ASN 693           HA       ASN 693  78.150  -5.723 -14.635
    3    HB2  ASN 693           HB2      ASN 693  79.701  -3.892 -15.156
    4    HB3  ASN 693           HB3      ASN 693  79.178  -3.907 -16.837
    5   HD21  ASN 693          HD21      ASN 693  77.216  -2.976 -17.370
    6   HD22  ASN 693          HD22      ASN 693  76.297  -2.004 -16.270

  No H/Q in entry =           6
  In of MODEL   39
    1    HA   PRO 694           HA       PRO 694  75.043  -6.866 -17.648
    2    HB2  PRO 694           HB2      PRO 694  72.906  -6.815 -15.988
    3    HB3  PRO 694           HB3      PRO 694  74.061  -8.150 -16.002
    4    HG2  PRO 694           HG2      PRO 694  73.789  -5.906 -14.063
    5    HG3  PRO 694           HG3      PRO 694  74.278  -7.586 -13.786
    6    HD2  PRO 694           HD2      PRO 694  76.013  -5.418 -13.970
    7    HD3  PRO 694           HD3      PRO 694  76.468  -7.120 -14.174

  No H/Q in entry =           7
  In of MODEL   39
    1    H    LEU 695           H        LEU 695  74.966  -5.106 -18.966
    2    HA   LEU 695           HA       LEU 695  73.691  -2.671 -18.005
    3    HB2  LEU 695           HB2      LEU 695  75.846  -2.695 -19.387
    4    HB3  LEU 695           HB3      LEU 695  74.889  -3.247 -20.734
    5    HG   LEU 695           HG       LEU 695  75.464  -0.848 -20.869
    6   HD12  LEU 695          HD11      LEU 695  73.267   0.075 -21.372
    7   HD11  LEU 695          HD12      LEU 695  72.510  -1.296 -20.562
    8   HD13  LEU 695          HD13      LEU 695  73.464  -1.554 -22.021
    9   HD23  LEU 695          HD21      LEU 695  73.770  -0.548 -18.393
   10   HD22  LEU 695          HD22      LEU 695  74.424   0.774 -19.361
   11   HD21  LEU 695          HD23      LEU 695  75.517  -0.316 -18.508

  No H/Q in entry =          11
  In of MODEL   39
    1    H    THR 696           H        THR 696  71.544  -2.441 -18.277
    2    HA   THR 696           HA       THR 696  70.331  -3.255 -20.713
    3    HB   THR 696           HB       THR 696  70.150  -5.362 -19.421
    4    HG1  THR 696           HG1      THR 696  68.017  -5.666 -19.705
    5   HG21  THR 696          HG21      THR 696  68.683  -3.698 -17.362
    6   HG23  THR 696          HG22      THR 696  70.239  -4.498 -17.145
    7   HG22  THR 696          HG23      THR 696  68.776  -5.459 -17.360

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLN 697           H        GLN 697  68.380  -2.166 -21.018
    2    HA   GLN 697           HA       GLN 697  67.908  -0.022 -19.066
    3    HB2  GLN 697           HB2      GLN 697  67.499  -0.025 -22.061
    4    HB3  GLN 697           HB3      GLN 697  67.038   1.287 -20.988
    5    HG2  GLN 697           HG2      GLN 697  69.833   0.284 -21.440
    6    HG3  GLN 697           HG3      GLN 697  69.134   1.736 -22.145
    7   HE21  GLN 697          HE21      GLN 697  71.455   1.555 -20.521
    8   HE22  GLN 697          HE22      GLN 697  71.201   2.465 -19.084

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ALA 698           H        ALA 698  66.825  -2.841 -19.632
    2    HA   ALA 698           HA       ALA 698  64.094  -2.480 -20.333
    3    HB3  ALA 698           HB1      ALA 698  63.825  -4.807 -19.646
    4    HB2  ALA 698           HB2      ALA 698  65.419  -4.778 -18.895
    5    HB1  ALA 698           HB3      ALA 698  65.270  -4.623 -20.645

  No H/Q in entry =           5
  In of MODEL   39
    1    H    VAL 699           H        VAL 699  62.417  -1.986 -19.059
    2    HA   VAL 699           HA       VAL 699  62.789  -1.131 -16.376
    3    HB   VAL 699           HB       VAL 699  60.222  -1.754 -17.895
    4   HG13  VAL 699          HG11      VAL 699  59.100  -0.294 -16.278
    5   HG12  VAL 699          HG12      VAL 699  60.614  -0.113 -15.393
    6   HG11  VAL 699          HG13      VAL 699  59.832  -1.692 -15.486
    7   HG23  VAL 699          HG21      VAL 699  61.606   0.883 -17.475
    8   HG22  VAL 699          HG22      VAL 699  60.079   0.640 -18.323
    9   HG21  VAL 699          HG23      VAL 699  61.575  -0.023 -18.983

  No H/Q in entry =           9
  In of MODEL   39
    1    HA   PRO 700           HA       PRO 700  62.138  -5.225 -14.709
    2    HB2  PRO 700           HB2      PRO 700  62.211  -4.633 -12.070
    3    HB3  PRO 700           HB3      PRO 700  63.664  -4.720 -13.068
    4    HG2  PRO 700           HG2      PRO 700  62.220  -2.347 -12.037
    5    HG3  PRO 700           HG3      PRO 700  63.946  -2.541 -12.383
    6    HD2  PRO 700           HD2      PRO 700  62.060  -1.241 -14.007
    7    HD3  PRO 700           HD3      PRO 700  63.684  -1.756 -14.498

  No H/Q in entry =           7
  In of MODEL   39
    1    H    LYS 701           H        LYS 701  60.538  -6.395 -14.352
    2    HA   LYS 701           HA       LYS 701  58.054  -5.085 -13.622
    3    HB2  LYS 701           HB2      LYS 701  58.498  -7.579 -15.261
    4    HB3  LYS 701           HB3      LYS 701  56.933  -7.112 -14.634
    5    HG2  LYS 701           HG2      LYS 701  56.942  -6.324 -16.879
    6    HG3  LYS 701           HG3      LYS 701  57.251  -4.930 -15.827
    7    HD2  LYS 701           HD2      LYS 701  58.642  -4.854 -17.795
    8    HD3  LYS 701           HD3      LYS 701  59.592  -5.019 -16.322
    9    HE2  LYS 701           HE2      LYS 701  59.835  -7.420 -16.761
   10    HE3  LYS 701           HE3      LYS 701  58.907  -7.240 -18.248
   11    HZ1  LYS 701           HZ1      LYS 701  61.417  -5.781 -17.686
   12    HZ3  LYS 701           HZ2      LYS 701  60.583  -5.857 -19.153
   13    HZ2  LYS 701           HZ3      LYS 701  61.341  -7.231 -18.553

  No H/Q in entry =          13
  In of MODEL   39
    1    H    CYS 702           H        CYS 702  56.931  -5.720 -11.977
    2    HA   CYS 702           HA       CYS 702  58.129  -7.764 -10.273
    3    HB2  CYS 702           HB2      CYS 702  56.115  -5.609  -9.577
    4    HB3  CYS 702           HB3      CYS 702  56.994  -6.647  -8.468

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLN 703           H        GLN 703  56.690  -9.333  -9.332
    2    HA   GLN 703           HA       GLN 703  54.619 -10.102 -11.158
    3    HB2  GLN 703           HB2      GLN 703  55.371 -11.283  -8.485
    4    HB3  GLN 703           HB3      GLN 703  54.385 -12.053  -9.717
    5    HG2  GLN 703           HG2      GLN 703  57.295 -11.317 -10.008
    6    HG3  GLN 703           HG3      GLN 703  56.675 -12.923  -9.657
    7   HE21  GLN 703          HE21      GLN 703  54.453 -12.765 -11.516
    8   HE22  GLN 703          HE22      GLN 703  55.156 -12.853 -13.077

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ARG 704           H        ARG 704  52.513 -10.934 -10.010
    2    HA   ARG 704           HA       ARG 704  50.890  -8.762  -9.471
    3    HB2  ARG 704           HB2      ARG 704  50.491 -11.612  -8.637
    4    HB3  ARG 704           HB3      ARG 704  49.245 -10.382  -8.596
    5    HG2  ARG 704           HG2      ARG 704  50.667 -11.370 -11.058
    6    HG3  ARG 704           HG3      ARG 704  49.070 -11.859 -10.492
    7    HD2  ARG 704           HD2      ARG 704  48.332  -9.511 -10.685
    8    HD3  ARG 704           HD3      ARG 704  49.904  -9.119 -11.383
    9    HE   ARG 704           HE       ARG 704  48.176 -11.138 -12.623
   10   HH11  ARG 704          HH11      ARG 704  50.061  -8.131 -12.967
   11   HH12  ARG 704          HH12      ARG 704  49.803  -8.060 -14.643
   12   HH21  ARG 704          HH21      ARG 704  47.856 -10.983 -14.864
   13   HH22  ARG 704          HH22      ARG 704  48.507  -9.668 -15.745

  No H/Q in entry =          13
  In of MODEL   39
    1    H    TRP 705           H        TRP 705  52.702 -10.674  -7.206
    2    HA   TRP 705           HA       TRP 705  51.366  -9.512  -4.889
    3    HB2  TRP 705           HB2      TRP 705  52.694 -11.257  -3.666
    4    HB3  TRP 705           HB3      TRP 705  51.514 -11.867  -4.823
    5    HD1  TRP 705           HD1      TRP 705  55.245 -11.742  -4.125
    6    HE1  TRP 705           HE1      TRP 705  56.465 -13.316  -5.750
    7    HE3  TRP 705           HE3      TRP 705  51.369 -12.865  -7.248
    8    HZ2  TRP 705           HZ2      TRP 705  55.868 -14.829  -8.047
    9    HZ3  TRP 705           HZ3      TRP 705  51.781 -14.376  -9.145
   10    HH2  TRP 705           HH2      TRP 705  53.984 -15.341  -9.529

  No H/Q in entry =          10
  In of MODEL   39
    1    H    GLU 706           H        GLU 706  53.643  -8.412  -6.806
    2    HA   GLU 706           HA       GLU 706  55.402  -7.537  -4.630
    3    HB2  GLU 706           HB2      GLU 706  56.098  -8.102  -7.504
    4    HB3  GLU 706           HB3      GLU 706  57.188  -7.344  -6.336
    5    HG2  GLU 706           HG2      GLU 706  57.125  -9.414  -5.030
    6    HG3  GLU 706           HG3      GLU 706  56.085 -10.137  -6.260

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LYS 707           H        LYS 707  56.558  -5.519  -5.290
    2    HA   LYS 707           HA       LYS 707  55.067  -3.790  -7.065
    3    HB2  LYS 707           HB2      LYS 707  55.051  -1.950  -5.412
    4    HB3  LYS 707           HB3      LYS 707  54.013  -3.285  -4.941
    5    HG2  LYS 707           HG2      LYS 707  55.620  -4.037  -3.316
    6    HG3  LYS 707           HG3      LYS 707  56.796  -2.844  -3.868
    7    HD2  LYS 707           HD2      LYS 707  54.116  -2.196  -2.620
    8    HD3  LYS 707           HD3      LYS 707  55.665  -2.169  -1.774
    9    HE2  LYS 707           HE2      LYS 707  56.468  -0.441  -3.344
   10    HE3  LYS 707           HE3      LYS 707  54.895  -0.443  -4.138
   11    HZ3  LYS 707           HZ1      LYS 707  55.078   1.369  -2.604
   12    HZ2  LYS 707           HZ2      LYS 707  55.451   0.337  -1.338
   13    HZ1  LYS 707           HZ3      LYS 707  53.911   0.287  -2.016

  No H/Q in entry =          13
  In of MODEL   39
    1    H    LEU 708           H        LEU 708  56.286  -1.933  -7.711
    2    HA   LEU 708           HA       LEU 708  59.131  -2.536  -7.775
    3    HB2  LEU 708           HB2      LEU 708  58.000  -2.327  -9.903
    4    HB3  LEU 708           HB3      LEU 708  57.383  -0.749  -9.467
    5    HG   LEU 708           HG       LEU 708  59.712   0.124  -9.491
    6   HD13  LEU 708          HD11      LEU 708  61.471  -1.186 -10.504
    7   HD12  LEU 708          HD12      LEU 708  60.402  -2.591 -10.595
    8   HD11  LEU 708          HD13      LEU 708  60.895  -1.951  -9.026
    9   HD23  LEU 708          HD21      LEU 708  59.957   0.107 -11.929
   10   HD22  LEU 708          HD22      LEU 708  58.284   0.370 -11.441
   11   HD21  LEU 708          HD23      LEU 708  58.792  -1.214 -12.030

  No H/Q in entry =          11
  In of MODEL   39
    1    H    GLN 709           H        GLN 709  60.368  -1.487  -6.350
    2    HA   GLN 709           HA       GLN 709  60.149   1.386  -6.146
    3    HB2  GLN 709           HB2      GLN 709  60.026   1.491  -3.761
    4    HB3  GLN 709           HB3      GLN 709  58.761   0.373  -4.234
    5    HG2  GLN 709           HG2      GLN 709  60.219  -1.510  -3.682
    6    HG3  GLN 709           HG3      GLN 709  61.473  -0.383  -3.194
    7   HE21  GLN 709          HE21      GLN 709  61.554  -1.071  -1.133
    8   HE22  GLN 709          HE22      GLN 709  60.295  -0.819   0.022

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ASN 710           H        ASN 710  62.180   2.274  -5.577
    2    HA   ASN 710           HA       ASN 710  64.469   2.399  -5.391
    3    HB2  ASN 710           HB2      ASN 710  63.806   0.945  -3.341
    4    HB3  ASN 710           HB3      ASN 710  64.362  -0.425  -4.268
    5   HD21  ASN 710          HD21      ASN 710  65.313   0.546  -1.750
    6   HD22  ASN 710          HD22      ASN 710  66.994   0.904  -1.935

  No H/Q in entry =           6
  In of MODEL   39
    1    H    SER 711           H        SER 711  63.073   1.177  -7.684
    2    HA   SER 711           HA       SER 711  63.419   0.313  -9.703
    3    HB2  SER 711           HB2      SER 711  65.426   1.781  -9.722
    4    HB3  SER 711           HB3      SER 711  66.374   0.473  -9.023
    5    HG   SER 711           HG       SER 711  65.612  -0.762 -10.895

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ARG 712           H        ARG 712  63.272  -1.461  -7.256
    2    HA   ARG 712           HA       ARG 712  64.101  -3.890  -8.654
    3    HB2  ARG 712           HB2      ARG 712  64.691  -4.931  -6.502
    4    HB3  ARG 712           HB3      ARG 712  65.731  -3.555  -6.866
    5    HG2  ARG 712           HG2      ARG 712  64.540  -2.196  -5.317
    6    HG3  ARG 712           HG3      ARG 712  63.344  -3.460  -5.033
    7    HD2  ARG 712           HD2      ARG 712  66.290  -3.706  -4.502
    8    HD3  ARG 712           HD3      ARG 712  65.102  -3.281  -3.256
    9    HE   ARG 712           HE       ARG 712  64.267  -5.651  -4.367
   10   HH11  ARG 712          HH11      ARG 712  67.198  -4.551  -2.711
   11   HH12  ARG 712          HH12      ARG 712  67.564  -6.050  -2.006
   12   HH21  ARG 712          HH21      ARG 712  64.772  -7.785  -3.370
   13   HH22  ARG 712          HH22      ARG 712  66.159  -7.911  -2.400

  No H/Q in entry =          13
  In of MODEL   39
    1    H    CYS 713           H        CYS 713  63.080  -5.772  -7.333
    2    HA   CYS 713           HA       CYS 713  60.222  -5.160  -7.200
    3    HB2  CYS 713           HB2      CYS 713  61.601  -7.853  -7.410
    4    HB3  CYS 713           HB3      CYS 713  59.885  -7.529  -7.589

  No H/Q in entry =           4
  In of MODEL   39
    1    H    VAL 714           H        VAL 714  59.315  -5.200  -5.222
    2    HA   VAL 714           HA       VAL 714  60.569  -6.889  -3.203
    3    HB   VAL 714           HB       VAL 714  59.938  -5.289  -1.421
    4   HG13  VAL 714          HG11      VAL 714  62.199  -5.160  -2.257
    5   HG12  VAL 714          HG12      VAL 714  61.623  -3.544  -1.841
    6   HG11  VAL 714          HG13      VAL 714  61.696  -4.051  -3.529
    7   HG22  VAL 714          HG21      VAL 714  58.072  -4.188  -2.514
    8   HG21  VAL 714          HG22      VAL 714  59.169  -3.462  -3.688
    9   HG23  VAL 714          HG23      VAL 714  59.260  -2.991  -1.991

  No H/Q in entry =           9
  In of MODEL   39
    1    H    CYS 715           H        CYS 715  58.943  -7.477  -1.483
    2    HA   CYS 715           HA       CYS 715  56.610  -8.330  -2.979
    3    HB2  CYS 715           HB2      CYS 715  57.531  -9.126  -0.201
    4    HB3  CYS 715           HB3      CYS 715  56.296  -9.924  -1.160

  No H/Q in entry =           4
  In of MODEL   39
    1    H    LYS 716           H        LYS 716  54.509  -7.904  -2.363
    2    HA   LYS 716           HA       LYS 716  54.153  -5.584  -0.713
    3    HB2  LYS 716           HB2      LYS 716  52.174  -7.322  -2.199
    4    HB3  LYS 716           HB3      LYS 716  51.691  -5.930  -1.237
    5    HG2  LYS 716           HG2      LYS 716  53.121  -4.498  -2.665
    6    HG3  LYS 716           HG3      LYS 716  53.485  -5.903  -3.658
    7    HD2  LYS 716           HD2      LYS 716  50.718  -4.777  -3.203
    8    HD3  LYS 716           HD3      LYS 716  51.723  -4.439  -4.609
    9    HE2  LYS 716           HE2      LYS 716  51.743  -6.870  -5.107
   10    HE3  LYS 716           HE3      LYS 716  50.643  -7.115  -3.753
   11    HZ1  LYS 716           HZ1      LYS 716  50.035  -5.383  -6.082
   12    HZ3  LYS 716           HZ2      LYS 716  48.973  -5.812  -4.860
   13    HZ2  LYS 716           HZ3      LYS 716  49.539  -6.984  -5.946

  No H/Q in entry =          13
  In of MODEL   39
    1    H    MET 717           H        MET 717  51.821  -6.071   0.655
    2    HA   MET 717           HA       MET 717  52.836  -8.009   2.595
    3    HB2  MET 717           HB2      MET 717  51.323  -5.445   3.102
    4    HB3  MET 717           HB3      MET 717  51.814  -6.586   4.337
    5    HG2  MET 717           HG2      MET 717  53.642  -4.984   2.560
    6    HG3  MET 717           HG3      MET 717  53.316  -4.688   4.264
    7    HE3  MET 717           HE1      MET 717  55.030  -7.792   5.965
    8    HE2  MET 717           HE2      MET 717  53.339  -7.648   5.497
    9    HE1  MET 717           HE3      MET 717  54.166  -6.276   6.238

  No H/Q in entry =           9
  In of MODEL   39
    1    HA   PRO 718           HA       PRO 718  49.103 -10.291   2.202
    2    HB2  PRO 718           HB2      PRO 718  48.856 -10.591   5.120
    3    HB3  PRO 718           HB3      PRO 718  49.125 -11.826   3.889
    4    HG2  PRO 718           HG2      PRO 718  51.039 -11.049   5.599
    5    HG3  PRO 718           HG3      PRO 718  51.418 -11.553   3.938
    6    HD2  PRO 718           HD2      PRO 718  51.272  -8.823   5.139
    7    HD3  PRO 718           HD3      PRO 718  52.400  -9.471   3.927

  No H/Q in entry =           7
  In of MODEL   39
    1    H    TYR 719           H        TYR 719  49.105  -7.483   4.054
    2    HA   TYR 719           HA       TYR 719  46.231  -7.586   4.482
    3    HB2  TYR 719           HB2      TYR 719  46.607  -5.491   5.850
    4    HB3  TYR 719           HB3      TYR 719  47.293  -6.976   6.490
    5    HD1  TYR 719           HD1      TYR 719  49.658  -7.238   6.726
    6    HD2  TYR 719           HD2      TYR 719  48.063  -3.744   4.900
    7    HE1  TYR 719           HE1      TYR 719  51.816  -6.124   6.986
    8    HE2  TYR 719           HE2      TYR 719  50.220  -2.622   5.131
    9    HH   TYR 719           HH       TYR 719  52.248  -2.775   6.459

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLU 720           H        GLU 720  48.219  -6.727   2.137
    2    HA   GLU 720           HA       GLU 720  46.882  -4.345   1.239
    3    HB2  GLU 720           HB2      GLU 720  48.803  -6.277  -0.006
    4    HB3  GLU 720           HB3      GLU 720  48.238  -4.831  -0.862
    5    HG2  GLU 720           HG2      GLU 720  49.934  -5.032   1.618
    6    HG3  GLU 720           HG3      GLU 720  50.453  -4.499   0.021

  No H/Q in entry =           6
  In of MODEL   39
    1    H    CYS 721           H        CYS 721  46.162  -7.484   1.553
    2    HA   CYS 721           HA       CYS 721  45.032  -8.160  -0.973
    3    HB2  CYS 721           HB2      CYS 721  46.007  -9.878   0.425
    4    HB3  CYS 721           HB3      CYS 721  44.893  -9.494   1.726

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLY 722           H        GLY 722  43.451  -6.790  -1.474
    2    HA3  GLY 722           HA2      GLY 722  41.076  -6.844   0.250
    3    HA2  GLY 722           HA3      GLY 722  41.471  -5.484  -0.802

  No H/Q in entry =           3
  In of MODEL   39
    1    HA   PRO 723           HA       PRO 723  39.395  -7.525  -4.178
    2    HB2  PRO 723           HB2      PRO 723  41.628  -6.851  -5.983
    3    HB3  PRO 723           HB3      PRO 723  39.966  -6.274  -6.041
    4    HG2  PRO 723           HG2      PRO 723  41.949  -4.643  -5.337
    5    HG3  PRO 723           HG3      PRO 723  40.366  -4.554  -4.540
    6    HD2  PRO 723           HD2      PRO 723  42.886  -5.868  -3.584
    7    HD3  PRO 723           HD3      PRO 723  41.753  -4.819  -2.701

  No H/Q in entry =           7
  In of MODEL   39
    1    H    SER 724           H        SER 724  39.459  -9.766  -4.020
    2    HA   SER 724           HA       SER 724  41.243 -11.278  -5.581
    3    HB2  SER 724           HB2      SER 724  42.260 -12.563  -3.605
    4    HB3  SER 724           HB3      SER 724  42.962 -11.001  -4.023
    5    HG   SER 724           HG       SER 724  41.203 -10.309  -2.416

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU 725           H        LEU 725  40.793 -13.422  -5.712
    2    HA   LEU 725           HA       LEU 725  38.117 -14.139  -4.904
    3    HB2  LEU 725           HB2      LEU 725  40.139 -15.335  -6.692
    4    HB3  LEU 725           HB3      LEU 725  38.930 -16.408  -6.037
    5    HG   LEU 725           HG       LEU 725  37.192 -14.845  -7.032
    6   HD13  LEU 725          HD11      LEU 725  37.813 -13.320  -8.673
    7   HD12  LEU 725          HD12      LEU 725  39.507 -13.719  -8.456
    8   HD11  LEU 725          HD13      LEU 725  38.620 -12.910  -7.154
    9   HD21  LEU 725          HD21      LEU 725  39.150 -16.142  -8.906
   10   HD23  LEU 725          HD22      LEU 725  37.494 -15.681  -9.291
   11   HD22  LEU 725          HD23      LEU 725  37.802 -16.946  -8.099

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ASP 726           H        ASP 726  37.499 -15.401  -3.383
    2    HA   ASP 726           HA       ASP 726  39.228 -16.249  -1.288
    3    HB2  ASP 726           HB2      ASP 726  36.338 -17.001  -1.800
    4    HB3  ASP 726           HB3      ASP 726  37.204 -17.165  -0.280

  No H/Q in entry =           4
  In of MODEL   39
    1    H    VAL 727           H        VAL 727  40.161 -18.152  -0.956
    2    HA   VAL 727           HA       VAL 727  39.278 -20.538  -2.410
    3    HB   VAL 727           HB       VAL 727  41.645 -21.186  -2.916
    4   HG13  VAL 727          HG11      VAL 727  41.966 -19.731  -4.858
    5   HG12  VAL 727          HG12      VAL 727  40.778 -18.604  -4.205
    6   HG11  VAL 727          HG13      VAL 727  40.282 -20.225  -4.688
    7   HG21  VAL 727          HG21      VAL 727  42.780 -19.794  -1.273
    8   HG23  VAL 727          HG22      VAL 727  42.270 -18.342  -2.129
    9   HG22  VAL 727          HG23      VAL 727  43.404 -19.459  -2.891

  No H/Q in entry =           9
  In of MODEL   39
    1    H    CYS 728           H        CYS 728  40.232 -22.563  -1.462
    2    HA   CYS 728           HA       CYS 728  40.568 -22.236   1.427
    3    HB2  CYS 728           HB2      CYS 728  39.874 -24.751  -0.112
    4    HB3  CYS 728           HB3      CYS 728  39.797 -24.491   1.618

  No H/Q in entry =           4
  In of MODEL   39
    1    H    ALA 729           H        ALA 729  42.558 -22.648   2.276
    2    HA   ALA 729           HA       ALA 729  44.388 -24.230   0.636
    3    HB3  ALA 729           HB1      ALA 729  44.865 -21.853   0.318
    4    HB2  ALA 729           HB2      ALA 729  46.174 -22.690   1.158
    5    HB1  ALA 729           HB3      ALA 729  45.040 -21.686   2.065

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLN 730           H        GLN 730  45.914 -25.331   1.751
    2    HA   GLN 730           HA       GLN 730  45.276 -25.797   4.549
    3    HB2  GLN 730           HB2      GLN 730  45.417 -27.761   3.055
    4    HB3  GLN 730           HB3      GLN 730  47.071 -27.317   2.691
    5    HG2  GLN 730           HG2      GLN 730  47.738 -27.644   4.964
    6    HG3  GLN 730           HG3      GLN 730  46.090 -28.022   5.437
    7   HE21  GLN 730          HE21      GLN 730  46.602 -30.061   6.153
    8   HE22  GLN 730          HE22      GLN 730  47.071 -31.323   5.080

  No H/Q in entry =           8
  In of MODEL   39
    1    H    ASP 731           H        ASP 731  46.427 -25.064   6.025
    2    HA   ASP 731           HA       ASP 731  48.818 -23.544   5.632
    3    HB2  ASP 731           HB2      ASP 731  47.181 -22.965   7.361
    4    HB3  ASP 731           HB3      ASP 731  47.423 -24.522   8.133

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLU 732           H        GLU 732  50.829 -24.407   5.551
    2    HA   GLU 732           HA       GLU 732  51.143 -27.220   6.084
    3    HB2  GLU 732           HB2      GLU 732  52.974 -25.172   4.881
    4    HB3  GLU 732           HB3      GLU 732  53.459 -26.835   5.184
    5    HG2  GLU 732           HG2      GLU 732  51.179 -25.964   3.427
    6    HG3  GLU 732           HG3      GLU 732  52.766 -26.519   2.879

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ARG 733           H        ARG 733  51.123 -24.872   8.235
    2    HA   ARG 733           HA       ARG 733  53.569 -25.745   9.568
    3    HB2  ARG 733           HB2      ARG 733  52.949 -23.264   9.189
    4    HB3  ARG 733           HB3      ARG 733  51.741 -23.512  10.436
    5    HG2  ARG 733           HG2      ARG 733  53.726 -22.505  11.383
    6    HG3  ARG 733           HG3      ARG 733  53.537 -24.147  12.008
    7    HD2  ARG 733           HD2      ARG 733  55.874 -23.598  11.333
    8    HD3  ARG 733           HD3      ARG 733  55.192 -24.985  10.481
    9    HE   ARG 733           HE       ARG 733  54.978 -22.385   9.214
   10   HH11  ARG 733          HH11      ARG 733  56.705 -25.500   9.326
   11   HH12  ARG 733          HH12      ARG 733  57.322 -25.344   7.748
   12   HH21  ARG 733          HH21      ARG 733  55.826 -22.249   7.028
   13   HH22  ARG 733          HH22      ARG 733  56.823 -23.491   6.441

  No H/Q in entry =          13
  In of MODEL   39
    1    H    SER 734           H        SER 734  50.179 -25.044  10.143
    2    HA   SER 734           HA       SER 734  50.096 -26.664  12.545
    3    HB2  SER 734           HB2      SER 734  48.919 -24.504  12.491
    4    HB3  SER 734           HB3      SER 734  48.015 -25.026  11.083
    5    HG   SER 734           HG       SER 734  47.945 -26.295  13.597

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LYS 735           H        LYS 735  49.418 -26.970   9.147
    2    HA   LYS 735           HA       LYS 735  48.370 -28.420   7.834
    3    HB2  LYS 735           HB2      LYS 735  48.729 -30.391  10.113
    4    HB3  LYS 735           HB3      LYS 735  48.334 -30.805   8.451
    5    HG2  LYS 735           HG2      LYS 735  50.885 -29.490   9.367
    6    HG3  LYS 735           HG3      LYS 735  50.698 -31.195   8.971
    7    HD2  LYS 735           HD2      LYS 735  50.197 -28.931   7.032
    8    HD3  LYS 735           HD3      LYS 735  51.721 -29.792   7.151
    9    HE2  LYS 735           HE2      LYS 735  50.463 -31.911   6.655
   10    HE3  LYS 735           HE3      LYS 735  49.023 -30.930   6.388
   11    HZ1  LYS 735           HZ1      LYS 735  50.231 -29.791   4.565
   12    HZ3  LYS 735           HZ2      LYS 735  50.117 -31.438   4.297
   13    HZ2  LYS 735           HZ3      LYS 735  51.556 -30.766   4.850

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ARG 736           H        ARG 736  46.763 -26.932   8.179
    2    HA   ARG 736           HA       ARG 736  44.283 -28.194   9.022
    3    HB2  ARG 736           HB2      ARG 736  43.547 -26.163  10.133
    4    HB3  ARG 736           HB3      ARG 736  44.984 -26.796  10.925
    5    HG2  ARG 736           HG2      ARG 736  46.355 -25.149   9.921
    6    HG3  ARG 736           HG3      ARG 736  45.036 -24.608   8.887
    7    HD2  ARG 736           HD2      ARG 736  45.406 -23.117  10.671
    8    HD3  ARG 736           HD3      ARG 736  43.810 -23.833  10.832
    9    HE   ARG 736           HE       ARG 736  45.758 -25.240  12.375
   10   HH11  ARG 736          HH11      ARG 736  43.892 -22.236  12.407
   11   HH12  ARG 736          HH12      ARG 736  43.817 -22.132  14.102
   12   HH21  ARG 736          HH21      ARG 736  45.636 -25.118  14.692
   13   HH22  ARG 736          HH22      ARG 736  44.809 -23.826  15.435

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ILE 737           H        ILE 737  42.463 -27.179   7.870
    2    HA   ILE 737           HA       ILE 737  43.405 -25.903   5.410
    3    HB   ILE 737           HB       ILE 737  40.595 -26.828   6.022
    4   HG12  ILE 737          HG12      ILE 737  42.203 -28.755   6.221
    5   HG13  ILE 737          HG13      ILE 737  41.039 -28.948   4.926
    6   HG23  ILE 737          HG21      ILE 737  40.363 -26.790   3.603
    7   HG22  ILE 737          HG22      ILE 737  42.065 -26.379   3.421
    8   HG21  ILE 737          HG23      ILE 737  40.959 -25.228   4.169
    9   HD13  ILE 737          HD11      ILE 737  42.746 -28.266   3.319
   10   HD12  ILE 737          HD12      ILE 737  43.239 -29.688   4.245
   11   HD11  ILE 737          HD13      ILE 737  43.914 -28.100   4.632

  No H/Q in entry =          11
  In of MODEL   39
    1    H    LEU 738           H        LEU 738  43.090 -23.739   5.202
    2    HA   LEU 738           HA       LEU 738  41.017 -22.577   6.845
    3    HB2  LEU 738           HB2      LEU 738  42.429 -20.747   7.513
    4    HB3  LEU 738           HB3      LEU 738  43.081 -22.265   8.103
    5    HG   LEU 738           HG       LEU 738  44.653 -21.997   5.934
    6   HD13  LEU 738          HD11      LEU 738  45.170 -19.761   5.445
    7   HD12  LEU 738          HD12      LEU 738  43.923 -19.193   6.564
    8   HD11  LEU 738          HD13      LEU 738  43.464 -20.097   5.118
    9   HD23  LEU 738          HD21      LEU 738  46.254 -20.817   7.275
   10   HD22  LEU 738          HD22      LEU 738  45.457 -22.081   8.231
   11   HD21  LEU 738          HD23      LEU 738  44.998 -20.381   8.431

  No H/Q in entry =          11
  In of MODEL   39
    1    HA   PRO 739           HA       PRO 739  39.999 -20.399   3.168
    2    HB2  PRO 739           HB2      PRO 739  38.809 -18.215   4.205
    3    HB3  PRO 739           HB3      PRO 739  38.065 -19.830   4.232
    4    HG2  PRO 739           HG2      PRO 739  39.516 -18.367   6.397
    5    HG3  PRO 739           HG3      PRO 739  38.009 -19.301   6.486
    6    HD2  PRO 739           HD2      PRO 739  40.403 -20.298   7.249
    7    HD3  PRO 739           HD3      PRO 739  39.115 -21.306   6.556

  No H/Q in entry =           7
  In of MODEL   39
    1    H    LEU 740           H        LEU 740  41.326 -19.331   1.896
    2    HA   LEU 740           HA       LEU 740  42.630 -16.906   2.858
    3    HB2  LEU 740           HB2      LEU 740  43.860 -19.104   1.201
    4    HB3  LEU 740           HB3      LEU 740  44.492 -17.474   1.180
    5    HG   LEU 740           HG       LEU 740  44.336 -19.259   3.605
    6   HD13  LEU 740          HD11      LEU 740  46.680 -19.438   3.469
    7   HD12  LEU 740          HD12      LEU 740  46.746 -18.366   2.048
    8   HD11  LEU 740          HD13      LEU 740  46.009 -19.962   1.922
    9   HD22  LEU 740          HD21      LEU 740  44.141 -16.922   4.224
   10   HD21  LEU 740          HD22      LEU 740  45.545 -16.527   3.234
   11   HD23  LEU 740          HD23      LEU 740  45.731 -17.537   4.665

  No H/Q in entry =          11
  In of MODEL   39
    1    H    THR 741           H        THR 741  43.582 -15.889   0.707
    2    HA   THR 741           HA       THR 741  41.485 -15.947  -1.307
    3    HB   THR 741           HB       THR 741  42.694 -13.325  -0.783
    4    HG1  THR 741           HG1      THR 741  40.889 -14.398   1.157
    5   HG23  THR 741          HG21      THR 741  40.370 -12.611  -0.918
    6   HG22  THR 741          HG22      THR 741  39.835 -14.285  -0.778
    7   HG21  THR 741          HG23      THR 741  40.730 -13.764  -2.207

  No H/Q in entry =           7
  In of MODEL   39
    1    H    VAL 742           H        VAL 742  42.403 -15.329  -3.391
    2    HA   VAL 742           HA       VAL 742  44.925 -16.360  -3.777
    3    HB   VAL 742           HB       VAL 742  43.557 -16.466  -5.728
    4   HG11  VAL 742          HG11      VAL 742  42.063 -14.785  -5.223
    5   HG13  VAL 742          HG12      VAL 742  42.666 -14.834  -6.884
    6   HG12  VAL 742          HG13      VAL 742  43.247 -13.562  -5.777
    7   HG22  VAL 742          HG21      VAL 742  44.796 -15.454  -7.499
    8   HG21  VAL 742          HG22      VAL 742  45.949 -15.986  -6.256
    9   HG23  VAL 742          HG23      VAL 742  45.503 -14.293  -6.386

  No H/Q in entry =           9
  In of MODEL   39
    1    H    CYS 743           H        CYS 743  44.254 -12.882  -3.645
    2    HA   CYS 743           HA       CYS 743  46.920 -12.121  -4.077
    3    HB2  CYS 743           HB2      CYS 743  45.109 -10.487  -4.205
    4    HB3  CYS 743           HB3      CYS 743  44.746 -10.712  -2.498

  No H/Q in entry =           4
  In of MODEL   39
    1    H    LYS 744           H        LYS 744  45.173 -12.884  -1.117
    2    HA   LYS 744           HA       LYS 744  47.053 -12.292   0.853
    3    HB2  LYS 744           HB2      LYS 744  44.654 -12.960   1.143
    4    HB3  LYS 744           HB3      LYS 744  45.114 -14.607   0.817
    5    HG2  LYS 744           HG2      LYS 744  44.928 -14.433   3.184
    6    HG3  LYS 744           HG3      LYS 744  46.646 -14.524   2.808
    7    HD2  LYS 744           HD2      LYS 744  46.368 -12.859   4.489
    8    HD3  LYS 744           HD3      LYS 744  46.709 -12.011   2.984
    9    HE2  LYS 744           HE2      LYS 744  44.941 -10.849   4.138
   10    HE3  LYS 744           HE3      LYS 744  44.253 -11.623   2.716
   11    HZ3  LYS 744           HZ1      LYS 744  43.387 -13.399   4.177
   12    HZ2  LYS 744           HZ2      LYS 744  42.850 -11.880   4.668
   13    HZ1  LYS 744           HZ3      LYS 744  44.103 -12.633   5.500

  No H/Q in entry =          13
  In of MODEL   39
    1    H    MET 745           H        MET 745  46.320 -15.463  -0.543
    2    HA   MET 745           HA       MET 745  48.389 -17.009   0.484
    3    HB2  MET 745           HB2      MET 745  46.879 -18.283  -0.465
    4    HB3  MET 745           HB3      MET 745  46.484 -17.185  -1.775
    5    HG2  MET 745           HG2      MET 745  47.434 -19.024  -2.879
    6    HG3  MET 745           HG3      MET 745  48.783 -17.927  -2.734
    7    HE2  MET 745           HE1      MET 745  48.163 -21.798  -0.377
    8    HE1  MET 745           HE2      MET 745  47.107 -21.150  -1.631
    9    HE3  MET 745           HE3      MET 745  47.161 -20.388  -0.041

  No H/Q in entry =           9
  In of MODEL   39
    1    H    HIS 746           H        HIS 746  48.333 -15.053  -2.486
    2    HA   HIS 746           HA       HIS 746  50.833 -16.073  -3.423
    3    HB2  HIS 746           HB2      HIS 746  49.075 -13.905  -4.237
    4    HB3  HIS 746           HB3      HIS 746  50.777 -13.689  -4.679
    5    HD1  HIS 746           HD1      HIS 746  51.743 -15.916  -6.034
    6    HD2  HIS 746           HD2      HIS 746  47.671 -15.245  -5.975
    7    HE1  HIS 746           HE1      HIS 746  50.862 -17.114  -8.023
    8    HE2  HIS 746           HE2      HIS 746  48.431 -16.461  -8.106

  No H/Q in entry =           8
  In of MODEL   39
    1    H    VAL 747           H        VAL 747  50.042 -13.061  -1.789
    2    HA   VAL 747           HA       VAL 747  52.675 -12.104  -1.683
    3    HB   VAL 747           HB       VAL 747  50.216 -11.527  -0.024
    4   HG12  VAL 747          HG11      VAL 747  52.904 -10.140   0.117
    5   HG11  VAL 747          HG12      VAL 747  52.231 -11.185   1.367
    6   HG13  VAL 747          HG13      VAL 747  51.440  -9.670   0.984
    7   HG23  VAL 747          HG21      VAL 747  51.764  -9.960  -2.049
    8   HG22  VAL 747          HG22      VAL 747  50.302  -9.398  -1.221
    9   HG21  VAL 747          HG23      VAL 747  50.230 -10.776  -2.336

  No H/Q in entry =           9
  In of MODEL   39
    1    H    LEU 748           H        LEU 748  50.722 -13.833   0.647
    2    HA   LEU 748           HA       LEU 748  52.627 -14.089   2.633
    3    HB2  LEU 748           HB2      LEU 748  50.513 -14.436   3.388
    4    HB3  LEU 748           HB3      LEU 748  50.006 -15.242   1.936
    5    HG   LEU 748           HG       LEU 748  51.712 -16.682   3.958
    6   HD13  LEU 748          HD11      LEU 748  49.626 -17.458   4.979
    7   HD12  LEU 748          HD12      LEU 748  48.694 -16.428   3.897
    8   HD11  LEU 748          HD13      LEU 748  49.738 -15.703   5.124
    9   HD22  LEU 748          HD21      LEU 748  50.595 -18.607   2.995
   10   HD21  LEU 748          HD22      LEU 748  51.348 -17.668   1.711
   11   HD23  LEU 748          HD23      LEU 748  49.607 -17.575   1.972

  No H/Q in entry =          11
  In of MODEL   39
    1    H    HIS 749           H        HIS 749  52.052 -16.059  -0.197
    2    HA   HIS 749           HA       HIS 749  53.694 -18.255   0.504
    3    HB2  HIS 749           HB2      HIS 749  51.938 -17.931  -1.436
    4    HB3  HIS 749           HB3      HIS 749  53.333 -17.354  -2.333
    5    HD1  HIS 749           HD1      HIS 749  55.047 -19.165  -3.130
    6    HD2  HIS 749           HD2      HIS 749  51.899 -20.642  -0.852
    7    HE1  HIS 749           HE1      HIS 749  55.053 -21.635  -3.491
    8    HE2  HIS 749           HE2      HIS 749  53.085 -22.501  -2.203

  No H/Q in entry =           8
  In of MODEL   39
    1    H    CYS 750           H        CYS 750  54.289 -15.155  -1.098
    2    HA   CYS 750           HA       CYS 750  57.004 -15.894  -1.745
    3    HB2  CYS 750           HB2      CYS 750  55.557 -14.423  -3.212
    4    HB3  CYS 750           HB3      CYS 750  55.708 -13.175  -1.988

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLN 751           H        GLN 751  55.259 -14.305   0.775
    2    HA   GLN 751           HA       GLN 751  57.434 -13.108   2.115
    3    HB2  GLN 751           HB2      GLN 751  54.753 -14.108   3.065
    4    HB3  GLN 751           HB3      GLN 751  55.913 -13.371   4.153
    5    HG2  GLN 751           HG2      GLN 751  54.806 -12.029   1.706
    6    HG3  GLN 751           HG3      GLN 751  54.128 -11.841   3.319
    7   HE21  GLN 751          HE21      GLN 751  55.250  -9.734   1.645
    8   HE22  GLN 751          HE22      GLN 751  56.608  -9.129   2.509

  No H/Q in entry =           8
  In of MODEL   39
    1    H    GLY 752           H        GLY 752  56.887 -16.323   1.451
    2    HA3  GLY 752           HA2      GLY 752  58.458 -17.972   1.978
    3    HA2  GLY 752           HA3      GLY 752  58.898 -17.062   3.416

  No H/Q in entry =           3
  In of MODEL   39
    1    H    ARG 753           H        ARG 753  55.573 -17.788   2.568
    2    HA   ARG 753           HA       ARG 753  55.527 -19.703   4.798
    3    HB2  ARG 753           HB2      ARG 753  53.246 -18.020   3.756
    4    HB3  ARG 753           HB3      ARG 753  53.189 -19.095   5.146
    5    HG2  ARG 753           HG2      ARG 753  54.803 -16.557   4.921
    6    HG3  ARG 753           HG3      ARG 753  53.305 -16.772   5.823
    7    HD2  ARG 753           HD2      ARG 753  54.416 -18.396   7.283
    8    HD3  ARG 753           HD3      ARG 753  55.909 -18.205   6.357
    9    HE   ARG 753           HE       ARG 753  54.929 -15.728   7.320
   10   HH11  ARG 753          HH11      ARG 753  56.695 -18.613   8.391
   11   HH12  ARG 753          HH12      ARG 753  57.578 -17.813   9.600
   12   HH21  ARG 753          HH21      ARG 753  56.178 -14.617   8.996
   13   HH22  ARG 753          HH22      ARG 753  57.270 -15.477   9.966

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ASN 754           H        ASN 754  54.875 -21.706   4.307
    2    HA   ASN 754           HA       ASN 754  54.139 -22.216   1.541
    3    HB2  ASN 754           HB2      ASN 754  55.014 -24.100   3.722
    4    HB3  ASN 754           HB3      ASN 754  54.506 -24.622   2.122
    5   HD21  ASN 754          HD21      ASN 754  57.028 -24.888   3.483
    6   HD22  ASN 754          HD22      ASN 754  58.206 -24.144   2.466

  No H/Q in entry =           6
  In of MODEL   39
    1    H    TYR 755           H        TYR 755  52.322 -22.928   0.895
    2    HA   TYR 755           HA       TYR 755  50.334 -23.952   2.725
    3    HB2  TYR 755           HB2      TYR 755  50.040 -21.448   1.109
    4    HB3  TYR 755           HB3      TYR 755  48.643 -22.475   1.409
    5    HD1  TYR 755           HD1      TYR 755  51.303 -20.543   3.082
    6    HD2  TYR 755           HD2      TYR 755  47.502 -22.366   3.417
    7    HE1  TYR 755           HE1      TYR 755  51.003 -19.483   5.250
    8    HE2  TYR 755           HE2      TYR 755  47.182 -21.318   5.587
    9    HH   TYR 755           HH       TYR 755  48.789 -20.565   7.382

  No H/Q in entry =           9
  In of MODEL   39
    1    H    THR 756           H        THR 756  48.792 -25.143   1.702
    2    HA   THR 756           HA       THR 756  49.532 -25.965  -1.014
    3    HB   THR 756           HB       THR 756  48.150 -27.512   1.179
    4    HG1  THR 756           HG1      THR 756  50.081 -27.835   1.865
    5   HG22  THR 756          HG21      THR 756  48.554 -29.457  -0.247
    6   HG21  THR 756          HG22      THR 756  49.245 -28.394  -1.488
    7   HG23  THR 756          HG23      THR 756  47.538 -28.256  -1.048

  No H/Q in entry =           7
  In of MODEL   39
    1    H    LEU 757           H        LEU 757  47.915 -25.908  -2.565
    2    HA   LEU 757           HA       LEU 757  45.447 -24.657  -1.807
    3    HB2  LEU 757           HB2      LEU 757  46.505 -25.579  -4.488
    4    HB3  LEU 757           HB3      LEU 757  44.881 -24.969  -4.276
    5    HG   LEU 757           HG       LEU 757  46.245 -23.246  -5.200
    6   HD13  LEU 757          HD11      LEU 757  45.937 -21.468  -3.562
    7   HD12  LEU 757          HD12      LEU 757  45.660 -22.672  -2.310
    8   HD11  LEU 757          HD13      LEU 757  44.541 -22.537  -3.663
    9   HD23  LEU 757          HD21      LEU 757  48.208 -22.315  -4.024
   10   HD22  LEU 757          HD22      LEU 757  48.458 -24.001  -4.480
   11   HD21  LEU 757          HD23      LEU 757  48.073 -23.588  -2.811

  No H/Q in entry =          11
  In of MODEL   39
    1    H    THR 758           H        THR 758  43.631 -25.616  -1.365
    2    HA   THR 758           HA       THR 758  43.502 -28.482  -1.858
    3    HB   THR 758           HB       THR 758  42.120 -28.497   0.333
    4    HG1  THR 758           HG1      THR 758  42.467 -25.960   0.247
    5   HG21  THR 758          HG21      THR 758  44.353 -29.519   0.100
    6   HG23  THR 758          HG22      THR 758  44.140 -28.784   1.685
    7   HG22  THR 758          HG23      THR 758  45.093 -27.956   0.452

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLY 759           H        GLY 759  41.025 -29.090  -1.173
    2    HA3  GLY 759           HA2      GLY 759  39.518 -27.948  -3.312
    3    HA2  GLY 759           HA3      GLY 759  39.003 -29.217  -2.202

  No H/Q in entry =           3
  In of MODEL   39
    1    H    ARG 760           H        ARG 760  37.292 -27.269  -2.952
    2    HA   ARG 760           HA       ARG 760  37.295 -25.087  -1.089
    3    HB2  ARG 760           HB2      ARG 760  35.217 -24.374  -2.120
    4    HB3  ARG 760           HB3      ARG 760  36.330 -24.865  -3.379
    5    HG2  ARG 760           HG2      ARG 760  34.344 -25.782  -4.129
    6    HG3  ARG 760           HG3      ARG 760  35.043 -27.137  -3.242
    7    HD2  ARG 760           HD2      ARG 760  33.679 -26.493  -1.264
    8    HD3  ARG 760           HD3      ARG 760  32.932 -25.230  -2.234
    9    HE   ARG 760           HE       ARG 760  32.776 -28.047  -3.001
   10   HH11  ARG 760          HH11      ARG 760  31.125 -25.078  -1.967
   11   HH12  ARG 760          HH12      ARG 760  29.579 -25.587  -2.475
   12   HH21  ARG 760          HH21      ARG 760  30.567 -28.757  -3.644
   13   HH22  ARG 760          HH22      ARG 760  29.270 -27.670  -3.438

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ASP 761           H        ASP 761  36.243 -28.270  -1.086
    2    HA   ASP 761           HA       ASP 761  34.147 -27.967   0.874
    3    HB2  ASP 761           HB2      ASP 761  35.516 -30.417  -0.235
    4    HB3  ASP 761           HB3      ASP 761  34.162 -30.470   0.891

  No H/Q in entry =           4
  In of MODEL   39
    1    H    SER 762           H        SER 762  37.502 -28.102   0.960
    2    HA   SER 762           HA       SER 762  37.861 -29.661   3.264
    3    HB2  SER 762           HB2      SER 762  39.701 -27.673   1.950
    4    HB3  SER 762           HB3      SER 762  40.180 -28.949   3.081
    5    HG   SER 762           HG       SER 762  39.083 -30.374   1.468

  No H/Q in entry =           5
  In of MODEL   39
    1    H    CYS 763           H        CYS 763  37.088 -26.245   2.879
    2    HA   CYS 763           HA       CYS 763  36.816 -26.094   5.749
    3    HB2  CYS 763           HB2      CYS 763  38.105 -24.050   6.050
    4    HB3  CYS 763           HB3      CYS 763  39.134 -25.294   5.349

  No H/Q in entry =           4
  In of MODEL   39
    1    H    THR 764           H        THR 764  35.976 -23.667   6.256
    2    HA   THR 764           HA       THR 764  33.678 -23.385   4.530
    3    HB   THR 764           HB       THR 764  34.348 -21.989   7.137
    4    HG1  THR 764           HG1      THR 764  33.855 -24.579   6.605
    5   HG21  THR 764          HG21      THR 764  32.443 -21.097   5.775
    6   HG23  THR 764          HG22      THR 764  31.945 -21.745   7.336
    7   HG22  THR 764          HG23      THR 764  31.692 -22.692   5.871

  No H/Q in entry =           7
  In of MODEL   39
    1    H    LEU 765           H        LEU 765  33.668 -21.836   2.995
    2    HA   LEU 765           HA       LEU 765  35.931 -20.057   2.859
    3    HB2  LEU 765           HB2      LEU 765  34.827 -21.511   0.961
    4    HB3  LEU 765           HB3      LEU 765  33.712 -20.167   0.853
    5    HG   LEU 765           HG       LEU 765  35.582 -18.651   0.338
    6   HD13  LEU 765          HD11      LEU 765  37.347 -19.782   1.542
    7   HD12  LEU 765          HD12      LEU 765  37.792 -19.661  -0.164
    8   HD11  LEU 765          HD13      LEU 765  37.177 -21.181   0.498
    9   HD22  LEU 765          HD21      LEU 765  36.088 -19.520  -1.887
   10   HD21  LEU 765          HD22      LEU 765  34.381 -19.751  -1.504
   11   HD23  LEU 765          HD23      LEU 765  35.502 -21.113  -1.413

  No H/Q in entry =          11
  In of MODEL   39
    1    HA   PRO 766           HA       PRO 766  33.636 -16.694   4.570
    2    HB2  PRO 766           HB2      PRO 766  35.125 -14.589   3.596
    3    HB3  PRO 766           HB3      PRO 766  35.523 -15.531   5.034
    4    HG2  PRO 766           HG2      PRO 766  36.679 -15.637   2.319
    5    HG3  PRO 766           HG3      PRO 766  37.425 -16.028   3.873
    6    HD2  PRO 766           HD2      PRO 766  36.538 -17.882   2.010
    7    HD3  PRO 766           HD3      PRO 766  36.809 -18.213   3.725

  No H/Q in entry =           7
  In of MODEL   39
    1    H    ALA 767           H        ALA 767  34.668 -15.715   1.235
    2    HA   ALA 767           HA       ALA 767  31.916 -14.771   0.943
    3    HB2  ALA 767           HB1      ALA 767  34.332 -13.761  -0.538
    4    HB1  ALA 767           HB2      ALA 767  33.617 -12.982   0.874
    5    HB3  ALA 767           HB3      ALA 767  32.693 -13.116  -0.621

  No H/Q in entry =           5
  In of MODEL   39
    1    H    SER 768           H        SER 768  30.685 -15.911  -0.095
    2    HA   SER 768           HA       SER 768  31.304 -16.678  -2.799
    3    HB2  SER 768           HB2      SER 768  30.541 -18.681  -0.655
    4    HB3  SER 768           HB3      SER 768  30.458 -18.994  -2.387
    5    HG   SER 768           HG       SER 768  32.840 -17.962  -1.518

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA 769           H        ALA 769  29.584 -14.814  -1.227
    2    HA   ALA 769           HA       ALA 769  26.970 -15.865  -1.986
    3    HB2  ALA 769           HB1      ALA 769  26.001 -14.547  -0.213
    4    HB1  ALA 769           HB2      ALA 769  27.590 -13.944   0.247
    5    HB3  ALA 769           HB3      ALA 769  27.201 -15.659   0.431

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLU 770           H        GLU 770  25.411 -13.988  -2.074
    2    HA   GLU 770           HA       GLU 770  26.252 -12.237  -4.219
    3    HB2  GLU 770           HB2      GLU 770  23.841 -11.731  -4.349
    4    HB3  GLU 770           HB3      GLU 770  24.158 -13.459  -4.458
    5    HG2  GLU 770           HG2      GLU 770  23.562 -12.219  -1.850
    6    HG3  GLU 770           HG3      GLU 770  22.199 -12.573  -2.936

  No H/Q in entry =           6
  In of MODEL   39
    1    H    LYS 771           H        LYS 771  25.529  -9.917  -4.091
    2    HA   LYS 771           HA       LYS 771  25.522  -8.890  -1.355
    3    HB2  LYS 771           HB2      LYS 771  27.355  -7.893  -3.560
    4    HB3  LYS 771           HB3      LYS 771  27.184  -7.184  -1.968
    5    HG2  LYS 771           HG2      LYS 771  28.130  -9.994  -2.446
    6    HG3  LYS 771           HG3      LYS 771  29.200  -8.608  -2.239
    7    HD2  LYS 771           HD2      LYS 771  28.609  -8.330  -0.008
    8    HD3  LYS 771           HD3      LYS 771  27.102  -9.224  -0.184
    9    HE2  LYS 771           HE2      LYS 771  28.227 -11.251  -0.409
   10    HE3  LYS 771           HE3      LYS 771  29.828 -10.481  -0.456
   11    HZ1  LYS 771           HZ1      LYS 771  29.371  -9.709   1.832
   12    HZ3  LYS 771           HZ2      LYS 771  29.397 -11.388   1.732
   13    HZ2  LYS 771           HZ3      LYS 771  27.932 -10.574   1.838

  No H/Q in entry =          13
  In of MODEL   39
    1    H    ALA 772           H        ALA 772  25.272  -6.351  -1.594
    2    HA   ALA 772           HA       ALA 772  23.429  -5.717  -3.720
    3    HB1  ALA 772           HB1      ALA 772  22.010  -6.623  -1.937
    4    HB3  ALA 772           HB2      ALA 772  21.753  -4.886  -2.124
    5    HB2  ALA 772           HB3      ALA 772  22.730  -5.494  -0.787

  No H/Q in entry =           5
  In of MODEL   39
    1    H    CYS 773           H        CYS 773  22.725  -3.296  -3.196
    2    HA   CYS 773           HA       CYS 773  25.004  -1.715  -3.490
    3    HB2  CYS 773           HB2      CYS 773  22.742  -1.018  -4.213
    4    HB3  CYS 773           HB3      CYS 773  22.266  -0.843  -2.528

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLY 774           H        GLY 774  26.530  -1.276  -2.076
    2    HA3  GLY 774           HA2      GLY 774  26.885  -0.052   0.111
    3    HA2  GLY 774           HA3      GLY 774  25.887  -1.334   0.795

  No H/Q in entry =           3
  In of MODEL   39
    1    H    ALA 775           H        ALA 775  27.030  -3.267  -1.162
    2    HA   ALA 775           HA       ALA 775  29.851  -3.378  -0.516
    3    HB1  ALA 775           HB1      ALA 775  29.675  -5.747   0.173
    4    HB2  ALA 775           HB2      ALA 775  27.919  -5.639   0.081
    5    HB3  ALA 775           HB3      ALA 775  28.796  -4.700   1.285

  No H/Q in entry =           5
  In of MODEL   39
    1    H    CYS 776           H        CYS 776  30.494  -3.288  -2.583
    2    HA   CYS 776           HA       CYS 776  29.195  -5.146  -4.437
    3    HB2  CYS 776           HB2      CYS 776  30.236  -2.384  -5.054
    4    HB3  CYS 776           HB3      CYS 776  29.516  -3.506  -6.204

  No H/Q in entry =           4
  In of MODEL   39
    1    HA   PRO 777           HA       PRO 777  33.468  -6.688  -4.520
    2    HB2  PRO 777           HB2      PRO 777  32.251  -8.572  -6.447
    3    HB3  PRO 777           HB3      PRO 777  33.159  -8.911  -4.977
    4    HG2  PRO 777           HG2      PRO 777  30.521  -9.287  -5.084
    5    HG3  PRO 777           HG3      PRO 777  31.307  -8.679  -3.615
    6    HD2  PRO 777           HD2      PRO 777  29.730  -7.185  -5.672
    7    HD3  PRO 777           HD3      PRO 777  29.769  -7.005  -3.905

  No H/Q in entry =           7
  In of MODEL   39
    1    H    LEU 778           H        LEU 778  34.833  -7.560  -6.506
    2    HA   LEU 778           HA       LEU 778  35.416  -5.375  -8.185
    3    HB2  LEU 778           HB2      LEU 778  36.013  -8.116  -9.207
    4    HB3  LEU 778           HB3      LEU 778  37.013  -6.692  -9.239
    5    HG   LEU 778           HG       LEU 778  36.606  -8.637  -6.990
    6   HD13  LEU 778          HD11      LEU 778  39.009  -8.965  -7.179
    7   HD12  LEU 778          HD12      LEU 778  39.055  -7.822  -8.517
    8   HD11  LEU 778          HD13      LEU 778  38.162  -9.332  -8.683
    9   HD22  LEU 778          HD21      LEU 778  36.673  -6.465  -5.948
   10   HD21  LEU 778          HD22      LEU 778  38.110  -6.034  -6.897
   11   HD23  LEU 778          HD23      LEU 778  38.183  -7.355  -5.709

  No H/Q in entry =          11
  In of MODEL   39
    1    H    TRP 779           H        TRP 779  33.671  -8.296  -8.715
    2    HA   TRP 779           HA       TRP 779  32.944  -7.750 -11.464
    3    HB2  TRP 779           HB2      TRP 779  31.935 -10.073 -11.168
    4    HB3  TRP 779           HB3      TRP 779  33.691  -9.934 -11.078
    5    HD1  TRP 779           HD1      TRP 779  30.637 -10.477  -8.762
    6    HE1  TRP 779           HE1      TRP 779  31.473 -11.505  -6.565
    7    HE3  TRP 779           HE3      TRP 779  35.653 -10.305  -9.624
    8    HZ2  TRP 779           HZ2      TRP 779  33.929 -12.169  -5.346
    9    HZ3  TRP 779           HZ3      TRP 779  37.178 -11.173  -7.898
   10    HH2  TRP 779           HH2      TRP 779  36.333 -12.086  -5.810

  No H/Q in entry =          10
  In of MODEL   39
    1    H    GLY 780           H        GLY 780  31.730  -6.947  -8.523
    2    HA3  GLY 780           HA2      GLY 780  28.948  -7.396  -9.328
    3    HA2  GLY 780           HA3      GLY 780  29.485  -7.273  -7.656

  No H/Q in entry =           3
  In of MODEL   39
    1    H    LYS 781           H        LYS 781  28.662  -5.610 -10.490
    2    HA   LYS 781           HA       LYS 781  29.313  -3.057  -9.220
    3    HB2  LYS 781           HB2      LYS 781  28.636  -3.699 -12.084
    4    HB3  LYS 781           HB3      LYS 781  28.843  -2.069 -11.465
    5    HG2  LYS 781           HG2      LYS 781  30.926  -4.204 -11.355
    6    HG3  LYS 781           HG3      LYS 781  30.826  -2.959 -12.621
    7    HD2  LYS 781           HD2      LYS 781  31.091  -1.235 -10.880
    8    HD3  LYS 781           HD3      LYS 781  31.222  -2.497  -9.655
    9    HE2  LYS 781           HE2      LYS 781  33.214  -3.340 -10.686
   10    HE3  LYS 781           HE3      LYS 781  33.088  -2.162 -11.996
   11    HZ2  LYS 781           HZ1      LYS 781  33.537  -1.549  -9.118
   12    HZ1  LYS 781           HZ2      LYS 781  33.329  -0.399 -10.311
   13    HZ3  LYS 781           HZ3      LYS 781  34.675  -1.398 -10.352

  No H/Q in entry =          13
  In of MODEL   39
    1    H    CYS 782           H        CYS 782  27.798  -1.532  -9.001
    2    HA   CYS 782           HA       CYS 782  25.093  -2.602  -8.864
    3    HB2  CYS 782           HB2      CYS 782  26.059  -1.532  -6.809
    4    HB3  CYS 782           HB3      CYS 782  26.137  -0.010  -7.682

  No H/Q in entry =           4
  In of MODEL   39
    1    H    ASP 783           H        ASP 783  24.742  -2.561 -11.022
    2    HA   ASP 783           HA       ASP 783  23.743  -0.016 -11.972
    3    HB2  ASP 783           HB2      ASP 783  25.988  -0.309 -13.089
    4    HB3  ASP 783           HB3      ASP 783  25.413  -1.827 -13.764

  No H/Q in entry =           4
  In of MODEL   39
    1    H    ALA 784           H        ALA 784  21.968  -0.993 -11.188
    2    HA   ALA 784           HA       ALA 784  20.155  -2.096 -12.899
    3    HB3  ALA 784           HB1      ALA 784  19.861  -4.382 -11.932
    4    HB2  ALA 784           HB2      ALA 784  21.345  -4.172 -11.006
    5    HB1  ALA 784           HB3      ALA 784  21.408  -4.238 -12.767

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLU 785           H        GLU 785  18.463  -1.132 -11.963
    2    HA   GLU 785           HA       GLU 785  18.674  -0.453  -9.191
    3    HB2  GLU 785           HB2      GLU 785  17.861   1.196 -10.896
    4    HB3  GLU 785           HB3      GLU 785  16.434   0.201 -11.113
    5    HG2  GLU 785           HG2      GLU 785  15.809   0.571  -8.779
    6    HG3  GLU 785           HG3      GLU 785  17.246   1.570  -8.558

  No H/Q in entry =           6
  In of MODEL   39
    1    H    SER 786           H        SER 786  18.632  -2.594  -8.542
    2    HA   SER 786           HA       SER 786  15.923  -3.494  -7.879
    3    HB2  SER 786           HB2      SER 786  18.110  -5.343  -8.898
    4    HB3  SER 786           HB3      SER 786  16.502  -5.839  -8.361
    5    HG   SER 786           HG       SER 786  16.283  -3.898 -10.162

  No H/Q in entry =           5
  In of MODEL   39
    1    H    SER 787           H        SER 787  18.336  -2.132  -6.712
    2    HA   SER 787           HA       SER 787  19.309  -1.835  -4.739
    3    HB2  SER 787           HB2      SER 787  17.609  -4.133  -3.746
    4    HB3  SER 787           HB3      SER 787  18.409  -2.913  -2.748
    5    HG   SER 787           HG       SER 787  17.171  -1.349  -3.974

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LYS 788           H        LYS 788  19.595  -4.782  -6.285
    2    HA   LYS 788           HA       LYS 788  21.645  -5.960  -4.631
    3    HB2  LYS 788           HB2      LYS 788  20.434  -6.663  -7.266
    4    HB3  LYS 788           HB3      LYS 788  21.799  -7.528  -6.586
    5    HG2  LYS 788           HG2      LYS 788  20.596  -8.242  -4.793
    6    HG3  LYS 788           HG3      LYS 788  19.228  -7.166  -5.125
    7    HD2  LYS 788           HD2      LYS 788  18.659  -9.448  -5.859
    8    HD3  LYS 788           HD3      LYS 788  18.816  -8.382  -7.251
    9    HE2  LYS 788           HE2      LYS 788  19.878 -10.470  -7.782
   10    HE3  LYS 788           HE3      LYS 788  21.138  -9.272  -7.594
   11    HZ1  LYS 788           HZ1      LYS 788  21.538 -10.143  -5.341
   12    HZ3  LYS 788           HZ2      LYS 788  21.730 -11.323  -6.501
   13    HZ2  LYS 788           HZ3      LYS 788  20.329 -11.295  -5.571

  No H/Q in entry =          13
  In of MODEL   39
    1    H    CYS 789           H        CYS 789  23.650  -6.673  -5.649
    2    HA   CYS 789           HA       CYS 789  24.686  -4.742  -7.558
    3    HB2  CYS 789           HB2      CYS 789  26.860  -5.350  -6.754
    4    HB3  CYS 789           HB3      CYS 789  25.786  -5.351  -5.343

  No H/Q in entry =           4
  In of MODEL   39
    1    H    VAL 790           H        VAL 790  25.374  -5.609  -9.574
    2    HA   VAL 790           HA       VAL 790  24.345  -8.310  -9.976
    3    HB   VAL 790           HB       VAL 790  23.145  -6.407 -11.103
    4   HG13  VAL 790          HG11      VAL 790  24.926  -4.963 -11.674
    5   HG12  VAL 790          HG12      VAL 790  24.065  -5.430 -13.143
    6   HG11  VAL 790          HG13      VAL 790  25.621  -6.164 -12.759
    7   HG23  VAL 790          HG21      VAL 790  24.289  -8.509 -12.925
    8   HG22  VAL 790          HG22      VAL 790  22.861  -7.527 -13.267
    9   HG21  VAL 790          HG23      VAL 790  22.859  -8.646 -11.898

  No H/Q in entry =           9
  In of MODEL   39
    1    H    CYS 791           H        CYS 791  25.557  -9.552 -11.711
    2    HA   CYS 791           HA       CYS 791  28.395  -9.102 -11.196
    3    HB2  CYS 791           HB2      CYS 791  27.017 -11.535 -12.383
    4    HB3  CYS 791           HB3      CYS 791  28.690 -11.422 -11.862

  No H/Q in entry =           4
  In of MODEL   39
    1    H    ARG 792           H        ARG 792  29.620  -8.344 -12.696
    2    HA   ARG 792           HA       ARG 792  28.499  -7.939 -15.359
    3    HB2  ARG 792           HB2      ARG 792  30.563  -6.443 -13.780
    4    HB3  ARG 792           HB3      ARG 792  30.240  -6.117 -15.485
    5    HG2  ARG 792           HG2      ARG 792  28.308  -5.842 -13.183
    6    HG3  ARG 792           HG3      ARG 792  29.033  -4.536 -14.130
    7    HD2  ARG 792           HD2      ARG 792  27.955  -5.502 -16.155
    8    HD3  ARG 792           HD3      ARG 792  27.138  -6.652 -15.112
    9    HE   ARG 792           HE       ARG 792  26.157  -4.636 -14.016
   10   HH11  ARG 792          HH11      ARG 792  27.264  -4.506 -17.371
   11   HH12  ARG 792          HH12      ARG 792  25.964  -3.579 -17.933
   12   HH21  ARG 792          HH21      ARG 792  24.255  -3.331 -14.824
   13   HH22  ARG 792          HH22      ARG 792  24.261  -2.919 -16.450

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLU 793           H        GLU 793  30.374  -7.486 -16.983
    2    HA   GLU 793           HA       GLU 793  31.637 -10.039 -17.399
    3    HB2  GLU 793           HB2      GLU 793  32.069  -7.480 -18.934
    4    HB3  GLU 793           HB3      GLU 793  32.367  -9.121 -19.483
    5    HG2  GLU 793           HG2      GLU 793  29.733  -7.966 -18.796
    6    HG3  GLU 793           HG3      GLU 793  30.348  -8.135 -20.463

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ALA 794           H        ALA 794  33.989 -10.035 -17.973
    2    HA   ALA 794           HA       ALA 794  35.450  -9.317 -15.680
    3    HB3  ALA 794           HB1      ALA 794  37.362 -10.199 -16.896
    4    HB1  ALA 794           HB2      ALA 794  36.405 -10.186 -18.383
    5    HB2  ALA 794           HB3      ALA 794  35.952 -11.251 -17.058

  No H/Q in entry =           5
  In of MODEL   39
    1    H    SER 795           H        SER 795  35.371  -8.012 -18.955
    2    HA   SER 795           HA       SER 795  37.379  -6.164 -18.534
    3    HB2  SER 795           HB2      SER 795  36.258  -5.225 -20.689
    4    HB3  SER 795           HB3      SER 795  37.012  -6.824 -20.729
    5    HG   SER 795           HG       SER 795  34.799  -6.592 -21.584

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLU 796           H        GLU 796  33.988  -6.253 -17.994
    2    HA   GLU 796           HA       GLU 796  33.627  -3.400 -17.796
    3    HB2  GLU 796           HB2      GLU 796  31.904  -4.876 -18.806
    4    HB3  GLU 796           HB3      GLU 796  31.700  -5.683 -17.266
    5    HG2  GLU 796           HG2      GLU 796  30.677  -3.781 -16.307
    6    HG3  GLU 796           HG3      GLU 796  31.177  -2.749 -17.648

  No H/Q in entry =           6
  In of MODEL   39
    1    H    CYS 797           H        CYS 797  34.714  -5.851 -15.807
    2    HA   CYS 797           HA       CYS 797  33.946  -4.749 -13.280
    3    HB2  CYS 797           HB2      CYS 797  36.239  -6.594 -13.989
    4    HB3  CYS 797           HB3      CYS 797  35.739  -6.190 -12.355

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLU 798           H        GLU 798  36.469  -4.211 -15.636
    2    HA   GLU 798           HA       GLU 798  38.254  -2.817 -15.806
    3    HB2  GLU 798           HB2      GLU 798  36.547  -1.147 -13.960
    4    HB3  GLU 798           HB3      GLU 798  37.897  -0.553 -14.911
    5    HG2  GLU 798           HG2      GLU 798  36.701  -1.123 -16.964
    6    HG3  GLU 798           HG3      GLU 798  35.337  -1.696 -15.998

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU 799           H        GLU 799  38.670  -4.774 -13.907
    2    HA   GLU 799           HA       GLU 799  40.155  -3.351 -11.774
    3    HB2  GLU 799           HB2      GLU 799  37.940  -4.721 -11.256
    4    HB3  GLU 799           HB3      GLU 799  39.027  -6.092 -11.348
    5    HG2  GLU 799           HG2      GLU 799  39.063  -3.822  -9.384
    6    HG3  GLU 799           HG3      GLU 799  38.846  -5.559  -9.128

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLU 800           H        GLU 800  39.720  -6.612 -12.936
    2    HA   GLU 800           HA       GLU 800  40.918  -8.122 -13.990
    3    HB2  GLU 800           HB2      GLU 800  43.236  -6.199 -14.035
    4    HB3  GLU 800           HB3      GLU 800  43.219  -7.777 -14.815
    5    HG2  GLU 800           HG2      GLU 800  41.271  -7.016 -16.162
    6    HG3  GLU 800           HG3      GLU 800  41.475  -5.418 -15.457

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLY 801           H        GLY 801  42.360  -6.648 -11.167
    2    HA3  GLY 801           HA2      GLY 801  43.704  -7.431  -9.567
    3    HA2  GLY 801           HA3      GLY 801  42.630  -8.809  -9.651

  No H/Q in entry =           3
  In of MODEL   39
    1    H    PHE 802           H        PHE 802  43.895 -10.380  -9.326
    2    HA   PHE 802           HA       PHE 802  46.516 -10.727 -10.507
    3    HB2  PHE 802           HB2      PHE 802  44.819 -12.342  -8.637
    4    HB3  PHE 802           HB3      PHE 802  46.219 -13.067  -9.405
    5    HD1  PHE 802           HD1      PHE 802  45.879  -9.591  -8.112
    6    HD2  PHE 802           HD2      PHE 802  47.632 -13.430  -7.607
    7    HE1  PHE 802           HE1      PHE 802  47.314  -8.710  -6.344
    8    HE2  PHE 802           HE2      PHE 802  49.054 -12.560  -5.853
    9    HZ   PHE 802           HZ       PHE 802  48.906 -10.186  -5.192

  No H/Q in entry =           9
  In of MODEL   39
    1    H    SER 803           H        SER 803  46.920 -13.067 -11.384
    2    HA   SER 803           HA       SER 803  44.772 -13.756 -13.246
    3    HB2  SER 803           HB2      SER 803  47.742 -14.186 -13.669
    4    HB3  SER 803           HB3      SER 803  46.421 -14.372 -14.829
    5    HG   SER 803           HG       SER 803  46.030 -12.131 -14.651

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ILE 804           H        ILE 804  44.071 -15.858 -13.078
    2    HA   ILE 804           HA       ILE 804  45.681 -17.703 -11.459
    3    HB   ILE 804           HB       ILE 804  43.762 -18.556 -10.248
    4   HG12  ILE 804          HG12      ILE 804  42.017 -18.080 -12.011
    5   HG13  ILE 804          HG13      ILE 804  41.513 -17.726 -10.370
    6   HG23  ILE 804          HG21      ILE 804  43.210 -16.644  -8.815
    7   HG22  ILE 804          HG22      ILE 804  43.888 -15.564 -10.034
    8   HG21  ILE 804          HG23      ILE 804  44.929 -16.730  -9.215
    9   HD13  ILE 804          HD11      ILE 804  40.730 -16.042 -11.911
   10   HD12  ILE 804          HD12      ILE 804  42.373 -15.729 -12.454
   11   HD11  ILE 804          HD13      ILE 804  41.900 -15.340 -10.795

  No H/Q in entry =          11
  In of MODEL   39
    1    H    CYS 805           H        CYS 805  44.640 -20.006 -11.585
    2    HA   CYS 805           HA       CYS 805  44.044 -20.540 -14.407
    3    HB2  CYS 805           HB2      CYS 805  46.191 -21.475 -13.659
    4    HB3  CYS 805           HB3      CYS 805  45.382 -22.248 -12.302

  No H/Q in entry =           4
  In of MODEL   39
    1    H    VAL 806           H        VAL 806  42.100 -21.314 -14.785
    2    HA   VAL 806           HA       VAL 806  40.635 -22.535 -12.552
    3    HB   VAL 806           HB       VAL 806  39.416 -20.691 -14.587
    4   HG13  VAL 806          HG11      VAL 806  37.868 -22.223 -13.672
    5   HG12  VAL 806          HG12      VAL 806  37.543 -20.609 -13.009
    6   HG11  VAL 806          HG13      VAL 806  38.355 -21.833 -12.030
    7   HG23  VAL 806          HG21      VAL 806  39.237 -18.990 -12.820
    8   HG22  VAL 806          HG22      VAL 806  40.887 -19.326 -13.313
    9   HG21  VAL 806          HG23      VAL 806  40.272 -19.988 -11.787

  No H/Q in entry =           9
  In of MODEL   39
    1    H    GLU 807           H        GLU 807  39.538 -24.340 -13.112
    2    HA   GLU 807           HA       GLU 807  39.767 -25.334 -15.802
    3    HB2  GLU 807           HB2      GLU 807  40.013 -26.872 -13.903
    4    HB3  GLU 807           HB3      GLU 807  38.409 -26.439 -13.336
    5    HG2  GLU 807           HG2      GLU 807  37.486 -27.345 -15.452
    6    HG3  GLU 807           HG3      GLU 807  39.123 -27.889 -15.855

  No H/Q in entry =           6
  In of MODEL   39
    1    H    VAL 808           H        VAL 808  38.397 -24.845 -17.252
    2    HA   VAL 808           HA       VAL 808  35.593 -24.449 -16.649
    3    HB   VAL 808           HB       VAL 808  36.703 -22.210 -16.639
    4   HG11  VAL 808          HG11      VAL 808  38.505 -22.567 -18.174
    5   HG13  VAL 808          HG12      VAL 808  37.513 -21.212 -18.721
    6   HG12  VAL 808          HG13      VAL 808  37.369 -22.784 -19.506
    7   HG22  VAL 808          HG21      VAL 808  35.185 -21.106 -18.187
    8   HG21  VAL 808          HG22      VAL 808  34.375 -22.360 -17.233
    9   HG23  VAL 808          HG23      VAL 808  34.810 -22.669 -18.918

  No H/Q in entry =           9
  In of MODEL   39
    1    H    ASN 809           H        ASN 809  34.393 -25.424 -18.169
    2    HA   ASN 809           HA       ASN 809  33.802 -26.563 -20.044
    3    HB2  ASN 809           HB2      ASN 809  35.975 -24.831 -21.047
    4    HB3  ASN 809           HB3      ASN 809  35.361 -26.077 -22.147
    5   HD21  ASN 809          HD21      ASN 809  34.932 -23.006 -20.717
    6   HD22  ASN 809          HD22      ASN 809  33.420 -22.610 -21.441

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLY 810           H        GLY 810  35.901 -27.468 -18.115
    2    HA3  GLY 810           HA2      GLY 810  36.605 -29.724 -17.938
    3    HA2  GLY 810           HA3      GLY 810  36.679 -29.770 -19.707

  No H/Q in entry =           3
  In of MODEL   39
    1    H    LYS 811           H        LYS 811  38.118 -27.119 -19.535
    2    HA   LYS 811           HA       LYS 811  40.776 -28.327 -19.091
    3    HB2  LYS 811           HB2      LYS 811  41.548 -26.715 -20.820
    4    HB3  LYS 811           HB3      LYS 811  40.434 -27.942 -21.411
    5    HG2  LYS 811           HG2      LYS 811  38.593 -26.332 -21.278
    6    HG3  LYS 811           HG3      LYS 811  39.718 -25.103 -20.708
    7    HD2  LYS 811           HD2      LYS 811  39.923 -26.543 -23.319
    8    HD3  LYS 811           HD3      LYS 811  39.152 -24.967 -23.112
    9    HE2  LYS 811           HE2      LYS 811  41.295 -24.063 -22.261
   10    HE3  LYS 811           HE3      LYS 811  42.049 -25.629 -22.548
   11    HZ3  LYS 811           HZ1      LYS 811  42.494 -24.099 -24.319
   12    HZ2  LYS 811           HZ2      LYS 811  40.864 -23.870 -24.621
   13    HZ1  LYS 811           HZ3      LYS 811  41.572 -25.381 -24.898

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLU 812           H        GLU 812  42.448 -26.907 -18.387
    2    HA   GLU 812           HA       GLU 812  41.485 -24.844 -16.592
    3    HB2  GLU 812           HB2      GLU 812  44.207 -26.085 -16.968
    4    HB3  GLU 812           HB3      GLU 812  43.815 -24.875 -15.754
    5    HG2  GLU 812           HG2      GLU 812  42.258 -26.381 -14.701
    6    HG3  GLU 812           HG3      GLU 812  42.528 -27.586 -15.957

  No H/Q in entry =           6
  In of MODEL   39
    1    H    GLN 813           H        GLN 813  41.332 -22.903 -17.271
    2    HA   GLN 813           HA       GLN 813  43.153 -21.872 -19.351
    3    HB2  GLN 813           HB2      GLN 813  40.917 -21.984 -20.199
    4    HB3  GLN 813           HB3      GLN 813  40.240 -21.340 -18.716
    5    HG2  GLN 813           HG2      GLN 813  41.166 -19.175 -19.204
    6    HG3  GLN 813           HG3      GLN 813  41.911 -19.784 -20.699
    7   HE21  GLN 813          HE21      GLN 813  39.516 -21.434 -21.264
    8   HE22  GLN 813          HE22      GLN 813  38.299 -20.328 -21.778

  No H/Q in entry =           8
  In of MODEL   39
    1    H    THR 814           H        THR 814  43.898 -19.633 -18.979
    2    HA   THR 814           HA       THR 814  44.053 -18.973 -16.176
    3    HB   THR 814           HB       THR 814  45.184 -17.615 -18.603
    4    HG1  THR 814           HG1      THR 814  46.382 -19.305 -18.639
    5   HG23  THR 814          HG21      THR 814  46.796 -16.609 -17.015
    6   HG22  THR 814          HG22      THR 814  45.955 -17.401 -15.683
    7   HG21  THR 814          HG23      THR 814  45.134 -16.160 -16.626

  No H/Q in entry =           7
  In of MODEL   39
    1    H    MET 815           H        MET 815  42.929 -17.356 -15.286
    2    HA   MET 815           HA       MET 815  41.452 -15.572 -17.093
    3    HB2  MET 815           HB2      MET 815  40.407 -16.577 -14.453
    4    HB3  MET 815           HB3      MET 815  39.559 -15.563 -15.611
    5    HG2  MET 815           HG2      MET 815  39.824 -17.573 -17.215
    6    HG3  MET 815           HG3      MET 815  40.270 -18.408 -15.737
    7    HE3  MET 815           HE1      MET 815  37.927 -19.080 -17.747
    8    HE2  MET 815           HE2      MET 815  36.743 -19.715 -16.592
    9    HE1  MET 815           HE3      MET 815  38.464 -20.094 -16.420

  No H/Q in entry =           9
  In of MODEL   39
    1    H    SER 816           H        SER 816  41.107 -13.547 -16.239
    2    HA   SER 816           HA       SER 816  42.987 -12.680 -14.272
    3    HB2  SER 816           HB2      SER 816  40.656 -11.220 -15.558
    4    HB3  SER 816           HB3      SER 816  41.939 -10.478 -14.596
    5    HG   SER 816           HG       SER 816  42.506 -12.024 -16.890

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLU 817           H        GLU 817  42.353 -11.824 -12.273
    2    HA   GLU 817           HA       GLU 817  40.876 -13.451 -10.678
    3    HB2  GLU 817           HB2      GLU 817  42.641 -11.760 -10.124
    4    HB3  GLU 817           HB3      GLU 817  41.395 -10.543 -10.300
    5    HG2  GLU 817           HG2      GLU 817  40.265 -11.251  -8.393
    6    HG3  GLU 817           HG3      GLU 817  41.176 -12.761  -8.318

  No H/Q in entry =           6
  In of MODEL   39
    1    H    CYS 818           H        CYS 818  39.856 -10.282 -11.931
    2    HA   CYS 818           HA       CYS 818  37.305 -10.451 -10.756
    3    HB2  CYS 818           HB2      CYS 818  36.644  -8.559 -12.227
    4    HB3  CYS 818           HB3      CYS 818  38.171  -8.292 -11.393

  No H/Q in entry =           4
  In of MODEL   39
    1    H    GLU 819           H        GLU 819  38.524 -11.830 -13.659
    2    HA   GLU 819           HA       GLU 819  36.047 -12.129 -15.061
    3    HB2  GLU 819           HB2      GLU 819  38.212 -12.042 -16.228
    4    HB3  GLU 819           HB3      GLU 819  38.707 -13.511 -15.409
    5    HG2  GLU 819           HG2      GLU 819  37.168 -14.814 -16.623
    6    HG3  GLU 819           HG3      GLU 819  36.342 -13.386 -17.252

  No H/Q in entry =           6
  In of MODEL   39
    1    H    ALA 820           H        ALA 820  38.265 -14.414 -13.512
    2    HA   ALA 820           HA       ALA 820  36.661 -16.630 -13.565
    3    HB1  ALA 820           HB1      ALA 820  38.988 -16.722 -12.945
    4    HB2  ALA 820           HB2      ALA 820  38.011 -17.461 -11.672
    5    HB3  ALA 820           HB3      ALA 820  38.653 -15.833 -11.460

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLY 821           H        GLY 821  36.853 -13.977 -11.263
    2    HA3  GLY 821           HA2      GLY 821  35.151 -14.992  -9.252
    3    HA2  GLY 821           HA3      GLY 821  35.573 -13.301  -9.495

  No H/Q in entry =           3
  In of MODEL   39
    1    H    ALA 822           H        ALA 822  34.520 -12.798 -12.001
    2    HA   ALA 822           HA       ALA 822  31.811 -12.399 -11.387
    3    HB1  ALA 822           HB1      ALA 822  33.091 -12.252 -14.122
    4    HB2  ALA 822           HB2      ALA 822  33.049 -10.949 -12.929
    5    HB3  ALA 822           HB3      ALA 822  31.547 -11.560 -13.611

  No H/Q in entry =           5
  In of MODEL   39
    1    H    LEU 823           H        LEU 823  33.470 -14.719 -13.405
    2    HA   LEU 823           HA       LEU 823  31.184 -15.947 -14.449
    3    HB2  LEU 823           HB2      LEU 823  33.931 -17.090 -13.956
    4    HB3  LEU 823           HB3      LEU 823  32.687 -17.892 -14.899
    5    HG   LEU 823           HG       LEU 823  33.910 -15.209 -15.579
    6   HD11  LEU 823          HD11      LEU 823  34.405 -17.905 -16.821
    7   HD13  LEU 823          HD12      LEU 823  35.537 -16.960 -15.836
    8   HD12  LEU 823          HD13      LEU 823  35.018 -16.351 -17.398
    9   HD22  LEU 823          HD21      LEU 823  31.658 -15.364 -16.409
   10   HD21  LEU 823          HD22      LEU 823  31.965 -16.963 -17.074
   11   HD23  LEU 823          HD23      LEU 823  32.784 -15.549 -17.755

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ARG 824           H        ARG 824  33.034 -16.577 -11.518
    2    HA   ARG 824           HA       ARG 824  31.570 -18.858 -10.727
    3    HB2  ARG 824           HB2      ARG 824  33.865 -18.141  -9.877
    4    HB3  ARG 824           HB3      ARG 824  33.037 -16.952  -8.889
    5    HG2  ARG 824           HG2      ARG 824  32.056 -18.567  -7.530
    6    HG3  ARG 824           HG3      ARG 824  32.321 -19.857  -8.699
    7    HD2  ARG 824           HD2      ARG 824  33.913 -20.230  -7.002
    8    HD3  ARG 824           HD3      ARG 824  34.789 -19.513  -8.328
    9    HE   ARG 824           HE       ARG 824  34.110 -17.395  -6.736
   10   HH11  ARG 824          HH11      ARG 824  36.056 -20.352  -6.390
   11   HH12  ARG 824          HH12      ARG 824  37.007 -19.754  -5.107
   12   HH21  ARG 824          HH21      ARG 824  35.502 -16.580  -4.904
   13   HH22  ARG 824          HH22      ARG 824  36.680 -17.644  -4.271

  No H/Q in entry =          13
  In of MODEL   39
    1    H    CYS 825           H        CYS 825  31.187 -15.477 -10.132
    2    HA   CYS 825           HA       CYS 825  29.046 -15.751  -8.320
    3    HB2  CYS 825           HB2      CYS 825  30.462 -13.621  -9.668
    4    HB3  CYS 825           HB3      CYS 825  28.865 -13.168  -9.174

  No H/Q in entry =           4
  In of MODEL   39
    1    H    ARG 826           H        ARG 826  29.133 -15.169 -11.807
    2    HA   ARG 826           HA       ARG 826  26.340 -14.607 -11.921
    3    HB2  ARG 826           HB2      ARG 826  26.572 -14.687 -14.349
    4    HB3  ARG 826           HB3      ARG 826  27.793 -13.643 -13.608
    5    HG2  ARG 826           HG2      ARG 826  29.389 -15.468 -13.873
    6    HG3  ARG 826           HG3      ARG 826  28.152 -16.427 -14.683
    7    HD2  ARG 826           HD2      ARG 826  29.322 -13.790 -15.585
    8    HD3  ARG 826           HD3      ARG 826  29.516 -15.360 -16.361
    9    HE   ARG 826           HE       ARG 826  26.952 -15.191 -16.553
   10   HH11  ARG 826          HH11      ARG 826  29.306 -12.579 -17.023
   11   HH12  ARG 826          HH12      ARG 826  28.360 -11.624 -18.032
   12   HH21  ARG 826          HH21      ARG 826  25.564 -13.893 -17.943
   13   HH22  ARG 826          HH22      ARG 826  26.103 -12.414 -18.600

  No H/Q in entry =          13
  In of MODEL   39
    1    H    GLY 827           H        GLY 827  28.155 -17.540 -12.077
    2    HA3  GLY 827           HA2      GLY 827  26.495 -19.430 -11.541
    3    HA2  GLY 827           HA3      GLY 827  25.687 -18.829 -12.986

  No H/Q in entry =           3
  In of MODEL   39
    1    H    GLN 828           H        GLN 828  28.467 -18.343 -14.110
    2    HA   GLN 828           HA       GLN 828  28.665 -20.586 -15.744
    3    HB2  GLN 828           HB2      GLN 828  29.760 -18.470 -16.299
    4    HB3  GLN 828           HB3      GLN 828  30.852 -18.666 -14.940
    5    HG2  GLN 828           HG2      GLN 828  31.971 -19.215 -17.032
    6    HG3  GLN 828           HG3      GLN 828  31.835 -20.627 -15.994
    7   HE21  GLN 828          HE21      GLN 828  29.151 -19.360 -17.938
    8   HE22  GLN 828          HE22      GLN 828  29.118 -20.698 -19.013

  No H/Q in entry =           8
  In of MODEL   39
    1    H    SER 829           H        SER 829  29.690 -22.520 -15.640
    2    HA   SER 829           HA       SER 829  30.452 -23.442 -13.029
    3    HB2  SER 829           HB2      SER 829  30.307 -24.907 -15.668
    4    HB3  SER 829           HB3      SER 829  30.533 -25.651 -14.084
    5    HG   SER 829           HG       SER 829  28.468 -24.346 -13.631

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ILE 830           H        ILE 830  32.404 -23.030 -12.345
    2    HA   ILE 830           HA       ILE 830  34.699 -23.650 -14.035
    3    HB   ILE 830           HB       ILE 830  35.913 -21.692 -13.460
    4   HG12  ILE 830          HG12      ILE 830  35.122 -21.389 -11.146
    5   HG13  ILE 830          HG13      ILE 830  35.148 -19.853 -11.970
    6   HG22  ILE 830          HG21      ILE 830  33.210 -20.775 -14.356
    7   HG21  ILE 830          HG22      ILE 830  34.550 -21.315 -15.372
    8   HG23  ILE 830          HG23      ILE 830  34.689 -19.818 -14.455
    9   HD11  ILE 830          HD11      ILE 830  32.715 -20.048 -12.290
   10   HD13  ILE 830          HD12      ILE 830  33.230 -20.046 -10.599
   11   HD12  ILE 830          HD13      ILE 830  32.756 -21.554 -11.367

  No H/Q in entry =          11
  In of MODEL   39
    1    H    SER 831           H        SER 831  36.542 -24.115 -12.788
    2    HA   SER 831           HA       SER 831  36.109 -24.388  -9.914
    3    HB2  SER 831           HB2      SER 831  37.273 -26.316 -11.874
    4    HB3  SER 831           HB3      SER 831  37.387 -26.489 -10.130
    5    HG   SER 831           HG       SER 831  34.987 -26.399 -10.205

  No H/Q in entry =           5
  In of MODEL   39
    1    H    VAL 832           H        VAL 832  37.585 -22.927  -9.064
    2    HA   VAL 832           HA       VAL 832  39.947 -22.224 -10.491
    3    HB   VAL 832           HB       VAL 832  39.285 -21.716  -7.562
    4   HG12  VAL 832          HG11      VAL 832  41.359 -20.417  -9.339
    5   HG11  VAL 832          HG12      VAL 832  41.683 -21.531  -8.015
    6   HG13  VAL 832          HG13      VAL 832  40.987 -19.944  -7.678
    7   HG21  VAL 832          HG21      VAL 832  37.645 -20.705  -9.076
    8   HG23  VAL 832          HG22      VAL 832  38.945 -19.922  -9.971
    9   HG22  VAL 832          HG23      VAL 832  38.628 -19.468  -8.297

  No H/Q in entry =           9
  In of MODEL   39
    1    H    THR 833           H        THR 833  41.432 -23.732 -10.845
    2    HA   THR 833           HA       THR 833  41.821 -25.821  -8.938
    3    HB   THR 833           HB       THR 833  43.425 -26.635 -10.724
    4    HG1  THR 833           HG1      THR 833  43.439 -25.599 -12.630
    5   HG21  THR 833          HG21      THR 833  40.544 -26.134 -11.483
    6   HG23  THR 833          HG22      THR 833  41.141 -27.496 -10.536
    7   HG22  THR 833          HG23      THR 833  41.596 -27.328 -12.235

  No H/Q in entry =           7
  In of MODEL   39
    1    H    SER 834           H        SER 834  43.498 -22.994 -10.115
    2    HA   SER 834           HA       SER 834  45.358 -23.212  -7.918
    3    HB2  SER 834           HB2      SER 834  46.234 -23.191 -10.813
    4    HB3  SER 834           HB3      SER 834  47.329 -22.925  -9.463
    5    HG   SER 834           HG       SER 834  45.765 -25.113  -9.133

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ILE 835           H        ILE 835  46.201 -21.218  -7.301
    2    HA   ILE 835           HA       ILE 835  44.723 -18.905  -8.366
    3    HB   ILE 835           HB       ILE 835  45.301 -17.709  -6.472
    4   HG12  ILE 835          HG12      ILE 835  47.750 -18.108  -6.386
    5   HG13  ILE 835          HG13      ILE 835  47.013 -18.248  -4.800
    6   HG23  ILE 835          HG21      ILE 835  44.729 -19.089  -4.552
    7   HG22  ILE 835          HG22      ILE 835  44.940 -20.522  -5.560
    8   HG21  ILE 835          HG23      ILE 835  43.695 -19.337  -5.959
    9   HD13  ILE 835          HD11      ILE 835  48.692 -19.926  -5.103
   10   HD12  ILE 835          HD12      ILE 835  47.906 -20.456  -6.595
   11   HD11  ILE 835          HD13      ILE 835  47.092 -20.686  -5.045

  No H/Q in entry =          11
  In of MODEL   39
    1    H    ARG 836           H        ARG 836  47.331 -20.454  -9.276
    2    HA   ARG 836           HA       ARG 836  48.881 -18.093 -10.008
    3    HB2  ARG 836           HB2      ARG 836  49.595 -21.018 -10.266
    4    HB3  ARG 836           HB3      ARG 836  50.652 -19.657 -10.614
    5    HG2  ARG 836           HG2      ARG 836  50.269 -18.975  -8.186
    6    HG3  ARG 836           HG3      ARG 836  49.632 -20.600  -7.985
    7    HD2  ARG 836           HD2      ARG 836  52.362 -19.907  -9.014
    8    HD3  ARG 836           HD3      ARG 836  51.939 -20.441  -7.387
    9    HE   ARG 836           HE       ARG 836  51.007 -22.462  -8.826
   10   HH11  ARG 836          HH11      ARG 836  54.111 -20.790  -9.087
   11   HH12  ARG 836          HH12      ARG 836  54.961 -22.142  -9.668
   12   HH21  ARG 836          HH21      ARG 836  52.179 -24.343  -9.604
   13   HH22  ARG 836          HH22      ARG 836  53.832 -24.186  -9.980

  No H/Q in entry =          13
  In of MODEL   39
    1    HA   PRO 837           HA       PRO 837  47.154 -18.439 -14.117
    2    HB2  PRO 837           HB2      PRO 837  49.234 -17.627 -15.684
    3    HB3  PRO 837           HB3      PRO 837  48.266 -16.515 -14.711
    4    HG2  PRO 837           HG2      PRO 837  50.926 -17.745 -14.090
    5    HG3  PRO 837           HG3      PRO 837  50.402 -16.064 -13.879
    6    HD2  PRO 837           HD2      PRO 837  50.481 -17.771 -11.816
    7    HD3  PRO 837           HD3      PRO 837  49.202 -16.547 -11.956

  No H/Q in entry =           7
  In of MODEL   39
    1    H    CYS 838           H        CYS 838  47.207 -19.653 -16.096
    2    HA   CYS 838           HA       CYS 838  48.835 -22.081 -15.972
    3    HB2  CYS 838           HB2      CYS 838  46.283 -22.280 -15.998
    4    HB3  CYS 838           HB3      CYS 838  46.300 -21.462 -17.543

  No H/Q in entry =           4
  In of MODEL   39
    1    H    ALA 839           H        ALA 839  48.869 -22.816 -18.563
    2    HA   ALA 839           HA       ALA 839  49.758 -20.513 -20.161
    3    HB1  ALA 839           HB1      ALA 839  51.125 -23.208 -19.919
    4    HB2  ALA 839           HB2      ALA 839  51.744 -21.680 -19.295
    5    HB3  ALA 839           HB3      ALA 839  51.577 -21.921 -21.036

  No H/Q in entry =           5
  In of MODEL   39
    1    H    ALA 840           H        ALA 840  47.265 -21.720 -20.045
    2    HA   ALA 840           HA       ALA 840  46.798 -23.761 -21.955
    3    HB1  ALA 840           HB1      ALA 840  44.462 -23.125 -21.711
    4    HB3  ALA 840           HB2      ALA 840  44.956 -21.637 -20.903
    5    HB2  ALA 840           HB3      ALA 840  45.256 -23.186 -20.131

  No H/Q in entry =           5
  In of MODEL   39
    1    H    GLU 841           H        GLU 841  46.926 -20.408 -21.940
    2    HA   GLU 841           HA       GLU 841  46.269 -20.110 -24.771
    3    HB2  GLU 841           HB2      GLU 841  46.144 -17.699 -24.105
    4    HB3  GLU 841           HB3      GLU 841  44.910 -18.764 -23.416
    5    HG2  GLU 841           HG2      GLU 841  47.396 -18.081 -21.924
    6    HG3  GLU 841           HG3      GLU 841  46.010 -16.966 -21.877

  No H/Q in entry =           6
  In of MODEL   39
    1    H    THR 842           H        THR 842  48.798 -21.037 -23.572
    2    HA   THR 842           HA       THR 842  50.974 -20.815 -23.548
    3    HB   THR 842           HB       THR 842  52.066 -19.757 -25.560
    4    HG1  THR 842           HG1      THR 842  49.677 -18.650 -25.822
    5   HG23  THR 842          HG21      THR 842  51.242 -21.465 -27.148
    6   HG22  THR 842          HG22      THR 842  49.870 -21.764 -26.082
    7   HG21  THR 842          HG23      THR 842  51.504 -22.129 -25.535

  No H/Q in entry =           7
  In of MODEL   39
    1    H    GLN 843           H        GLN 843  51.255 -19.799 -21.664
    2    HA   GLN 843           HA       GLN 843  51.674 -16.909 -21.736
    3    HB2  GLN 843           HB2      GLN 843  49.701 -17.523 -20.399
    4    HB3  GLN 843           HB3      GLN 843  50.666 -18.659 -19.476
    5    HG2  GLN 843           HG2      GLN 843  50.329 -16.682 -18.170
    6    HG3  GLN 843           HG3      GLN 843  52.024 -16.770 -18.633
    7   HE21  GLN 843          HE21      GLN 843  52.807 -15.325 -20.186
    8   HE22  GLN 843          HE22      GLN 843  51.953 -13.873 -20.593

  No H/Q in entry =           8
  In of MODEL   40
    1    H1   GLY 689           H3       GLY 689  68.450  16.382  -4.123
    2    H2   GLY 689           H2       GLY 689  67.197  17.413  -3.671
    3    H3   GLY 689           H1       GLY 689  67.866  16.324  -2.546
    4    HA2  GLY 689           HA2      GLY 689  66.390  15.637  -4.991
    5    HA3  GLY 689           HA3      GLY 689  65.767  15.474  -3.349

  No H/Q in entry =           5
  In of MODEL   40
    1    H    SER 690           H        SER 690  67.206  14.083  -1.886
    2    HA   SER 690           HA       SER 690  68.734  12.067  -3.251
    3    HB2  SER 690           HB2      SER 690  67.905  12.315  -0.353
    4    HB3  SER 690           HB3      SER 690  69.160  11.243  -0.987
    5    HG   SER 690           HG       SER 690  70.206  13.142  -1.743

  No H/Q in entry =           5
  In of MODEL   40
    1    H    HIS 691           H        HIS 691  67.516  10.674  -4.392
    2    HA   HIS 691           HA       HIS 691  64.873   9.943  -3.462
    3    HB2  HIS 691           HB2      HIS 691  66.367   9.078  -5.957
    4    HB3  HIS 691           HB3      HIS 691  64.716   8.630  -5.575
    5    HD1  HIS 691           HD1      HIS 691  62.890  10.418  -5.986
    6    HD2  HIS 691           HD2      HIS 691  66.734  11.693  -6.898
    7    HE1  HIS 691           HE1      HIS 691  62.607  12.560  -7.227
    8    HE2  HIS 691           HE2      HIS 691  64.895  13.055  -8.084

  No H/Q in entry =           8
  In of MODEL   40
    1    H    MET 692           H        MET 692  64.608   8.314  -2.094
    2    HA   MET 692           HA       MET 692  66.666   6.413  -1.534
    3    HB2  MET 692           HB2      MET 692  64.992   6.985   0.200
    4    HB3  MET 692           HB3      MET 692  63.717   6.305  -0.800
    5    HG2  MET 692           HG2      MET 692  64.609   4.091  -0.551
    6    HG3  MET 692           HG3      MET 692  66.036   4.706   0.270
    7    HE2  MET 692           HE1      MET 692  61.788   4.773   2.124
    8    HE1  MET 692           HE2      MET 692  62.145   4.127   0.520
    9    HE3  MET 692           HE3      MET 692  62.285   5.860   0.828

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ASN 693           H        ASN 693  63.766   6.417  -3.462
    2    HA   ASN 693           HA       ASN 693  64.899   4.155  -4.927
    3    HB2  ASN 693           HB2      ASN 693  62.803   3.506  -3.655
    4    HB3  ASN 693           HB3      ASN 693  61.942   4.763  -4.521
    5   HD21  ASN 693          HD21      ASN 693  63.078   4.201  -7.163
    6   HD22  ASN 693          HD22      ASN 693  62.475   2.674  -7.631

  No H/Q in entry =           6
  In of MODEL   40
    1    HA   PRO 694           HA       PRO 694  64.570   7.606  -7.816
    2    HB2  PRO 694           HB2      PRO 694  65.940   5.958  -9.771
    3    HB3  PRO 694           HB3      PRO 694  66.549   7.373  -8.914
    4    HG2  PRO 694           HG2      PRO 694  67.483   4.850  -8.484
    5    HG3  PRO 694           HG3      PRO 694  67.496   6.121  -7.247
    6    HD2  PRO 694           HD2      PRO 694  65.588   3.849  -7.614
    7    HD3  PRO 694           HD3      PRO 694  66.318   4.514  -6.131

  No H/Q in entry =           7
  In of MODEL   40
    1    H    LEU 695           H        LEU 695  62.770   7.950  -8.910
    2    HA   LEU 695           HA       LEU 695  61.830   5.856 -10.723
    3    HB2  LEU 695           HB2      LEU 695  60.412   6.194  -8.575
    4    HB3  LEU 695           HB3      LEU 695  59.995   7.755  -9.224
    5    HG   LEU 695           HG       LEU 695  58.194   6.138  -9.543
    6   HD12  LEU 695          HD11      LEU 695  57.763   6.372 -11.922
    7   HD11  LEU 695          HD12      LEU 695  59.428   6.893 -12.173
    8   HD13  LEU 695          HD13      LEU 695  58.332   7.875 -11.200
    9   HD22  LEU 695          HD21      LEU 695  58.432   4.216 -11.029
   10   HD21  LEU 695          HD22      LEU 695  59.504   4.097  -9.633
   11   HD23  LEU 695          HD23      LEU 695  60.151   4.561 -11.206

  No H/Q in entry =          11
  In of MODEL   40
    1    H    THR 696           H        THR 696  62.953   6.841 -12.353
    2    HA   THR 696           HA       THR 696  62.325   9.587 -13.007
    3    HB   THR 696           HB       THR 696  64.143   9.138 -14.761
    4    HG1  THR 696           HG1      THR 696  65.337   7.313 -14.503
    5   HG22  THR 696          HG21      THR 696  64.878   8.809 -11.850
    6   HG21  THR 696          HG22      THR 696  64.564  10.353 -12.648
    7   HG23  THR 696          HG23      THR 696  65.951   9.377 -13.132

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLN 697           H        GLN 697  63.067   6.972 -15.170
    2    HA   GLN 697           HA       GLN 697  60.406   7.094 -16.410
    3    HB2  GLN 697           HB2      GLN 697  63.076   6.908 -17.852
    4    HB3  GLN 697           HB3      GLN 697  61.528   6.649 -18.632
    5    HG2  GLN 697           HG2      GLN 697  62.248   8.814 -19.215
    6    HG3  GLN 697           HG3      GLN 697  60.966   9.032 -18.033
    7   HE21  GLN 697          HE21      GLN 697  61.668  11.045 -17.471
    8   HE22  GLN 697          HE22      GLN 697  63.101  11.315 -16.544

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ALA 698           H        ALA 698  61.891   5.407 -14.469
    2    HA   ALA 698           HA       ALA 698  62.117   2.855 -15.898
    3    HB3  ALA 698           HB1      ALA 698  62.915   3.526 -13.066
    4    HB1  ALA 698           HB2      ALA 698  64.017   3.553 -14.436
    5    HB2  ALA 698           HB3      ALA 698  63.266   2.034 -13.938

  No H/Q in entry =           5
  In of MODEL   40
    1    H    VAL 699           H        VAL 699  60.240   2.156 -16.258
    2    HA   VAL 699           HA       VAL 699  58.301   2.110 -14.223
    3    HB   VAL 699           HB       VAL 699  57.043   0.843 -15.852
    4   HG13  VAL 699          HG11      VAL 699  56.767   2.660 -17.540
    5   HG12  VAL 699          HG12      VAL 699  58.268   3.374 -16.954
    6   HG11  VAL 699          HG13      VAL 699  56.870   3.269 -15.888
    7   HG21  VAL 699          HG21      VAL 699  58.782  -0.350 -17.002
    8   HG23  VAL 699          HG22      VAL 699  59.431   1.155 -17.663
    9   HG22  VAL 699          HG23      VAL 699  57.846   0.571 -18.180

  No H/Q in entry =           9
  In of MODEL   40
    1    HA   PRO 700           HA       PRO 700  59.858  -1.675 -12.591
    2    HB2  PRO 700           HB2      PRO 700  57.774  -2.417 -11.082
    3    HB3  PRO 700           HB3      PRO 700  58.777  -1.026 -10.662
    4    HG2  PRO 700           HG2      PRO 700  56.083  -1.099 -11.944
    5    HG3  PRO 700           HG3      PRO 700  56.718   0.021 -10.725
    6    HD2  PRO 700           HD2      PRO 700  56.556   0.592 -13.412
    7    HD3  PRO 700           HD3      PRO 700  57.698   1.359 -12.289

  No H/Q in entry =           7
  In of MODEL   40
    1    H    LYS 701           H        LYS 701  59.792  -3.810 -12.877
    2    HA   LYS 701           HA       LYS 701  57.437  -4.852 -14.138
    3    HB2  LYS 701           HB2      LYS 701  58.790  -6.633 -15.288
    4    HB3  LYS 701           HB3      LYS 701  59.070  -5.019 -15.895
    5    HG2  LYS 701           HG2      LYS 701  60.895  -6.196 -13.856
    6    HG3  LYS 701           HG3      LYS 701  61.032  -6.661 -15.560
    7    HD2  LYS 701           HD2      LYS 701  61.328  -4.304 -16.132
    8    HD3  LYS 701           HD3      LYS 701  61.207  -3.867 -14.426
    9    HE2  LYS 701           HE2      LYS 701  63.198  -5.167 -13.939
   10    HE3  LYS 701           HE3      LYS 701  63.293  -5.699 -15.617
   11    HZ1  LYS 701           HZ1      LYS 701  63.581  -3.380 -16.263
   12    HZ3  LYS 701           HZ2      LYS 701  64.816  -3.893 -15.259
   13    HZ2  LYS 701           HZ3      LYS 701  63.583  -2.911 -14.649

  No H/Q in entry =          13
  In of MODEL   40
    1    H    CYS 702           H        CYS 702  56.538  -5.490 -12.295
    2    HA   CYS 702           HA       CYS 702  58.038  -7.409 -10.660
    3    HB2  CYS 702           HB2      CYS 702  55.920  -5.506  -9.593
    4    HB3  CYS 702           HB3      CYS 702  57.023  -6.526  -8.714

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLN 703           H        GLN 703  56.673  -9.090  -9.709
    2    HA   GLN 703           HA       GLN 703  54.468  -9.753 -11.374
    3    HB2  GLN 703           HB2      GLN 703  55.643 -10.960  -8.898
    4    HB3  GLN 703           HB3      GLN 703  54.150 -11.562  -9.605
    5    HG2  GLN 703           HG2      GLN 703  56.784 -11.385 -11.049
    6    HG3  GLN 703           HG3      GLN 703  56.135 -12.842 -10.291
    7   HE21  GLN 703          HE21      GLN 703  56.785 -12.323 -13.090
    8   HE22  GLN 703          HE22      GLN 703  55.342 -12.628 -13.968

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ARG 704           H        ARG 704  52.467 -10.351 -10.386
    2    HA   ARG 704           HA       ARG 704  50.992  -8.121  -9.626
    3    HB2  ARG 704           HB2      ARG 704  50.388 -11.048  -9.261
    4    HB3  ARG 704           HB3      ARG 704  49.189  -9.762  -9.158
    5    HG2  ARG 704           HG2      ARG 704  49.320  -9.283 -11.402
    6    HG3  ARG 704           HG3      ARG 704  50.888 -10.079 -11.594
    7    HD2  ARG 704           HD2      ARG 704  49.812 -12.242 -11.267
    8    HD3  ARG 704           HD3      ARG 704  48.259 -11.449 -11.030
    9    HE   ARG 704           HE       ARG 704  48.251 -10.831 -13.310
   10   HH11  ARG 704          HH11      ARG 704  51.108 -12.883 -12.637
   11   HH12  ARG 704          HH12      ARG 704  51.104 -13.569 -14.200
   12   HH21  ARG 704          HH21      ARG 704  48.352 -11.818 -15.456
   13   HH22  ARG 704          HH22      ARG 704  49.538 -12.978 -15.800

  No H/Q in entry =          13
  In of MODEL   40
    1    H    TRP 705           H        TRP 705  52.583 -10.457  -7.619
    2    HA   TRP 705           HA       TRP 705  51.372  -9.422  -5.166
    3    HB2  TRP 705           HB2      TRP 705  52.494 -11.415  -4.138
    4    HB3  TRP 705           HB3      TRP 705  51.274 -11.784  -5.348
    5    HD1  TRP 705           HD1      TRP 705  55.011 -12.043  -4.694
    6    HE1  TRP 705           HE1      TRP 705  56.071 -13.559  -6.464
    7    HE3  TRP 705           HE3      TRP 705  50.995 -12.593  -7.805
    8    HZ2  TRP 705           HZ2      TRP 705  55.310 -14.846  -8.861
    9    HZ3  TRP 705           HZ3      TRP 705  51.251 -13.979  -9.820
   10    HH2  TRP 705           HH2      TRP 705  53.361 -15.088 -10.330

  No H/Q in entry =          10
  In of MODEL   40
    1    H    GLU 706           H        GLU 706  53.772  -8.399  -7.018
    2    HA   GLU 706           HA       GLU 706  55.573  -7.913  -4.776
    3    HB2  GLU 706           HB2      GLU 706  56.335  -8.169  -7.711
    4    HB3  GLU 706           HB3      GLU 706  57.405  -7.744  -6.393
    5    HG2  GLU 706           HG2      GLU 706  57.061  -9.915  -5.387
    6    HG3  GLU 706           HG3      GLU 706  55.944 -10.343  -6.678

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LYS 707           H        LYS 707  57.007  -5.956  -5.349
    2    HA   LYS 707           HA       LYS 707  55.683  -3.825  -6.757
    3    HB2  LYS 707           HB2      LYS 707  55.603  -2.308  -4.819
    4    HB3  LYS 707           HB3      LYS 707  54.536  -3.686  -4.590
    5    HG2  LYS 707           HG2      LYS 707  55.998  -4.681  -3.014
    6    HG3  LYS 707           HG3      LYS 707  57.311  -3.582  -3.429
    7    HD2  LYS 707           HD2      LYS 707  56.258  -3.001  -1.283
    8    HD3  LYS 707           HD3      LYS 707  56.081  -1.713  -2.470
    9    HE2  LYS 707           HE2      LYS 707  53.801  -2.431  -2.923
   10    HE3  LYS 707           HE3      LYS 707  53.976  -3.762  -1.784
   11    HZ3  LYS 707           HZ1      LYS 707  52.842  -1.983  -0.735
   12    HZ2  LYS 707           HZ2      LYS 707  54.034  -0.873  -1.158
   13    HZ1  LYS 707           HZ3      LYS 707  54.377  -2.096  -0.050

  No H/Q in entry =          13
  In of MODEL   40
    1    H    LEU 708           H        LEU 708  57.080  -1.934  -6.787
    2    HA   LEU 708           HA       LEU 708  59.906  -2.645  -6.488
    3    HB2  LEU 708           HB2      LEU 708  59.152  -1.795  -8.676
    4    HB3  LEU 708           HB3      LEU 708  58.550  -0.339  -7.912
    5    HG   LEU 708           HG       LEU 708  60.942   0.141  -7.220
    6   HD13  LEU 708          HD11      LEU 708  61.876  -2.066  -7.470
    7   HD12  LEU 708          HD12      LEU 708  62.718  -0.919  -8.510
    8   HD11  LEU 708          HD13      LEU 708  61.539  -2.036  -9.201
    9   HD22  LEU 708          HD21      LEU 708  61.559   1.074  -9.372
   10   HD21  LEU 708          HD22      LEU 708  59.832   1.300  -9.091
   11   HD23  LEU 708          HD23      LEU 708  60.397   0.034 -10.184

  No H/Q in entry =          11
  In of MODEL   40
    1    H    GLN 709           H        GLN 709  60.839  -1.956  -4.595
    2    HA   GLN 709           HA       GLN 709  60.383   0.790  -3.770
    3    HB2  GLN 709           HB2      GLN 709  59.858   0.337  -1.500
    4    HB3  GLN 709           HB3      GLN 709  58.760  -0.691  -2.407
    5    HG2  GLN 709           HG2      GLN 709  60.166  -2.615  -1.977
    6    HG3  GLN 709           HG3      GLN 709  61.358  -1.594  -1.219
    7   HE21  GLN 709          HE21      GLN 709  61.264  -2.726   0.635
    8   HE22  GLN 709          HE22      GLN 709  59.976  -2.594   1.777

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ASN 710           H        ASN 710  62.130   1.559  -2.599
    2    HA   ASN 710           HA       ASN 710  64.389   1.701  -2.024
    3    HB2  ASN 710           HB2      ASN 710  63.476  -0.166  -0.414
    4    HB3  ASN 710           HB3      ASN 710  64.137  -1.272  -1.574
    5   HD21  ASN 710          HD21      ASN 710  65.358  -2.094   0.076
    6   HD22  ASN 710          HD22      ASN 710  66.810  -1.306   0.569

  No H/Q in entry =           6
  In of MODEL   40
    1    H    SER 711           H        SER 711  63.541   1.138  -4.696
    2    HA   SER 711           HA       SER 711  64.278   0.824  -6.703
    3    HB2  SER 711           HB2      SER 711  66.757   1.079  -7.178
    4    HB3  SER 711           HB3      SER 711  66.033   2.294  -6.122
    5    HG   SER 711           HG       SER 711  66.980   0.364  -4.586

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ARG 712           H        ARG 712  63.731  -1.519  -4.979
    2    HA   ARG 712           HA       ARG 712  64.732  -3.464  -6.885
    3    HB2  ARG 712           HB2      ARG 712  65.153  -5.079  -5.098
    4    HB3  ARG 712           HB3      ARG 712  66.202  -3.674  -4.989
    5    HG2  ARG 712           HG2      ARG 712  64.839  -2.785  -3.183
    6    HG3  ARG 712           HG3      ARG 712  63.741  -4.153  -3.329
    7    HD2  ARG 712           HD2      ARG 712  65.638  -5.680  -2.845
    8    HD3  ARG 712           HD3      ARG 712  66.700  -4.290  -2.688
    9    HE   ARG 712           HE       ARG 712  64.425  -4.404  -0.891
   10   HH11  ARG 712          HH11      ARG 712  67.924  -4.783  -1.338
   11   HH12  ARG 712          HH12      ARG 712  68.256  -5.114   0.287
   12   HH21  ARG 712          HH21      ARG 712  64.900  -4.861   1.400
   13   HH22  ARG 712          HH22      ARG 712  66.504  -5.170   1.871

  No H/Q in entry =          13
  In of MODEL   40
    1    H    CYS 713           H        CYS 713  63.499  -5.523  -6.733
    2    HA   CYS 713           HA       CYS 713  60.686  -4.887  -6.319
    3    HB2  CYS 713           HB2      CYS 713  61.247  -5.663  -8.569
    4    HB3  CYS 713           HB3      CYS 713  62.007  -7.112  -7.902

  No H/Q in entry =           4
  In of MODEL   40
    1    H    VAL 714           H        VAL 714  59.737  -5.624  -4.635
    2    HA   VAL 714           HA       VAL 714  60.654  -8.091  -3.351
    3    HB   VAL 714           HB       VAL 714  60.149  -7.123  -1.129
    4   HG11  VAL 714          HG11      VAL 714  62.453  -7.047  -1.886
    5   HG13  VAL 714          HG12      VAL 714  62.082  -5.626  -0.906
    6   HG12  VAL 714          HG13      VAL 714  62.162  -5.492  -2.662
    7   HG23  VAL 714          HG21      VAL 714  59.837  -4.682  -0.871
    8   HG22  VAL 714          HG22      VAL 714  58.518  -5.445  -1.760
    9   HG21  VAL 714          HG23      VAL 714  59.753  -4.537  -2.628

  No H/Q in entry =           9
  In of MODEL   40
    1    H    CYS 715           H        CYS 715  58.769  -8.660  -1.681
    2    HA   CYS 715           HA       CYS 715  56.413  -8.706  -3.329
    3    HB2  CYS 715           HB2      CYS 715  55.627 -10.257  -1.433
    4    HB3  CYS 715           HB3      CYS 715  56.933 -10.818  -2.473

  No H/Q in entry =           4
  In of MODEL   40
    1    H    LYS 716           H        LYS 716  54.390  -7.907  -2.672
    2    HA   LYS 716           HA       LYS 716  54.591  -5.544  -1.073
    3    HB2  LYS 716           HB2      LYS 716  52.114  -5.254  -1.555
    4    HB3  LYS 716           HB3      LYS 716  53.158  -5.320  -2.960
    5    HG2  LYS 716           HG2      LYS 716  52.415  -7.479  -3.535
    6    HG3  LYS 716           HG3      LYS 716  51.656  -7.713  -1.959
    7    HD2  LYS 716           HD2      LYS 716  50.005  -7.262  -3.753
    8    HD3  LYS 716           HD3      LYS 716  49.962  -6.062  -2.472
    9    HE2  LYS 716           HE2      LYS 716  49.738  -4.946  -4.591
   10    HE3  LYS 716           HE3      LYS 716  51.306  -4.547  -3.914
   11    HZ1  LYS 716           HZ1      LYS 716  50.880  -6.603  -6.053
   12    HZ3  LYS 716           HZ2      LYS 716  52.383  -5.968  -5.540
   13    HZ2  LYS 716           HZ3      LYS 716  51.285  -5.009  -6.295

  No H/Q in entry =          13
  In of MODEL   40
    1    H    MET 717           H        MET 717  52.331  -5.214   0.382
    2    HA   MET 717           HA       MET 717  52.922  -6.986   2.615
    3    HB2  MET 717           HB2      MET 717  51.025  -4.662   2.360
    4    HB3  MET 717           HB3      MET 717  51.320  -5.530   3.851
    5    HG2  MET 717           HG2      MET 717  53.428  -3.991   2.349
    6    HG3  MET 717           HG3      MET 717  52.415  -3.269   3.585
    7    HE2  MET 717           HE1      MET 717  55.974  -6.128   4.242
    8    HE1  MET 717           HE2      MET 717  55.497  -5.395   2.707
    9    HE3  MET 717           HE3      MET 717  54.594  -6.757   3.369

  No H/Q in entry =           9
  In of MODEL   40
    1    HA   PRO 718           HA       PRO 718  49.620  -9.762   1.666
    2    HB2  PRO 718           HB2      PRO 718  49.399 -11.036   4.041
    3    HB3  PRO 718           HB3      PRO 718  50.764 -11.291   2.952
    4    HG2  PRO 718           HG2      PRO 718  50.591  -9.535   5.374
    5    HG3  PRO 718           HG3      PRO 718  51.893 -10.635   4.889
    6    HD2  PRO 718           HD2      PRO 718  52.016  -7.967   4.483
    7    HD3  PRO 718           HD3      PRO 718  52.758  -9.134   3.369

  No H/Q in entry =           7
  In of MODEL   40
    1    H    TYR 719           H        TYR 719  49.258  -7.158   3.602
    2    HA   TYR 719           HA       TYR 719  46.382  -7.651   3.990
    3    HB2  TYR 719           HB2      TYR 719  46.450  -6.001   5.850
    4    HB3  TYR 719           HB3      TYR 719  47.489  -7.381   6.151
    5    HD1  TYR 719           HD1      TYR 719  47.337  -3.774   5.665
    6    HD2  TYR 719           HD2      TYR 719  49.978  -7.099   6.044
    7    HE1  TYR 719           HE1      TYR 719  49.200  -2.239   6.145
    8    HE2  TYR 719           HE2      TYR 719  51.838  -5.566   6.521
    9    HH   TYR 719           HH       TYR 719  52.463  -3.206   6.138

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLU 720           H        GLU 720  48.454  -6.223   2.005
    2    HA   GLU 720           HA       GLU 720  47.133  -3.627   1.707
    3    HB2  GLU 720           HB2      GLU 720  49.496  -3.598   1.873
    4    HB3  GLU 720           HB3      GLU 720  49.690  -4.878   0.683
    5    HG2  GLU 720           HG2      GLU 720  48.976  -3.270  -1.039
    6    HG3  GLU 720           HG3      GLU 720  48.842  -2.031   0.213

  No H/Q in entry =           6
  In of MODEL   40
    1    H    CYS 721           H        CYS 721  46.695  -6.637   0.755
    2    HA   CYS 721           HA       CYS 721  46.434  -6.781  -2.006
    3    HB2  CYS 721           HB2      CYS 721  44.753  -8.171   0.066
    4    HB3  CYS 721           HB3      CYS 721  45.118  -8.730  -1.560

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLY 722           H        GLY 722  45.201  -5.387  -3.192
    2    HA3  GLY 722           HA2      GLY 722  42.669  -4.390  -2.194
    3    HA2  GLY 722           HA3      GLY 722  43.407  -4.000  -3.745

  No H/Q in entry =           3
  In of MODEL   40
    1    HA   PRO 723           HA       PRO 723  40.653  -6.956  -5.577
    2    HB2  PRO 723           HB2      PRO 723  42.057  -7.693  -7.791
    3    HB3  PRO 723           HB3      PRO 723  41.237  -6.136  -7.658
    4    HG2  PRO 723           HG2      PRO 723  44.131  -6.786  -7.344
    5    HG3  PRO 723           HG3      PRO 723  43.369  -5.355  -8.059
    6    HD2  PRO 723           HD2      PRO 723  44.445  -5.443  -5.530
    7    HD3  PRO 723           HD3      PRO 723  43.181  -4.308  -6.038

  No H/Q in entry =           7
  In of MODEL   40
    1    H    SER 724           H        SER 724  40.340  -8.961  -4.724
    2    HA   SER 724           HA       SER 724  42.325 -11.047  -5.028
    3    HB2  SER 724           HB2      SER 724  41.534 -10.031  -2.282
    4    HB3  SER 724           HB3      SER 724  42.508 -11.464  -2.610
    5    HG   SER 724           HG       SER 724  43.467  -9.324  -3.878

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU 725           H        LEU 725  41.291 -12.696  -5.673
    2    HA   LEU 725           HA       LEU 725  38.509 -13.359  -5.183
    3    HB2  LEU 725           HB2      LEU 725  40.107 -13.809  -7.248
    4    HB3  LEU 725           HB3      LEU 725  40.631 -15.122  -6.240
    5    HG   LEU 725           HG       LEU 725  38.365 -15.987  -6.161
    6   HD12  LEU 725          HD11      LEU 725  36.762 -15.341  -7.865
    7   HD11  LEU 725          HD12      LEU 725  37.805 -13.990  -8.306
    8   HD13  LEU 725          HD13      LEU 725  37.082 -14.063  -6.697
    9   HD21  LEU 725          HD21      LEU 725  40.024 -16.957  -7.648
   10   HD23  LEU 725          HD22      LEU 725  39.592 -15.768  -8.889
   11   HD22  LEU 725          HD23      LEU 725  38.423 -16.989  -8.396

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ASP 726           H        ASP 726  37.801 -14.836  -3.636
    2    HA   ASP 726           HA       ASP 726  39.771 -15.783  -1.758
    3    HB2  ASP 726           HB2      ASP 726  36.763 -15.901  -1.665
    4    HB3  ASP 726           HB3      ASP 726  37.790 -16.658  -0.451

  No H/Q in entry =           4
  In of MODEL   40
    1    H    VAL 727           H        VAL 727  40.400 -17.693  -1.311
    2    HA   VAL 727           HA       VAL 727  39.390 -20.002  -2.819
    3    HB   VAL 727           HB       VAL 727  41.726 -20.719  -3.310
    4   HG13  VAL 727          HG11      VAL 727  42.120 -19.190  -5.195
    5   HG12  VAL 727          HG12      VAL 727  40.990 -18.035  -4.491
    6   HG11  VAL 727          HG13      VAL 727  40.412 -19.600  -5.052
    7   HG23  VAL 727          HG21      VAL 727  42.467 -17.932  -2.407
    8   HG22  VAL 727          HG22      VAL 727  43.559 -19.095  -3.162
    9   HG21  VAL 727          HG23      VAL 727  42.872 -19.432  -1.575

  No H/Q in entry =           9
  In of MODEL   40
    1    H    CYS 728           H        CYS 728  40.150 -22.106  -1.872
    2    HA   CYS 728           HA       CYS 728  40.446 -21.807   1.024
    3    HB2  CYS 728           HB2      CYS 728  39.747 -24.328  -0.505
    4    HB3  CYS 728           HB3      CYS 728  39.600 -24.020   1.211

  No H/Q in entry =           4
  In of MODEL   40
    1    H    ALA 729           H        ALA 729  42.317 -22.346   2.004
    2    HA   ALA 729           HA       ALA 729  44.263 -23.812   0.382
    3    HB1  ALA 729           HB1      ALA 729  44.792 -21.487   2.199
    4    HB3  ALA 729           HB2      ALA 729  44.772 -21.437   0.432
    5    HB2  ALA 729           HB3      ALA 729  45.990 -22.395   1.280

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLN 730           H        GLN 730  45.770 -24.971   1.547
    2    HA   GLN 730           HA       GLN 730  44.962 -25.594   4.288
    3    HB2  GLN 730           HB2      GLN 730  44.835 -27.527   2.709
    4    HB3  GLN 730           HB3      GLN 730  46.537 -27.314   2.375
    5    HG2  GLN 730           HG2      GLN 730  47.171 -27.884   4.550
    6    HG3  GLN 730           HG3      GLN 730  45.521 -27.846   5.142
    7   HE21  GLN 730          HE21      GLN 730  47.424 -29.924   5.280
    8   HE22  GLN 730          HE22      GLN 730  46.817 -31.322   4.493

  No H/Q in entry =           8
  In of MODEL   40
    1    H    ASP 731           H        ASP 731  46.236 -25.059   5.786
    2    HA   ASP 731           HA       ASP 731  48.688 -23.639   5.351
    3    HB2  ASP 731           HB2      ASP 731  47.114 -23.169   7.252
    4    HB3  ASP 731           HB3      ASP 731  47.510 -24.742   7.912

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLU 732           H        GLU 732  50.671 -24.497   5.110
    2    HA   GLU 732           HA       GLU 732  50.869 -27.316   5.226
    3    HB2  GLU 732           HB2      GLU 732  52.929 -25.243   4.444
    4    HB3  GLU 732           HB3      GLU 732  53.268 -26.971   4.486
    5    HG2  GLU 732           HG2      GLU 732  51.329 -27.307   2.922
    6    HG3  GLU 732           HG3      GLU 732  51.236 -25.550   2.814

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ARG 733           H        ARG 733  51.207 -25.146   7.760
    2    HA   ARG 733           HA       ARG 733  53.184 -26.795   9.074
    3    HB2  ARG 733           HB2      ARG 733  51.799 -24.256   9.876
    4    HB3  ARG 733           HB3      ARG 733  53.012 -25.096  10.809
    5    HG2  ARG 733           HG2      ARG 733  53.412 -23.774   8.130
    6    HG3  ARG 733           HG3      ARG 733  53.933 -23.141   9.687
    7    HD2  ARG 733           HD2      ARG 733  55.890 -24.085   8.807
    8    HD3  ARG 733           HD3      ARG 733  55.268 -25.329   9.878
    9    HE   ARG 733           HE       ARG 733  54.623 -26.601   8.014
   10   HH11  ARG 733          HH11      ARG 733  56.285 -23.608   7.096
   11   HH12  ARG 733          HH12      ARG 733  56.840 -24.194   5.615
   12   HH21  ARG 733          HH21      ARG 733  55.343 -27.403   5.910
   13   HH22  ARG 733          HH22      ARG 733  56.267 -26.371   4.908

  No H/Q in entry =          13
  In of MODEL   40
    1    H    SER 734           H        SER 734  50.019 -25.401   9.584
    2    HA   SER 734           HA       SER 734  49.427 -26.976  11.905
    3    HB2  SER 734           HB2      SER 734  47.572 -25.234  10.291
    4    HB3  SER 734           HB3      SER 734  47.456 -25.642  12.006
    5    HG   SER 734           HG       SER 734  49.274 -23.925  10.689

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LYS 735           H        LYS 735  48.912 -27.245   8.482
    2    HA   LYS 735           HA       LYS 735  48.107 -28.806   7.152
    3    HB2  LYS 735           HB2      LYS 735  47.753 -30.486   9.638
    4    HB3  LYS 735           HB3      LYS 735  47.611 -31.072   7.987
    5    HG2  LYS 735           HG2      LYS 735  50.089 -30.010   9.329
    6    HG3  LYS 735           HG3      LYS 735  49.769 -31.678   8.852
    7    HD2  LYS 735           HD2      LYS 735  49.576 -30.808   6.477
    8    HD3  LYS 735           HD3      LYS 735  50.209 -29.284   7.083
    9    HE2  LYS 735           HE2      LYS 735  51.575 -31.951   7.245
   10    HE3  LYS 735           HE3      LYS 735  51.949 -30.661   6.110
   11    HZ3  LYS 735           HZ1      LYS 735  52.678 -29.251   7.935
   12    HZ2  LYS 735           HZ2      LYS 735  53.492 -30.711   8.000
   13    HZ1  LYS 735           HZ3      LYS 735  52.248 -30.426   9.076

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ARG 736           H        ARG 736  46.306 -26.929   8.751
    2    HA   ARG 736           HA       ARG 736  43.752 -28.320   8.355
    3    HB2  ARG 736           HB2      ARG 736  42.719 -26.552   9.624
    4    HB3  ARG 736           HB3      ARG 736  44.042 -27.260  10.536
    5    HG2  ARG 736           HG2      ARG 736  45.364 -25.398  10.319
    6    HG3  ARG 736           HG3      ARG 736  44.500 -24.823   8.889
    7    HD2  ARG 736           HD2      ARG 736  43.403 -24.916  11.691
    8    HD3  ARG 736           HD3      ARG 736  44.009 -23.501  10.808
    9    HE   ARG 736           HE       ARG 736  42.039 -24.687   9.239
   10   HH11  ARG 736          HH11      ARG 736  42.189 -22.985  12.347
   11   HH12  ARG 736          HH12      ARG 736  40.608 -22.379  12.206
   12   HH21  ARG 736          HH21      ARG 736  39.936 -23.871   9.076
   13   HH22  ARG 736          HH22      ARG 736  39.276 -22.896  10.323

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ILE 737           H        ILE 737  41.968 -26.953   7.440
    2    HA   ILE 737           HA       ILE 737  42.966 -25.620   5.052
    3    HB   ILE 737           HB       ILE 737  40.101 -26.316   5.739
    4   HG12  ILE 737          HG12      ILE 737  41.478 -28.386   5.803
    5   HG13  ILE 737          HG13      ILE 737  40.322 -28.399   4.484
    6   HG21  ILE 737          HG21      ILE 737  40.458 -24.687   3.937
    7   HG23  ILE 737          HG22      ILE 737  39.757 -26.184   3.331
    8   HG22  ILE 737          HG23      ILE 737  41.472 -25.855   3.086
    9   HD12  ILE 737          HD11      ILE 737  43.284 -27.869   4.298
   10   HD11  ILE 737          HD12      ILE 737  42.138 -27.748   2.960
   11   HD13  ILE 737          HD13      ILE 737  42.416 -29.304   3.741

  No H/Q in entry =          11
  In of MODEL   40
    1    H    LEU 738           H        LEU 738  42.778 -23.471   4.896
    2    HA   LEU 738           HA       LEU 738  40.841 -22.138   6.575
    3    HB2  LEU 738           HB2      LEU 738  42.272 -20.350   7.216
    4    HB3  LEU 738           HB3      LEU 738  43.043 -21.840   7.738
    5    HG   LEU 738           HG       LEU 738  43.830 -20.024   5.450
    6   HD13  LEU 738          HD11      LEU 738  45.848 -19.646   6.759
    7   HD12  LEU 738          HD12      LEU 738  45.216 -20.687   8.034
    8   HD11  LEU 738          HD13      LEU 738  44.400 -19.173   7.650
    9   HD23  LEU 738          HD21      LEU 738  45.129 -22.571   6.372
   10   HD22  LEU 738          HD22      LEU 738  45.731 -21.479   5.097
   11   HD21  LEU 738          HD23      LEU 738  44.192 -22.331   4.900

  No H/Q in entry =          11
  In of MODEL   40
    1    HA   PRO 739           HA       PRO 739  39.911 -20.028   2.849
    2    HB2  PRO 739           HB2      PRO 739  38.645 -17.867   3.885
    3    HB3  PRO 739           HB3      PRO 739  37.924 -19.490   3.894
    4    HG2  PRO 739           HG2      PRO 739  39.338 -18.041   6.096
    5    HG3  PRO 739           HG3      PRO 739  37.837 -18.986   6.163
    6    HD2  PRO 739           HD2      PRO 739  40.290 -20.020   6.889
    7    HD3  PRO 739           HD3      PRO 739  38.970 -21.003   6.198

  No H/Q in entry =           7
  In of MODEL   40
    1    H    LEU 740           H        LEU 740  41.357 -19.012   1.674
    2    HA   LEU 740           HA       LEU 740  42.674 -16.645   2.766
    3    HB2  LEU 740           HB2      LEU 740  43.844 -18.835   1.072
    4    HB3  LEU 740           HB3      LEU 740  44.528 -17.231   1.103
    5    HG   LEU 740           HG       LEU 740  44.355 -19.150   3.424
    6   HD13  LEU 740          HD11      LEU 740  45.995 -19.767   1.807
    7   HD12  LEU 740          HD12      LEU 740  46.824 -19.078   3.209
    8   HD11  LEU 740          HD13      LEU 740  46.613 -18.125   1.723
    9   HD23  LEU 740          HD21      LEU 740  45.716 -17.462   4.616
   10   HD22  LEU 740          HD22      LEU 740  44.108 -16.868   4.233
   11   HD21  LEU 740          HD23      LEU 740  45.491 -16.350   3.264

  No H/Q in entry =          11
  In of MODEL   40
    1    H    THR 741           H        THR 741  43.674 -15.519   0.780
    2    HA   THR 741           HA       THR 741  41.704 -15.536  -1.348
    3    HB   THR 741           HB       THR 741  42.921 -12.965  -0.343
    4    HG1  THR 741           HG1      THR 741  40.526 -14.126   0.720
    5   HG21  THR 741          HG21      THR 741  41.474 -13.131  -2.359
    6   HG23  THR 741          HG22      THR 741  40.859 -12.044  -1.110
    7   HG22  THR 741          HG23      THR 741  40.164 -13.652  -1.304

  No H/Q in entry =           7
  In of MODEL   40
    1    H    VAL 742           H        VAL 742  42.688 -15.037  -3.385
    2    HA   VAL 742           HA       VAL 742  45.163 -16.148  -3.710
    3    HB   VAL 742           HB       VAL 742  43.961 -16.345  -5.665
    4   HG11  VAL 742          HG11      VAL 742  43.411 -13.446  -5.587
    5   HG13  VAL 742          HG12      VAL 742  42.323 -14.774  -5.154
    6   HG12  VAL 742          HG13      VAL 742  42.894 -14.601  -6.819
    7   HG22  VAL 742          HG21      VAL 742  45.034 -15.237  -7.473
    8   HG21  VAL 742          HG22      VAL 742  46.280 -15.575  -6.246
    9   HG23  VAL 742          HG23      VAL 742  45.603 -13.962  -6.414

  No H/Q in entry =           9
  In of MODEL   40
    1    H    CYS 743           H        CYS 743  44.761 -12.575  -3.865
    2    HA   CYS 743           HA       CYS 743  47.467 -12.112  -4.314
    3    HB2  CYS 743           HB2      CYS 743  45.732 -10.282  -4.384
    4    HB3  CYS 743           HB3      CYS 743  45.653 -10.371  -2.633

  No H/Q in entry =           4
  In of MODEL   40
    1    H    LYS 744           H        LYS 744  45.736 -12.532  -1.257
    2    HA   LYS 744           HA       LYS 744  47.837 -11.996   0.496
    3    HB2  LYS 744           HB2      LYS 744  45.543 -13.928   0.822
    4    HB3  LYS 744           HB3      LYS 744  46.591 -13.398   2.122
    5    HG2  LYS 744           HG2      LYS 744  45.806 -11.074   1.753
    6    HG3  LYS 744           HG3      LYS 744  44.735 -11.659   0.482
    7    HD2  LYS 744           HD2      LYS 744  43.430 -11.397   2.467
    8    HD3  LYS 744           HD3      LYS 744  43.643 -13.123   2.201
    9    HE2  LYS 744           HE2      LYS 744  43.928 -12.609   4.548
   10    HE3  LYS 744           HE3      LYS 744  45.467 -13.132   3.875
   11    HZ1  LYS 744           HZ1      LYS 744  46.125 -10.737   3.753
   12    HZ3  LYS 744           HZ2      LYS 744  45.760 -11.245   5.301
   13    HZ2  LYS 744           HZ3      LYS 744  44.638 -10.336   4.453

  No H/Q in entry =          13
  In of MODEL   40
    1    H    MET 745           H        MET 745  46.685 -15.112  -0.706
    2    HA   MET 745           HA       MET 745  48.640 -16.828   0.296
    3    HB2  MET 745           HB2      MET 745  46.896 -17.920  -0.672
    4    HB3  MET 745           HB3      MET 745  46.790 -16.861  -2.053
    5    HG2  MET 745           HG2      MET 745  47.569 -18.835  -2.989
    6    HG3  MET 745           HG3      MET 745  49.044 -17.936  -2.736
    7    HE1  MET 745           HE1      MET 745  46.875 -20.896  -1.753
    8    HE3  MET 745           HE2      MET 745  46.785 -20.014  -0.226
    9    HE2  MET 745           HE3      MET 745  47.646 -21.553  -0.316

  No H/Q in entry =           9
  In of MODEL   40
    1    H    HIS 746           H        HIS 746  48.686 -15.011  -2.764
    2    HA   HIS 746           HA       HIS 746  51.161 -16.137  -3.643
    3    HB2  HIS 746           HB2      HIS 746  49.526 -13.854  -4.492
    4    HB3  HIS 746           HB3      HIS 746  51.225 -13.822  -4.982
    5    HD1  HIS 746           HD1      HIS 746  51.782 -16.441  -6.168
    6    HD2  HIS 746           HD2      HIS 746  48.027 -14.723  -6.393
    7    HE1  HIS 746           HE1      HIS 746  50.727 -17.433  -8.189
    8    HE2  HIS 746           HE2      HIS 746  48.358 -16.582  -8.135

  No H/Q in entry =           8
  In of MODEL   40
    1    H    VAL 747           H        VAL 747  50.330 -13.122  -2.060
    2    HA   VAL 747           HA       VAL 747  52.912 -12.099  -1.952
    3    HB   VAL 747           HB       VAL 747  50.449 -11.543  -0.289
    4   HG11  VAL 747          HG11      VAL 747  52.459 -11.049   1.048
    5   HG13  VAL 747          HG12      VAL 747  51.625  -9.573   0.564
    6   HG12  VAL 747          HG13      VAL 747  53.090 -10.075  -0.279
    7   HG22  VAL 747          HG21      VAL 747  50.418  -9.475  -1.572
    8   HG21  VAL 747          HG22      VAL 747  50.374 -10.892  -2.629
    9   HG23  VAL 747          HG23      VAL 747  51.875  -9.991  -2.424

  No H/Q in entry =           9
  In of MODEL   40
    1    H    LEU 748           H        LEU 748  51.059 -13.952   0.464
    2    HA   LEU 748           HA       LEU 748  53.229 -13.962   2.233
    3    HB2  LEU 748           HB2      LEU 748  51.996 -15.674   3.560
    4    HB3  LEU 748           HB3      LEU 748  51.048 -14.258   3.184
    5    HG   LEU 748           HG       LEU 748  49.923 -15.638   1.399
    6   HD11  LEU 748          HD11      LEU 748  51.551 -17.427   1.193
    7   HD13  LEU 748          HD12      LEU 748  49.968 -18.059   1.654
    8   HD12  LEU 748          HD13      LEU 748  51.244 -17.902   2.862
    9   HD22  LEU 748          HD21      LEU 748  48.858 -15.094   3.496
   10   HD21  LEU 748          HD22      LEU 748  49.645 -16.465   4.278
   11   HD23  LEU 748          HD23      LEU 748  48.444 -16.738   3.013

  No H/Q in entry =          11
  In of MODEL   40
    1    H    HIS 749           H        HIS 749  52.389 -16.096  -0.370
    2    HA   HIS 749           HA       HIS 749  54.229 -18.151   0.328
    3    HB2  HIS 749           HB2      HIS 749  52.296 -18.174  -1.445
    4    HB3  HIS 749           HB3      HIS 749  53.517 -17.510  -2.523
    5    HD1  HIS 749           HD1      HIS 749  55.776 -19.123  -2.743
    6    HD2  HIS 749           HD2      HIS 749  52.282 -20.834  -1.296
    7    HE1  HIS 749           HE1      HIS 749  56.118 -21.588  -2.937
    8    HE2  HIS 749           HE2      HIS 749  53.952 -22.617  -2.198

  No H/Q in entry =           8
  In of MODEL   40
    1    H    CYS 750           H        CYS 750  54.447 -15.099  -1.262
    2    HA   CYS 750           HA       CYS 750  57.099 -15.557  -2.262
    3    HB2  CYS 750           HB2      CYS 750  55.401 -14.125  -3.429
    4    HB3  CYS 750           HB3      CYS 750  55.521 -12.977  -2.108

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLN 751           H        GLN 751  55.531 -14.077   0.507
    2    HA   GLN 751           HA       GLN 751  57.744 -12.832   1.713
    3    HB2  GLN 751           HB2      GLN 751  55.382 -14.219   3.016
    4    HB3  GLN 751           HB3      GLN 751  56.525 -13.210   3.874
    5    HG2  GLN 751           HG2      GLN 751  54.713 -12.282   1.661
    6    HG3  GLN 751           HG3      GLN 751  54.375 -12.093   3.374
    7   HE21  GLN 751          HE21      GLN 751  54.589 -10.011   1.411
    8   HE22  GLN 751          HE22      GLN 751  55.910  -9.023   1.846

  No H/Q in entry =           8
  In of MODEL   40
    1    H    GLY 752           H        GLY 752  56.642 -16.133   1.613
    2    HA3  GLY 752           HA2      GLY 752  58.572 -17.774   1.685
    3    HA2  GLY 752           HA3      GLY 752  58.985 -16.990   3.199

  No H/Q in entry =           3
  In of MODEL   40
    1    H    ARG 753           H        ARG 753  55.638 -17.484   2.395
    2    HA   ARG 753           HA       ARG 753  55.423 -19.500   4.531
    3    HB2  ARG 753           HB2      ARG 753  53.307 -17.762   3.237
    4    HB3  ARG 753           HB3      ARG 753  53.075 -18.838   4.610
    5    HG2  ARG 753           HG2      ARG 753  54.924 -16.462   4.661
    6    HG3  ARG 753           HG3      ARG 753  53.229 -16.376   5.127
    7    HD2  ARG 753           HD2      ARG 753  55.260 -18.215   6.371
    8    HD3  ARG 753           HD3      ARG 753  54.762 -16.660   7.047
    9    HE   ARG 753           HE       ARG 753  52.430 -17.925   6.731
   10   HH11  ARG 753          HH11      ARG 753  55.442 -18.876   8.360
   11   HH12  ARG 753          HH12      ARG 753  54.668 -19.918   9.457
   12   HH21  ARG 753          HH21      ARG 753  51.379 -19.350   8.274
   13   HH22  ARG 753          HH22      ARG 753  52.319 -20.190   9.410

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ASN 754           H        ASN 754  54.321 -21.474   4.051
    2    HA   ASN 754           HA       ASN 754  53.723 -21.849   1.197
    3    HB2  ASN 754           HB2      ASN 754  54.653 -23.953   3.151
    4    HB3  ASN 754           HB3      ASN 754  54.055 -24.280   1.546
    5   HD21  ASN 754          HD21      ASN 754  56.624 -23.120   3.387
    6   HD22  ASN 754          HD22      ASN 754  57.807 -23.029   2.133

  No H/Q in entry =           6
  In of MODEL   40
    1    H    TYR 755           H        TYR 755  51.800 -22.393   0.621
    2    HA   TYR 755           HA       TYR 755  50.028 -23.692   2.491
    3    HB2  TYR 755           HB2      TYR 755  49.458 -21.114   1.045
    4    HB3  TYR 755           HB3      TYR 755  48.181 -22.210   1.569
    5    HD1  TYR 755           HD1      TYR 755  50.981 -20.094   2.762
    6    HD2  TYR 755           HD2      TYR 755  47.464 -22.199   3.812
    7    HE1  TYR 755           HE1      TYR 755  51.060 -19.085   4.990
    8    HE2  TYR 755           HE2      TYR 755  47.529 -21.207   6.039
    9    HH   TYR 755           HH       TYR 755  49.201 -20.338   7.494

  No H/Q in entry =           9
  In of MODEL   40
    1    H    THR 756           H        THR 756  48.544 -24.941   1.519
    2    HA   THR 756           HA       THR 756  49.162 -25.640  -1.261
    3    HB   THR 756           HB       THR 756  47.700 -27.161   0.892
    4    HG1  THR 756           HG1      THR 756  50.179 -26.596   0.829
    5   HG22  THR 756          HG21      THR 756  48.827 -28.047  -1.757
    6   HG21  THR 756          HG22      THR 756  47.118 -27.828  -1.347
    7   HG23  THR 756          HG23      THR 756  48.056 -29.100  -0.549

  No H/Q in entry =           7
  In of MODEL   40
    1    H    LEU 757           H        LEU 757  47.438 -25.765  -2.780
    2    HA   LEU 757           HA       LEU 757  45.037 -24.319  -2.052
    3    HB2  LEU 757           HB2      LEU 757  46.014 -25.386  -4.706
    4    HB3  LEU 757           HB3      LEU 757  44.461 -24.610  -4.497
    5    HG   LEU 757           HG       LEU 757  45.905 -23.014  -5.443
    6   HD13  LEU 757          HD11      LEU 757  44.432 -22.133  -3.791
    7   HD12  LEU 757          HD12      LEU 757  45.955 -21.244  -3.755
    8   HD11  LEU 757          HD13      LEU 757  45.607 -22.440  -2.517
    9   HD23  LEU 757          HD21      LEU 757  48.057 -22.332  -4.450
   10   HD22  LEU 757          HD22      LEU 757  48.070 -24.027  -4.927
   11   HD21  LEU 757          HD23      LEU 757  47.883 -23.594  -3.229

  No H/Q in entry =          11
  In of MODEL   40
    1    H    THR 758           H        THR 758  43.092 -25.166  -1.781
    2    HA   THR 758           HA       THR 758  42.844 -28.041  -2.224
    3    HB   THR 758           HB       THR 758  41.469 -28.100  -0.077
    4    HG1  THR 758           HG1      THR 758  42.379 -25.478  -0.046
    5   HG23  THR 758          HG21      THR 758  43.425 -28.345   1.355
    6   HG22  THR 758          HG22      THR 758  44.395 -27.413   0.215
    7   HG21  THR 758          HG23      THR 758  43.776 -28.994  -0.250

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLY 759           H        GLY 759  40.369 -28.586  -1.674
    2    HA3  GLY 759           HA2      GLY 759  38.899 -27.365  -3.772
    3    HA2  GLY 759           HA3      GLY 759  38.311 -28.580  -2.644

  No H/Q in entry =           3
  In of MODEL   40
    1    H    ARG 760           H        ARG 760  36.831 -26.415  -3.562
    2    HA   ARG 760           HA       ARG 760  36.963 -24.168  -1.834
    3    HB2  ARG 760           HB2      ARG 760  34.995 -23.336  -2.990
    4    HB3  ARG 760           HB3      ARG 760  36.133 -24.023  -4.134
    5    HG2  ARG 760           HG2      ARG 760  34.092 -24.770  -4.939
    6    HG3  ARG 760           HG3      ARG 760  34.654 -26.139  -3.984
    7    HD2  ARG 760           HD2      ARG 760  33.279 -25.283  -2.081
    8    HD3  ARG 760           HD3      ARG 760  32.623 -24.063  -3.173
    9    HE   ARG 760           HE       ARG 760  32.405 -26.817  -4.005
   10   HH11  ARG 760          HH11      ARG 760  30.798 -24.054  -2.466
   11   HH12  ARG 760          HH12      ARG 760  29.232 -24.645  -2.687
   12   HH21  ARG 760          HH21      ARG 760  30.205 -27.649  -4.319
   13   HH22  ARG 760          HH22      ARG 760  28.893 -26.724  -3.758

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ASP 761           H        ASP 761  35.560 -27.214  -1.374
    2    HA   ASP 761           HA       ASP 761  33.658 -26.077   0.522
    3    HB2  ASP 761           HB2      ASP 761  32.755 -27.684  -1.155
    4    HB3  ASP 761           HB3      ASP 761  33.776 -28.940  -0.469

  No H/Q in entry =           4
  In of MODEL   40
    1    H    SER 762           H        SER 762  36.712 -27.080   0.518
    2    HA   SER 762           HA       SER 762  36.808 -28.838   2.732
    3    HB2  SER 762           HB2      SER 762  38.968 -27.110   1.529
    4    HB3  SER 762           HB3      SER 762  39.252 -28.345   2.758
    5    HG   SER 762           HG       SER 762  37.879 -28.938   0.372

  No H/Q in entry =           5
  In of MODEL   40
    1    H    CYS 763           H        CYS 763  36.586 -25.398   2.533
    2    HA   CYS 763           HA       CYS 763  36.309 -25.347   5.424
    3    HB2  CYS 763           HB2      CYS 763  37.580 -23.252   5.618
    4    HB3  CYS 763           HB3      CYS 763  38.605 -24.514   4.924

  No H/Q in entry =           4
  In of MODEL   40
    1    H    THR 764           H        THR 764  35.445 -22.855   5.865
    2    HA   THR 764           HA       THR 764  33.211 -22.599   4.030
    3    HB   THR 764           HB       THR 764  33.672 -21.238   6.698
    4    HG1  THR 764           HG1      THR 764  33.130 -23.826   6.165
    5   HG21  THR 764          HG21      THR 764  31.983 -20.214   5.241
    6   HG23  THR 764          HG22      THR 764  31.237 -20.951   6.662
    7   HG22  THR 764          HG23      THR 764  31.160 -21.769   5.098

  No H/Q in entry =           7
  In of MODEL   40
    1    H    LEU 765           H        LEU 765  33.732 -21.430   2.391
    2    HA   LEU 765           HA       LEU 765  35.791 -19.469   2.563
    3    HB2  LEU 765           HB2      LEU 765  35.283 -21.174   0.688
    4    HB3  LEU 765           HB3      LEU 765  34.063 -20.013   0.199
    5    HG   LEU 765           HG       LEU 765  35.825 -18.307  -0.071
    6   HD12  LEU 765          HD11      LEU 765  38.173 -19.060  -0.051
    7   HD11  LEU 765          HD12      LEU 765  37.614 -20.639   0.535
    8   HD13  LEU 765          HD13      LEU 765  37.417 -19.228   1.540
    9   HD23  LEU 765          HD21      LEU 765  36.804 -19.278  -2.091
   10   HD22  LEU 765          HD22      LEU 765  35.080 -19.618  -1.977
   11   HD21  LEU 765          HD23      LEU 765  36.255 -20.876  -1.584

  No H/Q in entry =          11
  In of MODEL   40
    1    HA   PRO 766           HA       PRO 766  32.879 -16.042   2.758
    2    HB2  PRO 766           HB2      PRO 766  34.608 -14.047   2.779
    3    HB3  PRO 766           HB3      PRO 766  34.594 -15.185   4.136
    4    HG2  PRO 766           HG2      PRO 766  36.375 -15.081   1.761
    5    HG3  PRO 766           HG3      PRO 766  36.839 -15.284   3.469
    6    HD2  PRO 766           HD2      PRO 766  36.567 -17.376   1.687
    7    HD3  PRO 766           HD3      PRO 766  36.333 -17.550   3.437

  No H/Q in entry =           7
  In of MODEL   40
    1    H    ALA 767           H        ALA 767  32.743 -13.911   1.526
    2    HA   ALA 767           HA       ALA 767  31.822 -13.149  -0.494
    3    HB1  ALA 767           HB1      ALA 767  34.128 -12.182  -0.398
    4    HB3  ALA 767           HB2      ALA 767  33.496 -12.387  -2.036
    5    HB2  ALA 767           HB3      ALA 767  34.659 -13.542  -1.376

  No H/Q in entry =           5
  In of MODEL   40
    1    H    SER 768           H        SER 768  33.847 -14.674  -2.622
    2    HA   SER 768           HA       SER 768  33.526 -16.319  -4.090
    3    HB2  SER 768           HB2      SER 768  31.574 -17.118  -2.006
    4    HB3  SER 768           HB3      SER 768  31.835 -18.098  -3.425
    5    HG   SER 768           HG       SER 768  33.729 -17.281  -1.456

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA 769           H        ALA 769  30.362 -15.133  -3.029
    2    HA   ALA 769           HA       ALA 769  29.409 -15.328  -5.799
    3    HB3  ALA 769           HB1      ALA 769  27.832 -15.379  -3.227
    4    HB2  ALA 769           HB2      ALA 769  28.252 -16.785  -4.202
    5    HB1  ALA 769           HB3      ALA 769  27.171 -15.554  -4.854

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLU 770           H        GLU 770  27.176 -13.846  -5.544
    2    HA   GLU 770           HA       GLU 770  28.008 -11.183  -5.981
    3    HB2  GLU 770           HB2      GLU 770  25.562 -10.766  -6.106
    4    HB3  GLU 770           HB3      GLU 770  26.124 -12.070  -7.145
    5    HG2  GLU 770           HG2      GLU 770  25.367 -13.700  -5.450
    6    HG3  GLU 770           HG3      GLU 770  24.727 -12.370  -4.495

  No H/Q in entry =           6
  In of MODEL   40
    1    H    LYS 771           H        LYS 771  27.536  -9.346  -4.951
    2    HA   LYS 771           HA       LYS 771  27.428  -9.508  -2.076
    3    HB2  LYS 771           HB2      LYS 771  28.470  -7.670  -4.128
    4    HB3  LYS 771           HB3      LYS 771  27.897  -6.987  -2.628
    5    HG2  LYS 771           HG2      LYS 771  30.335  -7.526  -2.934
    6    HG3  LYS 771           HG3      LYS 771  29.555  -7.949  -1.392
    7    HD2  LYS 771           HD2      LYS 771  29.869  -9.925  -3.593
    8    HD3  LYS 771           HD3      LYS 771  31.276  -9.561  -2.571
    9    HE2  LYS 771           HE2      LYS 771  28.650 -10.892  -1.834
   10    HE3  LYS 771           HE3      LYS 771  30.279 -11.486  -1.653
   11    HZ3  LYS 771           HZ1      LYS 771  29.377 -10.803   0.471
   12    HZ2  LYS 771           HZ2      LYS 771  29.138  -9.236  -0.083
   13    HZ1  LYS 771           HZ3      LYS 771  30.694  -9.837   0.059

  No H/Q in entry =          13
  In of MODEL   40
    1    H    ALA 772           H        ALA 772  26.363  -7.828  -1.070
    2    HA   ALA 772           HA       ALA 772  23.677  -7.376  -2.130
    3    HB2  ALA 772           HB1      ALA 772  24.865  -6.942   0.605
    4    HB3  ALA 772           HB2      ALA 772  23.847  -8.297   0.117
    5    HB1  ALA 772           HB3      ALA 772  23.178  -6.667   0.184

  No H/Q in entry =           5
  In of MODEL   40
    1    H    CYS 773           H        CYS 773  22.894  -5.013  -1.197
    2    HA   CYS 773           HA       CYS 773  24.504  -3.179  -2.679
    3    HB2  CYS 773           HB2      CYS 773  22.019  -2.987  -2.557
    4    HB3  CYS 773           HB3      CYS 773  22.144  -2.652  -0.835

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLY 774           H        GLY 774  26.132  -1.899  -1.905
    2    HA3  GLY 774           HA2      GLY 774  26.702  -0.489   0.109
    3    HA2  GLY 774           HA3      GLY 774  26.531  -1.990   1.004

  No H/Q in entry =           3
  In of MODEL   40
    1    H    ALA 775           H        ALA 775  27.822  -3.421  -1.435
    2    HA   ALA 775           HA       ALA 775  30.497  -2.419  -1.317
    3    HB1  ALA 775           HB1      ALA 775  31.404  -4.551  -0.524
    4    HB2  ALA 775           HB2      ALA 775  29.768  -5.163  -0.287
    5    HB3  ALA 775           HB3      ALA 775  30.360  -3.823   0.698

  No H/Q in entry =           5
  In of MODEL   40
    1    H    CYS 776           H        CYS 776  31.533  -2.974  -3.115
    2    HA   CYS 776           HA       CYS 776  30.198  -4.837  -4.962
    3    HB2  CYS 776           HB2      CYS 776  31.740  -2.356  -5.732
    4    HB3  CYS 776           HB3      CYS 776  30.884  -3.458  -6.806

  No H/Q in entry =           4
  In of MODEL   40
    1    HA   PRO 777           HA       PRO 777  34.322  -6.632  -4.932
    2    HB2  PRO 777           HB2      PRO 777  33.776  -8.784  -6.459
    3    HB3  PRO 777           HB3      PRO 777  33.214  -8.675  -4.786
    4    HG2  PRO 777           HG2      PRO 777  31.711  -8.236  -7.324
    5    HG3  PRO 777           HG3      PRO 777  31.175  -9.011  -5.823
    6    HD2  PRO 777           HD2      PRO 777  30.590  -6.407  -6.552
    7    HD3  PRO 777           HD3      PRO 777  30.555  -7.027  -4.894

  No H/Q in entry =           7
  In of MODEL   40
    1    H    LEU 778           H        LEU 778  35.760  -7.483  -6.792
    2    HA   LEU 778           HA       LEU 778  35.928  -5.425  -8.771
    3    HB2  LEU 778           HB2      LEU 778  37.872  -6.896  -9.655
    4    HB3  LEU 778           HB3      LEU 778  38.024  -6.082  -8.109
    5    HG   LEU 778           HG       LEU 778  37.050  -8.904  -8.089
    6   HD12  LEU 778          HD11      LEU 778  39.288  -9.738  -8.060
    7   HD11  LEU 778          HD12      LEU 778  39.943  -8.134  -8.437
    8   HD13  LEU 778          HD13      LEU 778  38.943  -9.002  -9.622
    9   HD23  LEU 778          HD21      LEU 778  38.382  -8.963  -6.039
   10   HD22  LEU 778          HD22      LEU 778  37.216  -7.644  -6.003
   11   HD21  LEU 778          HD23      LEU 778  38.906  -7.311  -6.346

  No H/Q in entry =          11
  In of MODEL   40
    1    H    TRP 779           H        TRP 779  34.276  -8.276  -8.673
    2    HA   TRP 779           HA       TRP 779  33.971  -8.298 -11.571
    3    HB2  TRP 779           HB2      TRP 779  32.864 -10.587 -11.150
    4    HB3  TRP 779           HB3      TRP 779  34.608 -10.487 -10.987
    5    HD1  TRP 779           HD1      TRP 779  31.415 -11.153  -8.887
    6    HE1  TRP 779           HE1      TRP 779  32.146 -12.027  -6.596
    7    HE3  TRP 779           HE3      TRP 779  36.483 -10.507  -9.300
    8    HZ2  TRP 779           HZ2      TRP 779  34.590 -12.404  -5.140
    9    HZ3  TRP 779           HZ3      TRP 779  37.895 -11.157  -7.419
   10    HH2  TRP 779           HH2      TRP 779  36.952 -12.079  -5.395

  No H/Q in entry =          10
  In of MODEL   40
    1    H    GLY 780           H        GLY 780  32.652  -6.634  -9.262
    2    HA3  GLY 780           HA2      GLY 780  29.986  -6.960 -10.375
    3    HA2  GLY 780           HA3      GLY 780  30.148  -7.094  -8.626

  No H/Q in entry =           3
  In of MODEL   40
    1    H    LYS 781           H        LYS 781  28.466  -5.285  -9.744
    2    HA   LYS 781           HA       LYS 781  29.517  -2.824  -8.770
    3    HB2  LYS 781           HB2      LYS 781  30.439  -2.686 -10.941
    4    HB3  LYS 781           HB3      LYS 781  28.966  -3.183 -11.720
    5    HG2  LYS 781           HG2      LYS 781  29.166  -0.604 -10.171
    6    HG3  LYS 781           HG3      LYS 781  29.731  -0.714 -11.837
    7    HD2  LYS 781           HD2      LYS 781  26.924  -1.180 -10.823
    8    HD3  LYS 781           HD3      LYS 781  27.487   0.159 -11.831
    9    HE2  LYS 781           HE2      LYS 781  28.209  -1.583 -13.500
   10    HE3  LYS 781           HE3      LYS 781  27.341  -2.729 -12.476
   11    HZ1  LYS 781           HZ1      LYS 781  25.267  -1.534 -12.905
   12    HZ3  LYS 781           HZ2      LYS 781  25.958  -2.002 -14.348
   13    HZ2  LYS 781           HZ3      LYS 781  26.075  -0.410 -13.860

  No H/Q in entry =          13
  In of MODEL   40
    1    H    CYS 782           H        CYS 782  27.960  -1.465  -8.032
    2    HA   CYS 782           HA       CYS 782  25.254  -2.592  -8.143
    3    HB2  CYS 782           HB2      CYS 782  26.340  -2.800  -5.938
    4    HB3  CYS 782           HB3      CYS 782  26.598  -1.064  -5.907

  No H/Q in entry =           4
  In of MODEL   40
    1    H    ASP 783           H        ASP 783  24.318  -1.386  -9.668
    2    HA   ASP 783           HA       ASP 783  23.867   1.422  -9.054
    3    HB2  ASP 783           HB2      ASP 783  25.630   1.614 -10.688
    4    HB3  ASP 783           HB3      ASP 783  24.855   0.439 -11.744

  No H/Q in entry =           4
  In of MODEL   40
    1    H    ALA 784           H        ALA 784  23.168  -1.304 -11.182
    2    HA   ALA 784           HA       ALA 784  20.464  -0.520 -11.570
    3    HB1  ALA 784           HB1      ALA 784  20.231  -2.782 -12.533
    4    HB3  ALA 784           HB2      ALA 784  21.858  -3.179 -11.985
    5    HB2  ALA 784           HB3      ALA 784  21.620  -1.938 -13.217

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLU 785           H        GLU 785  19.123  -0.518  -9.953
    2    HA   GLU 785           HA       GLU 785  17.816  -1.179  -8.307
    3    HB2  GLU 785           HB2      GLU 785  19.302  -3.799  -8.464
    4    HB3  GLU 785           HB3      GLU 785  17.956  -3.512  -7.371
    5    HG2  GLU 785           HG2      GLU 785  17.851  -3.335 -10.374
    6    HG3  GLU 785           HG3      GLU 785  17.234  -4.669  -9.396

  No H/Q in entry =           6
  In of MODEL   40
    1    H    SER 786           H        SER 786  17.725  -1.166  -6.093
    2    HA   SER 786           HA       SER 786  20.278  -0.486  -4.855
    3    HB2  SER 786           HB2      SER 786  18.288   1.158  -4.944
    4    HB3  SER 786           HB3      SER 786  17.495   0.083  -3.800
    5    HG   SER 786           HG       SER 786  19.867   1.573  -3.472

  No H/Q in entry =           5
  In of MODEL   40
    1    H    SER 787           H        SER 787  18.707  -3.114  -5.389
    2    HA   SER 787           HA       SER 787  18.266  -4.175  -2.753
    3    HB2  SER 787           HB2      SER 787  18.396  -5.608  -5.413
    4    HB3  SER 787           HB3      SER 787  17.770  -6.269  -3.904
    5    HG   SER 787           HG       SER 787  16.633  -3.887  -4.590

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LYS 788           H        LYS 788  20.638  -4.846  -5.381
    2    HA   LYS 788           HA       LYS 788  22.464  -5.865  -3.389
    3    HB2  LYS 788           HB2      LYS 788  22.794  -7.950  -4.497
    4    HB3  LYS 788           HB3      LYS 788  21.098  -7.782  -4.067
    5    HG2  LYS 788           HG2      LYS 788  20.538  -7.264  -6.374
    6    HG3  LYS 788           HG3      LYS 788  22.247  -7.333  -6.823
    7    HD2  LYS 788           HD2      LYS 788  22.322  -9.665  -6.082
    8    HD3  LYS 788           HD3      LYS 788  20.607  -9.607  -5.711
    9    HE2  LYS 788           HE2      LYS 788  20.178  -9.108  -8.095
   10    HE3  LYS 788           HE3      LYS 788  21.902  -9.311  -8.416
   11    HZ2  LYS 788           HZ1      LYS 788  20.025 -11.356  -7.378
   12    HZ1  LYS 788           HZ2      LYS 788  21.676 -11.572  -7.418
   13    HZ3  LYS 788           HZ3      LYS 788  20.815 -11.398  -8.871

  No H/Q in entry =          13
  In of MODEL   40
    1    H    CYS 789           H        CYS 789  24.493  -6.617  -4.546
    2    HA   CYS 789           HA       CYS 789  25.152  -4.689  -6.619
    3    HB2  CYS 789           HB2      CYS 789  26.625  -4.698  -4.645
    4    HB3  CYS 789           HB3      CYS 789  26.862  -6.430  -4.821

  No H/Q in entry =           4
  In of MODEL   40
    1    H    VAL 790           H        VAL 790  25.549  -5.486  -8.616
    2    HA   VAL 790           HA       VAL 790  24.952  -8.328  -8.952
    3    HB   VAL 790           HB       VAL 790  24.764  -6.042 -10.943
    4   HG12  VAL 790          HG11      VAL 790  23.743  -8.867 -11.164
    5   HG11  VAL 790          HG12      VAL 790  25.129  -8.180 -12.011
    6   HG13  VAL 790          HG13      VAL 790  23.505  -7.576 -12.354
    7   HG23  VAL 790          HG21      VAL 790  22.619  -7.441  -9.397
    8   HG22  VAL 790          HG22      VAL 790  22.346  -6.221 -10.656
    9   HG21  VAL 790          HG23      VAL 790  23.178  -5.786  -9.150

  No H/Q in entry =           9
  In of MODEL   40
    1    H    CYS 791           H        CYS 791  26.174  -9.463 -10.480
    2    HA   CYS 791           HA       CYS 791  28.885  -8.453 -10.662
    3    HB2  CYS 791           HB2      CYS 791  27.826 -11.246 -10.829
    4    HB3  CYS 791           HB3      CYS 791  29.490 -10.825 -11.212

  No H/Q in entry =           4
  In of MODEL   40
    1    H    ARG 792           H        ARG 792  30.030  -8.442 -12.465
    2    HA   ARG 792           HA       ARG 792  28.429  -7.716 -14.796
    3    HB2  ARG 792           HB2      ARG 792  31.375  -7.317 -14.217
    4    HB3  ARG 792           HB3      ARG 792  30.422  -6.506 -15.456
    5    HG2  ARG 792           HG2      ARG 792  29.184  -5.283 -13.841
    6    HG3  ARG 792           HG3      ARG 792  29.818  -6.251 -12.519
    7    HD2  ARG 792           HD2      ARG 792  30.949  -4.165 -12.454
    8    HD3  ARG 792           HD3      ARG 792  32.092  -5.342 -13.079
    9    HE   ARG 792           HE       ARG 792  31.007  -4.274 -15.313
   10   HH11  ARG 792          HH11      ARG 792  32.555  -2.833 -12.425
   11   HH12  ARG 792          HH12      ARG 792  33.106  -1.460 -13.240
   12   HH21  ARG 792          HH21      ARG 792  31.826  -2.414 -16.427
   13   HH22  ARG 792          HH22      ARG 792  32.739  -1.217 -15.593

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLU 793           H        GLU 793  29.368  -8.328 -16.941
    2    HA   GLU 793           HA       GLU 793  30.021 -11.076 -17.046
    3    HB2  GLU 793           HB2      GLU 793  30.349  -9.035 -19.251
    4    HB3  GLU 793           HB3      GLU 793  30.302 -10.775 -19.450
    5    HG2  GLU 793           HG2      GLU 793  28.179 -10.233 -20.066
    6    HG3  GLU 793           HG3      GLU 793  27.937 -10.516 -18.346

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ALA 794           H        ALA 794  31.973 -11.944 -18.009
    2    HA   ALA 794           HA       ALA 794  34.145 -11.190 -16.407
    3    HB1  ALA 794           HB1      ALA 794  33.983 -13.057 -18.739
    4    HB2  ALA 794           HB2      ALA 794  33.819 -13.469 -17.020
    5    HB3  ALA 794           HB3      ALA 794  35.356 -12.853 -17.666

  No H/Q in entry =           5
  In of MODEL   40
    1    H    SER 795           H        SER 795  33.288 -10.415 -19.686
    2    HA   SER 795           HA       SER 795  35.902  -9.311 -20.081
    3    HB2  SER 795           HB2      SER 795  34.750 -10.641 -21.885
    4    HB3  SER 795           HB3      SER 795  33.576  -9.339 -22.026
    5    HG   SER 795           HG       SER 795  35.199  -7.982 -22.755

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLU 796           H        GLU 796  33.224  -8.325 -18.550
    2    HA   GLU 796           HA       GLU 796  33.346  -5.546 -19.492
    3    HB2  GLU 796           HB2      GLU 796  31.185  -6.968 -19.634
    4    HB3  GLU 796           HB3      GLU 796  31.098  -6.786 -17.897
    5    HG2  GLU 796           HG2      GLU 796  31.134  -4.469 -19.820
    6    HG3  GLU 796           HG3      GLU 796  29.659  -5.241 -19.269

  No H/Q in entry =           6
  In of MODEL   40
    1    H    CYS 797           H        CYS 797  33.872  -7.685 -16.800
    2    HA   CYS 797           HA       CYS 797  33.794  -6.093 -14.560
    3    HB2  CYS 797           HB2      CYS 797  35.903  -8.146 -15.242
    4    HB3  CYS 797           HB3      CYS 797  35.579  -7.488 -13.638

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLU 798           H        GLU 798  35.591  -4.962 -13.332
    2    HA   GLU 798           HA       GLU 798  37.270  -3.519 -15.216
    3    HB2  GLU 798           HB2      GLU 798  35.000  -2.584 -15.182
    4    HB3  GLU 798           HB3      GLU 798  35.152  -2.331 -13.467
    5    HG2  GLU 798           HG2      GLU 798  36.828  -0.651 -13.830
    6    HG3  GLU 798           HG3      GLU 798  36.815  -0.982 -15.571

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU 799           H        GLU 799  38.892  -4.613 -13.974
    2    HA   GLU 799           HA       GLU 799  40.232  -2.960 -12.204
    3    HB2  GLU 799           HB2      GLU 799  38.584  -3.751 -10.495
    4    HB3  GLU 799           HB3      GLU 799  38.979  -5.412 -10.883
    5    HG2  GLU 799           HG2      GLU 799  39.981  -4.622  -8.760
    6    HG3  GLU 799           HG3      GLU 799  41.179  -5.168  -9.933

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLU 800           H        GLU 800  42.309  -4.001 -11.598
    2    HA   GLU 800           HA       GLU 800  42.902  -6.160 -13.437
    3    HB2  GLU 800           HB2      GLU 800  45.290  -5.377 -13.313
    4    HB3  GLU 800           HB3      GLU 800  44.200  -4.304 -14.186
    5    HG2  GLU 800           HG2      GLU 800  44.122  -2.818 -12.246
    6    HG3  GLU 800           HG3      GLU 800  45.140  -3.934 -11.349

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLY 801           H        GLY 801  42.049  -7.496 -11.797
    2    HA3  GLY 801           HA2      GLY 801  43.569  -7.843  -9.430
    3    HA2  GLY 801           HA3      GLY 801  42.317  -8.930 -10.047

  No H/Q in entry =           3
  In of MODEL   40
    1    H    PHE 802           H        PHE 802  43.741 -10.577  -9.423
    2    HA   PHE 802           HA       PHE 802  46.233 -10.830 -10.879
    3    HB2  PHE 802           HB2      PHE 802  44.896 -12.538  -8.808
    4    HB3  PHE 802           HB3      PHE 802  46.283 -13.128  -9.706
    5    HD1  PHE 802           HD1      PHE 802  47.812 -13.333  -7.955
    6    HD2  PHE 802           HD2      PHE 802  45.819  -9.624  -8.537
    7    HE1  PHE 802           HE1      PHE 802  49.299 -12.301  -6.365
    8    HE2  PHE 802           HE2      PHE 802  47.311  -8.570  -6.921
    9    HZ   PHE 802           HZ       PHE 802  49.067  -9.904  -5.818

  No H/Q in entry =           9
  In of MODEL   40
    1    H    SER 803           H        SER 803  46.553 -13.349 -11.558
    2    HA   SER 803           HA       SER 803  44.338 -14.054 -13.285
    3    HB2  SER 803           HB2      SER 803  47.301 -14.207 -13.898
    4    HB3  SER 803           HB3      SER 803  46.001 -14.790 -14.937
    5    HG   SER 803           HG       SER 803  45.698 -12.165 -14.156

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ILE 804           H        ILE 804  43.788 -16.162 -13.069
    2    HA   ILE 804           HA       ILE 804  45.522 -17.835 -11.427
    3    HB   ILE 804           HB       ILE 804  43.690 -18.647 -10.057
    4   HG12  ILE 804          HG12      ILE 804  41.823 -18.331 -11.707
    5   HG13  ILE 804          HG13      ILE 804  41.426 -17.807 -10.081
    6   HG21  ILE 804          HG21      ILE 804  44.879 -16.757  -9.180
    7   HG23  ILE 804          HG22      ILE 804  43.179 -16.664  -8.704
    8   HG22  ILE 804          HG23      ILE 804  43.788 -15.650 -10.015
    9   HD11  ILE 804          HD11      ILE 804  41.832 -15.474 -10.805
   10   HD13  ILE 804          HD12      ILE 804  40.522 -16.269 -11.670
   11   HD12  ILE 804          HD13      ILE 804  42.086 -16.064 -12.450

  No H/Q in entry =          11
  In of MODEL   40
    1    H    CYS 805           H        CYS 805  44.644 -20.121 -11.397
    2    HA   CYS 805           HA       CYS 805  43.962 -20.847 -14.148
    3    HB2  CYS 805           HB2      CYS 805  46.113 -21.667 -13.238
    4    HB3  CYS 805           HB3      CYS 805  45.241 -22.446 -11.926

  No H/Q in entry =           4
  In of MODEL   40
    1    H    VAL 806           H        VAL 806  42.009 -21.585 -14.500
    2    HA   VAL 806           HA       VAL 806  40.531 -22.718 -12.245
    3    HB   VAL 806           HB       VAL 806  39.427 -20.934 -14.396
    4   HG12  VAL 806          HG11      VAL 806  37.418 -20.850 -12.971
    5   HG11  VAL 806          HG12      VAL 806  38.136 -22.111 -11.953
    6   HG13  VAL 806          HG13      VAL 806  37.761 -22.447 -13.638
    7   HG21  VAL 806          HG21      VAL 806  39.986 -20.242 -11.519
    8   HG23  VAL 806          HG22      VAL 806  39.088 -19.233 -12.661
    9   HG22  VAL 806          HG23      VAL 806  40.784 -19.596 -12.956

  No H/Q in entry =           9
  In of MODEL   40
    1    H    GLU 807           H        GLU 807  39.612 -24.608 -12.699
    2    HA   GLU 807           HA       GLU 807  39.913 -25.711 -15.327
    3    HB2  GLU 807           HB2      GLU 807  40.374 -27.084 -13.339
    4    HB3  GLU 807           HB3      GLU 807  38.726 -26.859 -12.792
    5    HG2  GLU 807           HG2      GLU 807  37.908 -28.069 -14.754
    6    HG3  GLU 807           HG3      GLU 807  39.575 -28.271 -15.302

  No H/Q in entry =           6
  In of MODEL   40
    1    H    VAL 808           H        VAL 808  38.550 -25.365 -16.754
    2    HA   VAL 808           HA       VAL 808  35.702 -25.188 -16.174
    3    HB   VAL 808           HB       VAL 808  36.645 -22.919 -16.532
    4   HG11  VAL 808          HG11      VAL 808  38.504 -23.374 -17.950
    5   HG13  VAL 808          HG12      VAL 808  37.450 -22.182 -18.714
    6   HG12  VAL 808          HG13      VAL 808  37.434 -23.861 -19.264
    7   HG22  VAL 808          HG21      VAL 808  34.350 -23.253 -17.129
    8   HG21  VAL 808          HG22      VAL 808  34.827 -23.855 -18.722
    9   HG23  VAL 808          HG23      VAL 808  35.118 -22.165 -18.295

  No H/Q in entry =           9
  In of MODEL   40
    1    H    ASN 809           H        ASN 809  34.594 -26.510 -17.489
    2    HA   ASN 809           HA       ASN 809  34.105 -28.011 -19.171
    3    HB2  ASN 809           HB2      ASN 809  36.219 -26.368 -20.417
    4    HB3  ASN 809           HB3      ASN 809  35.612 -27.762 -21.333
    5   HD21  ASN 809          HD21      ASN 809  35.264 -24.554 -20.375
    6   HD22  ASN 809          HD22      ASN 809  33.763 -24.181 -21.123

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLY 810           H        GLY 810  36.357 -28.401 -17.133
    2    HA3  GLY 810           HA2      GLY 810  37.496 -30.380 -16.580
    3    HA2  GLY 810           HA3      GLY 810  37.324 -30.883 -18.268

  No H/Q in entry =           3
  In of MODEL   40
    1    H    LYS 811           H        LYS 811  38.351 -27.845 -18.517
    2    HA   LYS 811           HA       LYS 811  41.166 -28.686 -18.698
    3    HB2  LYS 811           HB2      LYS 811  39.619 -26.601 -20.189
    4    HB3  LYS 811           HB3      LYS 811  41.353 -26.857 -20.301
    5    HG2  LYS 811           HG2      LYS 811  41.037 -29.014 -21.269
    6    HG3  LYS 811           HG3      LYS 811  39.293 -28.929 -20.993
    7    HD2  LYS 811           HD2      LYS 811  39.913 -28.422 -23.304
    8    HD3  LYS 811           HD3      LYS 811  39.095 -27.084 -22.498
    9    HE2  LYS 811           HE2      LYS 811  41.267 -26.006 -22.073
   10    HE3  LYS 811           HE3      LYS 811  42.099 -27.321 -22.891
   11    HZ1  LYS 811           HZ1      LYS 811  40.141 -25.457 -24.104
   12    HZ3  LYS 811           HZ2      LYS 811  40.974 -26.681 -24.933
   13    HZ2  LYS 811           HZ3      LYS 811  41.816 -25.368 -24.289

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLU 812           H        GLU 812  42.707 -27.353 -17.858
    2    HA   GLU 812           HA       GLU 812  41.759 -25.321 -16.030
    3    HB2  GLU 812           HB2      GLU 812  44.509 -26.437 -16.523
    4    HB3  GLU 812           HB3      GLU 812  44.166 -25.154 -15.373
    5    HG2  GLU 812           HG2      GLU 812  42.654 -26.683 -14.177
    6    HG3  GLU 812           HG3      GLU 812  43.119 -27.964 -15.296

  No H/Q in entry =           6
  In of MODEL   40
    1    H    GLN 813           H        GLN 813  41.276 -23.504 -16.893
    2    HA   GLN 813           HA       GLN 813  43.041 -22.418 -18.944
    3    HB2  GLN 813           HB2      GLN 813  40.890 -22.841 -19.824
    4    HB3  GLN 813           HB3      GLN 813  40.091 -22.099 -18.448
    5    HG2  GLN 813           HG2      GLN 813  40.802 -19.933 -19.157
    6    HG3  GLN 813           HG3      GLN 813  41.780 -20.627 -20.458
    7   HE21  GLN 813          HE21      GLN 813  39.493 -18.754 -20.484
    8   HE22  GLN 813          HE22      GLN 813  38.357 -19.462 -21.562

  No H/Q in entry =           8
  In of MODEL   40
    1    H    THR 814           H        THR 814  43.907 -20.484 -18.630
    2    HA   THR 814           HA       THR 814  43.946 -19.376 -16.000
    3    HB   THR 814           HB       THR 814  45.000 -18.195 -18.560
    4    HG1  THR 814           HG1      THR 814  46.964 -19.280 -17.957
    5   HG21  THR 814          HG21      THR 814  45.813 -17.819 -15.669
    6   HG23  THR 814          HG22      THR 814  44.972 -16.639 -16.672
    7   HG22  THR 814          HG23      THR 814  46.634 -17.089 -17.047

  No H/Q in entry =           7
  In of MODEL   40
    1    H    MET 815           H        MET 815  42.663 -17.807 -15.265
    2    HA   MET 815           HA       MET 815  41.213 -16.157 -17.220
    3    HB2  MET 815           HB2      MET 815  40.107 -16.952 -14.522
    4    HB3  MET 815           HB3      MET 815  39.273 -16.108 -15.810
    5    HG2  MET 815           HG2      MET 815  39.663 -18.317 -17.150
    6    HG3  MET 815           HG3      MET 815  40.015 -18.924 -15.536
    7    HE2  MET 815           HE1      MET 815  36.546 -20.442 -16.340
    8    HE1  MET 815           HE2      MET 815  38.259 -20.752 -16.003
    9    HE3  MET 815           HE3      MET 815  37.788 -20.017 -17.523

  No H/Q in entry =           9
  In of MODEL   40
    1    H    SER 816           H        SER 816  40.826 -14.053 -16.449
    2    HA   SER 816           HA       SER 816  42.742 -13.182 -14.496
    3    HB2  SER 816           HB2      SER 816  40.519 -11.651 -15.887
    4    HB3  SER 816           HB3      SER 816  41.756 -10.929 -14.857
    5    HG   SER 816           HG       SER 816  42.044 -12.182 -17.362

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLU 817           H        GLU 817  42.156 -12.228 -12.520
    2    HA   GLU 817           HA       GLU 817  40.603 -13.773 -10.903
    3    HB2  GLU 817           HB2      GLU 817  42.409 -12.116 -10.376
    4    HB3  GLU 817           HB3      GLU 817  41.168 -10.887 -10.499
    5    HG2  GLU 817           HG2      GLU 817  39.920 -11.982  -8.670
    6    HG3  GLU 817           HG3      GLU 817  41.187 -13.197  -8.698

  No H/Q in entry =           6
  In of MODEL   40
    1    H    CYS 818           H        CYS 818  39.772 -10.607 -12.227
    2    HA   CYS 818           HA       CYS 818  37.221 -10.361 -11.138
    3    HB2  CYS 818           HB2      CYS 818  38.115  -9.277 -13.809
    4    HB3  CYS 818           HB3      CYS 818  36.888  -8.623 -12.724

  No H/Q in entry =           4
  In of MODEL   40
    1    H    GLU 819           H        GLU 819  38.378 -11.987 -14.012
    2    HA   GLU 819           HA       GLU 819  35.883 -12.457 -15.249
    3    HB2  GLU 819           HB2      GLU 819  37.859 -12.493 -16.585
    4    HB3  GLU 819           HB3      GLU 819  38.616 -13.649 -15.508
    5    HG2  GLU 819           HG2      GLU 819  37.395 -15.418 -16.334
    6    HG3  GLU 819           HG3      GLU 819  36.196 -14.416 -17.116

  No H/Q in entry =           6
  In of MODEL   40
    1    H    ALA 820           H        ALA 820  38.109 -14.705 -13.590
    2    HA   ALA 820           HA       ALA 820  36.502 -16.883 -13.494
    3    HB2  ALA 820           HB1      ALA 820  37.815 -17.628 -11.568
    4    HB3  ALA 820           HB2      ALA 820  38.423 -15.988 -11.362
    5    HB1  ALA 820           HB3      ALA 820  38.826 -16.902 -12.819

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLY 821           H        GLY 821  36.697 -14.201 -11.165
    2    HA3  GLY 821           HA2      GLY 821  34.904 -15.177  -9.233
    3    HA2  GLY 821           HA3      GLY 821  35.339 -13.491  -9.469

  No H/Q in entry =           3
  In of MODEL   40
    1    H    ALA 822           H        ALA 822  34.366 -13.182 -12.109
    2    HA   ALA 822           HA       ALA 822  31.687 -12.568 -11.597
    3    HB2  ALA 822           HB1      ALA 822  33.036 -11.407 -13.294
    4    HB3  ALA 822           HB2      ALA 822  31.524 -12.019 -13.954
    5    HB1  ALA 822           HB3      ALA 822  33.039 -12.871 -14.283

  No H/Q in entry =           5
  In of MODEL   40
    1    H    LEU 823           H        LEU 823  33.186 -15.213 -13.390
    2    HA   LEU 823           HA       LEU 823  30.743 -16.416 -14.113
    3    HB2  LEU 823           HB2      LEU 823  33.499 -17.612 -13.922
    4    HB3  LEU 823           HB3      LEU 823  32.116 -18.570 -14.381
    5    HG   LEU 823           HG       LEU 823  33.052 -18.077 -16.403
    6   HD11  LEU 823          HD11      LEU 823  30.749 -17.518 -16.524
    7   HD13  LEU 823          HD12      LEU 823  31.684 -16.467 -17.586
    8   HD12  LEU 823          HD13      LEU 823  31.087 -15.851 -16.055
    9   HD23  LEU 823          HD21      LEU 823  33.967 -15.907 -17.101
   10   HD22  LEU 823          HD22      LEU 823  34.796 -16.558 -15.692
   11   HD21  LEU 823          HD23      LEU 823  33.622 -15.261 -15.500

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ARG 824           H        ARG 824  32.694 -16.756 -11.187
    2    HA   ARG 824           HA       ARG 824  31.307 -18.956 -10.078
    3    HB2  ARG 824           HB2      ARG 824  32.771 -16.726  -8.648
    4    HB3  ARG 824           HB3      ARG 824  32.286 -18.261  -7.940
    5    HG2  ARG 824           HG2      ARG 824  33.798 -19.439  -9.447
    6    HG3  ARG 824           HG3      ARG 824  34.279 -17.902 -10.172
    7    HD2  ARG 824           HD2      ARG 824  35.938 -18.617  -8.574
    8    HD3  ARG 824           HD3      ARG 824  35.107 -17.188  -7.956
    9    HE   ARG 824           HE       ARG 824  33.780 -19.445  -7.081
   10   HH11  ARG 824          HH11      ARG 824  36.877 -17.818  -6.458
   11   HH12  ARG 824          HH12      ARG 824  37.095 -18.467  -4.898
   12   HH21  ARG 824          HH21      ARG 824  34.086 -20.359  -4.908
   13   HH22  ARG 824          HH22      ARG 824  35.485 -19.973  -4.017

  No H/Q in entry =          13
  In of MODEL   40
    1    H    CYS 825           H        CYS 825  30.431 -15.642 -10.392
    2    HA   CYS 825           HA       CYS 825  28.438 -15.847  -8.299
    3    HB2  CYS 825           HB2      CYS 825  29.560 -13.606  -8.571
    4    HB3  CYS 825           HB3      CYS 825  29.024 -13.622 -10.235

  No H/Q in entry =           4
  In of MODEL   40
    1    H    ARG 826           H        ARG 826  28.859 -15.365 -11.729
    2    HA   ARG 826           HA       ARG 826  26.400 -14.891 -12.652
    3    HB2  ARG 826           HB2      ARG 826  28.481 -14.721 -13.882
    4    HB3  ARG 826           HB3      ARG 826  28.584 -16.481 -13.934
    5    HG2  ARG 826           HG2      ARG 826  26.444 -16.515 -15.016
    6    HG3  ARG 826           HG3      ARG 826  26.529 -14.732 -15.054
    7    HD2  ARG 826           HD2      ARG 826  28.500 -14.807 -16.460
    8    HD3  ARG 826           HD3      ARG 826  28.582 -16.555 -16.296
    9    HE   ARG 826           HE       ARG 826  26.533 -16.702 -17.534
   10   HH11  ARG 826          HH11      ARG 826  28.257 -13.598 -17.776
   11   HH12  ARG 826          HH12      ARG 826  27.697 -13.261 -19.345
   12   HH21  ARG 826          HH21      ARG 826  25.761 -16.212 -19.661
   13   HH22  ARG 826          HH22      ARG 826  26.200 -14.720 -20.405

  No H/Q in entry =          13
  In of MODEL   40
    1    H    GLY 827           H        GLY 827  27.882 -18.137 -12.291
    2    HA3  GLY 827           HA2      GLY 827  26.072 -19.859 -11.696
    3    HA2  GLY 827           HA3      GLY 827  25.271 -19.183 -13.116

  No H/Q in entry =           3
  In of MODEL   40
    1    H    GLN 828           H        GLN 828  28.287 -18.987 -13.965
    2    HA   GLN 828           HA       GLN 828  28.207 -21.303 -15.638
    3    HB2  GLN 828           HB2      GLN 828  29.159 -19.194 -16.404
    4    HB3  GLN 828           HB3      GLN 828  30.344 -19.236 -15.110
    5    HG2  GLN 828           HG2      GLN 828  31.324 -19.853 -17.246
    6    HG3  GLN 828           HG3      GLN 828  31.367 -21.190 -16.094
    7   HE21  GLN 828          HE21      GLN 828  29.846 -19.976 -18.970
    8   HE22  GLN 828          HE22      GLN 828  29.244 -21.495 -19.507

  No H/Q in entry =           8
  In of MODEL   40
    1    H    SER 829           H        SER 829  29.568 -23.110 -15.502
    2    HA   SER 829           HA       SER 829  30.375 -23.747 -12.799
    3    HB2  SER 829           HB2      SER 829  30.338 -25.454 -15.298
    4    HB3  SER 829           HB3      SER 829  30.563 -26.032 -13.643
    5    HG   SER 829           HG       SER 829  28.354 -24.590 -13.658

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ILE 830           H        ILE 830  32.335 -23.155 -12.188
    2    HA   ILE 830           HA       ILE 830  34.610 -23.809 -13.850
    3    HB   ILE 830           HB       ILE 830  35.743 -21.705 -13.504
    4   HG12  ILE 830          HG12      ILE 830  34.766 -21.089 -11.310
    5   HG13  ILE 830          HG13      ILE 830  34.812 -19.719 -12.389
    6   HG21  ILE 830          HG21      ILE 830  33.037 -21.208 -14.652
    7   HG23  ILE 830          HG22      ILE 830  34.481 -21.754 -15.508
    8   HG22  ILE 830          HG23      ILE 830  34.413 -20.118 -14.838
    9   HD13  ILE 830          HD11      ILE 830  32.772 -19.712 -11.166
   10   HD12  ILE 830          HD12      ILE 830  32.429 -21.379 -11.617
   11   HD11  ILE 830          HD13      ILE 830  32.391 -20.109 -12.842

  No H/Q in entry =          11
  In of MODEL   40
    1    H    SER 831           H        SER 831  36.401 -24.377 -12.626
    2    HA   SER 831           HA       SER 831  36.002 -24.400  -9.729
    3    HB2  SER 831           HB2      SER 831  37.184 -26.452 -11.565
    4    HB3  SER 831           HB3      SER 831  37.172 -26.560  -9.811
    5    HG   SER 831           HG       SER 831  35.440 -27.648 -11.099

  No H/Q in entry =           5
  In of MODEL   40
    1    H    VAL 832           H        VAL 832  37.464 -22.718  -9.151
    2    HA   VAL 832           HA       VAL 832  39.947 -22.358 -10.414
    3    HB   VAL 832           HB       VAL 832  39.029 -20.517  -9.157
    4   HG12  VAL 832          HG11      VAL 832  39.392 -22.171  -6.659
    5   HG11  VAL 832          HG12      VAL 832  37.853 -21.696  -7.381
    6   HG13  VAL 832          HG13      VAL 832  38.919 -20.473  -6.694
    7   HG21  VAL 832          HG21      VAL 832  41.600 -21.468  -7.899
    8   HG23  VAL 832          HG22      VAL 832  40.980 -19.824  -7.805
    9   HG22  VAL 832          HG23      VAL 832  41.431 -20.506  -9.367

  No H/Q in entry =           9
  In of MODEL   40
    1    H    THR 833           H        THR 833  41.635 -23.588 -10.448
    2    HA   THR 833           HA       THR 833  41.832 -25.670  -8.462
    3    HB   THR 833           HB       THR 833  43.613 -26.550 -10.048
    4    HG1  THR 833           HG1      THR 833  43.772 -25.629 -12.019
    5   HG23  THR 833          HG21      THR 833  41.969 -27.355 -11.690
    6   HG22  THR 833          HG22      THR 833  40.840 -26.110 -11.162
    7   HG21  THR 833          HG23      THR 833  41.307 -27.398 -10.054

  No H/Q in entry =           7
  In of MODEL   40
    1    H    SER 834           H        SER 834  43.599 -22.876  -9.666
    2    HA   SER 834           HA       SER 834  45.134 -22.923  -7.252
    3    HB2  SER 834           HB2      SER 834  47.319 -22.765  -8.414
    4    HB3  SER 834           HB3      SER 834  46.522 -24.316  -8.680
    5    HG   SER 834           HG       SER 834  46.264 -23.865 -10.706

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ILE 835           H        ILE 835  46.335 -20.956  -6.963
    2    HA   ILE 835           HA       ILE 835  44.808 -18.723  -8.005
    3    HB   ILE 835           HB       ILE 835  45.776 -17.371  -6.362
    4   HG12  ILE 835          HG12      ILE 835  48.146 -18.045  -6.513
    5   HG13  ILE 835          HG13      ILE 835  47.607 -17.957  -4.851
    6   HG22  ILE 835          HG21      ILE 835  45.324 -18.562  -4.264
    7   HG21  ILE 835          HG22      ILE 835  45.155 -20.047  -5.219
    8   HG23  ILE 835          HG23      ILE 835  44.076 -18.682  -5.504
    9   HD12  ILE 835          HD11      ILE 835  48.047 -20.435  -6.490
   10   HD11  ILE 835          HD12      ILE 835  47.406 -20.394  -4.845
   11   HD13  ILE 835          HD13      ILE 835  49.056 -19.841  -5.161

  No H/Q in entry =          11
  In of MODEL   40
    1    H    ARG 836           H        ARG 836  47.328 -20.334  -9.191
    2    HA   ARG 836           HA       ARG 836  48.786 -17.933  -9.996
    3    HB2  ARG 836           HB2      ARG 836  50.616 -19.353 -10.591
    4    HB3  ARG 836           HB3      ARG 836  50.125 -19.684  -8.943
    5    HG2  ARG 836           HG2      ARG 836  49.008 -21.708  -9.672
    6    HG3  ARG 836           HG3      ARG 836  49.465 -21.356 -11.349
    7    HD2  ARG 836           HD2      ARG 836  51.770 -21.307 -10.710
    8    HD3  ARG 836           HD3      ARG 836  51.312 -21.667  -9.048
    9    HE   ARG 836           HE       ARG 836  50.487 -23.573 -11.094
   10   HH11  ARG 836          HH11      ARG 836  52.831 -22.795  -8.559
   11   HH12  ARG 836          HH12      ARG 836  53.400 -24.386  -8.377
   12   HH21  ARG 836          HH21      ARG 836  51.273 -25.785 -10.873
   13   HH22  ARG 836          HH22      ARG 836  52.506 -26.126  -9.755

  No H/Q in entry =          13
  In of MODEL   40
    1    HA   PRO 837           HA       PRO 837  47.053 -18.445 -14.000
    2    HB2  PRO 837           HB2      PRO 837  49.081 -17.560 -15.616
    3    HB3  PRO 837           HB3      PRO 837  48.045 -16.471 -14.689
    4    HG2  PRO 837           HG2      PRO 837  50.792 -17.462 -14.056
    5    HG3  PRO 837           HG3      PRO 837  50.115 -15.836 -13.849
    6    HD2  PRO 837           HD2      PRO 837  50.380 -17.573 -11.796
    7    HD3  PRO 837           HD3      PRO 837  49.058 -16.392 -11.879

  No H/Q in entry =           7
  In of MODEL   40
    1    H    CYS 838           H        CYS 838  47.113 -19.885 -15.729
    2    HA   CYS 838           HA       CYS 838  49.013 -22.092 -15.455
    3    HB2  CYS 838           HB2      CYS 838  46.530 -22.517 -15.373
    4    HB3  CYS 838           HB3      CYS 838  46.438 -21.847 -17.001

  No H/Q in entry =           4
  In of MODEL   40
    1    H    ALA 839           H        ALA 839  49.476 -23.097 -17.760
    2    HA   ALA 839           HA       ALA 839  50.715 -21.105 -19.350
    3    HB2  ALA 839           HB1      ALA 839  50.299 -24.050 -19.884
    4    HB1  ALA 839           HB2      ALA 839  51.692 -23.336 -19.074
    5    HB3  ALA 839           HB3      ALA 839  51.392 -22.995 -20.778

  No H/Q in entry =           5
  In of MODEL   40
    1    H    ALA 840           H        ALA 840  47.620 -21.972 -19.105
    2    HA   ALA 840           HA       ALA 840  46.801 -21.902 -21.875
    3    HB2  ALA 840           HB1      ALA 840  45.184 -21.907 -19.338
    4    HB3  ALA 840           HB2      ALA 840  45.670 -23.333 -20.252
    5    HB1  ALA 840           HB3      ALA 840  44.557 -22.161 -20.965

  No H/Q in entry =           5
  In of MODEL   40
    1    H    GLU 841           H        GLU 841  48.137 -19.536 -20.496
    2    HA   GLU 841           HA       GLU 841  46.017 -17.567 -20.820
    3    HB2  GLU 841           HB2      GLU 841  47.630 -15.876 -20.029
    4    HB3  GLU 841           HB3      GLU 841  47.501 -17.205 -18.897
    5    HG2  GLU 841           HG2      GLU 841  49.629 -18.070 -19.599
    6    HG3  GLU 841           HG3      GLU 841  49.723 -16.882 -20.900

  No H/Q in entry =           6
  In of MODEL   40
    1    H    THR 842           H        THR 842  48.065 -19.231 -22.637
    2    HA   THR 842           HA       THR 842  48.020 -17.299 -24.811
    3    HB   THR 842           HB       THR 842  50.229 -19.311 -24.243
    4    HG1  THR 842           HG1      THR 842  50.264 -16.495 -23.875
    5   HG21  THR 842          HG21      THR 842  49.952 -18.657 -26.606
    6   HG23  THR 842          HG22      THR 842  51.463 -18.036 -25.943
    7   HG22  THR 842          HG23      THR 842  50.078 -16.960 -26.142

  No H/Q in entry =           7
  In of MODEL   40
    1    H    GLN 843           H        GLN 843  47.514 -18.368 -26.781
    2    HA   GLN 843           HA       GLN 843  46.478 -21.087 -26.424
    3    HB2  GLN 843           HB2      GLN 843  45.881 -19.156 -28.668
    4    HB3  GLN 843           HB3      GLN 843  45.024 -20.641 -28.285
    5    HG2  GLN 843           HG2      GLN 843  44.245 -19.626 -26.191
    6    HG3  GLN 843           HG3      GLN 843  45.076 -18.134 -26.624
    7   HE21  GLN 843          HE21      GLN 843  42.312 -18.514 -26.136
    8   HE22  GLN 843          HE22      GLN 843  41.467 -18.070 -27.574

  No H/Q in entry =           8
  In of MODEL   41
    1    H1   GLY 689           H2       GLY 689  55.207   9.481 -14.888
    2    H2   GLY 689           H1       GLY 689  55.558   8.158 -15.832
    3    H3   GLY 689           H3       GLY 689  56.683   9.415 -15.710
    4    HA2  GLY 689           HA2      GLY 689  55.423   9.454 -17.808
    5    HA3  GLY 689           HA3      GLY 689  55.188  10.910 -16.840

  No H/Q in entry =           5
  In of MODEL   41
    1    H    SER 690           H        SER 690  53.496   9.305 -18.817
    2    HA   SER 690           HA       SER 690  51.003   9.724 -17.518
    3    HB2  SER 690           HB2      SER 690  51.339  10.028 -19.970
    4    HB3  SER 690           HB3      SER 690  51.638   8.301 -20.128
    5    HG   SER 690           HG       SER 690  49.239   9.364 -19.054

  No H/Q in entry =           5
  In of MODEL   41
    1    H    HIS 691           H        HIS 691  49.578   8.208 -16.711
    2    HA   HIS 691           HA       HIS 691  48.749   6.320 -15.821
    3    HB2  HIS 691           HB2      HIS 691  50.733   4.992 -17.646
    4    HB3  HIS 691           HB3      HIS 691  49.783   4.046 -16.519
    5    HD1  HIS 691           HD1      HIS 691  47.221   3.898 -17.006
    6    HD2  HIS 691           HD2      HIS 691  49.423   5.921 -19.886
    7    HE1  HIS 691           HE1      HIS 691  45.734   4.055 -18.991
    8    HE2  HIS 691           HE2      HIS 691  46.985   5.487 -20.615

  No H/Q in entry =           8
  In of MODEL   41
    1    H    MET 692           H        MET 692  49.528   4.228 -14.541
    2    HA   MET 692           HA       MET 692  51.307   5.241 -12.517
    3    HB2  MET 692           HB2      MET 692  49.869   2.577 -12.756
    4    HB3  MET 692           HB3      MET 692  50.814   3.072 -11.370
    5    HG2  MET 692           HG2      MET 692  48.496   3.337 -10.855
    6    HG3  MET 692           HG3      MET 692  49.221   4.933 -10.993
    7    HE3  MET 692           HE1      MET 692  46.049   4.316 -10.989
    8    HE2  MET 692           HE2      MET 692  45.535   5.474 -12.216
    9    HE1  MET 692           HE3      MET 692  46.769   5.923 -11.041

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ASN 693           H        ASN 693  51.288   2.940 -15.110
    2    HA   ASN 693           HA       ASN 693  54.086   2.385 -14.565
    3    HB2  ASN 693           HB2      ASN 693  53.836   0.227 -15.725
    4    HB3  ASN 693           HB3      ASN 693  52.699   0.330 -14.395
    5   HD21  ASN 693          HD21      ASN 693  52.646  -1.398 -16.682
    6   HD22  ASN 693          HD22      ASN 693  51.165  -1.094 -17.512

  No H/Q in entry =           6
  In of MODEL   41
    1    HA   PRO 694           HA       PRO 694  54.929   4.508 -18.340
    2    HB2  PRO 694           HB2      PRO 694  57.068   2.576 -18.951
    3    HB3  PRO 694           HB3      PRO 694  57.185   4.306 -18.626
    4    HG2  PRO 694           HG2      PRO 694  58.043   2.480 -16.853
    5    HG3  PRO 694           HG3      PRO 694  57.302   4.005 -16.336
    6    HD2  PRO 694           HD2      PRO 694  56.101   1.266 -16.478
    7    HD3  PRO 694           HD3      PRO 694  55.935   2.519 -15.225

  No H/Q in entry =           7
  In of MODEL   41
    1    H    LEU 695           H        LEU 695  54.563   4.382 -20.511
    2    HA   LEU 695           HA       LEU 695  53.315   1.931 -21.442
    3    HB2  LEU 695           HB2      LEU 695  53.568   4.637 -22.769
    4    HB3  LEU 695           HB3      LEU 695  52.621   3.296 -23.371
    5    HG   LEU 695           HG       LEU 695  52.090   4.884 -20.861
    6   HD12  LEU 695          HD11      LEU 695  50.589   4.684 -23.457
    7   HD11  LEU 695          HD12      LEU 695  51.543   6.054 -22.896
    8   HD13  LEU 695          HD13      LEU 695  50.076   5.589 -22.032
    9   HD23  LEU 695          HD21      LEU 695  50.039   3.558 -20.669
   10   HD22  LEU 695          HD22      LEU 695  51.479   2.555 -20.514
   11   HD21  LEU 695          HD23      LEU 695  50.563   2.554 -22.022

  No H/Q in entry =          11
  In of MODEL   41
    1    H    THR 696           H        THR 696  54.383   0.543 -22.623
    2    HA   THR 696           HA       THR 696  56.033  -0.552 -23.665
    3    HB   THR 696           HB       THR 696  57.129   0.529 -25.652
    4    HG1  THR 696           HG1      THR 696  56.386   2.799 -24.371
    5   HG22  THR 696          HG21      THR 696  54.174   1.110 -25.459
    6   HG21  THR 696          HG22      THR 696  54.897  -0.433 -25.909
    7   HG23  THR 696          HG23      THR 696  55.102   0.975 -26.953

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLN 697           H        GLN 697  58.586   0.242 -24.602
    2    HA   GLN 697           HA       GLN 697  60.638   0.791 -24.090
    3    HB2  GLN 697           HB2      GLN 697  59.618   2.220 -21.616
    4    HB3  GLN 697           HB3      GLN 697  61.228   2.344 -22.296
    5    HG2  GLN 697           HG2      GLN 697  58.655   3.390 -23.464
    6    HG3  GLN 697           HG3      GLN 697  60.017   4.319 -22.853
    7   HE21  GLN 697          HE21      GLN 697  58.679   2.639 -25.517
    8   HE22  GLN 697          HE22      GLN 697  59.918   2.978 -26.655

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ALA 698           H        ALA 698  62.251   0.612 -22.071
    2    HA   ALA 698           HA       ALA 698  61.966  -2.133 -21.337
    3    HB2  ALA 698           HB1      ALA 698  64.210  -0.213 -20.714
    4    HB1  ALA 698           HB2      ALA 698  64.121  -1.259 -22.126
    5    HB3  ALA 698           HB3      ALA 698  64.252  -1.966 -20.516

  No H/Q in entry =           5
  In of MODEL   41
    1    H    VAL 699           H        VAL 699  60.773  -2.610 -19.669
    2    HA   VAL 699           HA       VAL 699  61.304  -1.379 -17.135
    3    HB   VAL 699           HB       VAL 699  59.473   0.023 -17.957
    4   HG12  VAL 699          HG11      VAL 699  57.240  -0.856 -18.469
    5   HG11  VAL 699          HG12      VAL 699  57.878  -2.497 -18.349
    6   HG13  VAL 699          HG13      VAL 699  58.467  -1.413 -19.608
    7   HG22  VAL 699          HG21      VAL 699  59.456  -0.448 -15.582
    8   HG21  VAL 699          HG22      VAL 699  58.511  -1.911 -15.851
    9   HG23  VAL 699          HG23      VAL 699  57.798  -0.331 -16.173

  No H/Q in entry =           9
  In of MODEL   41
    1    HA   PRO 700           HA       PRO 700  61.074  -5.752 -16.296
    2    HB2  PRO 700           HB2      PRO 700  61.015  -5.106 -13.468
    3    HB3  PRO 700           HB3      PRO 700  62.271  -5.924 -14.389
    4    HG2  PRO 700           HG2      PRO 700  62.428  -3.375 -13.348
    5    HG3  PRO 700           HG3      PRO 700  63.476  -4.008 -14.627
    6    HD2  PRO 700           HD2      PRO 700  61.257  -2.079 -14.771
    7    HD3  PRO 700           HD3      PRO 700  62.585  -2.364 -15.911

  No H/Q in entry =           7
  In of MODEL   41
    1    H    LYS 701           H        LYS 701  59.318  -6.958 -16.192
    2    HA   LYS 701           HA       LYS 701  56.845  -5.816 -15.232
    3    HB2  LYS 701           HB2      LYS 701  57.413  -8.542 -16.433
    4    HB3  LYS 701           HB3      LYS 701  55.820  -7.885 -16.096
    5    HG2  LYS 701           HG2      LYS 701  57.793  -6.759 -18.081
    6    HG3  LYS 701           HG3      LYS 701  56.401  -7.771 -18.467
    7    HD2  LYS 701           HD2      LYS 701  54.896  -6.055 -17.595
    8    HD3  LYS 701           HD3      LYS 701  56.279  -5.056 -17.151
    9    HE2  LYS 701           HE2      LYS 701  55.279  -4.301 -19.239
   10    HE3  LYS 701           HE3      LYS 701  56.920  -4.884 -19.501
   11    HZ1  LYS 701           HZ1      LYS 701  54.424  -6.397 -20.086
   12    HZ3  LYS 701           HZ2      LYS 701  55.995  -6.957 -20.349
   13    HZ2  LYS 701           HZ3      LYS 701  55.419  -5.650 -21.220

  No H/Q in entry =          13
  In of MODEL   41
    1    H    CYS 702           H        CYS 702  55.816  -6.444 -13.401
    2    HA   CYS 702           HA       CYS 702  57.378  -8.160 -11.606
    3    HB2  CYS 702           HB2      CYS 702  55.073  -6.338 -10.821
    4    HB3  CYS 702           HB3      CYS 702  56.266  -7.095  -9.801

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLN 703           H        GLN 703  56.222  -9.779 -10.436
    2    HA   GLN 703           HA       GLN 703  54.135 -10.964 -11.969
    3    HB2  GLN 703           HB2      GLN 703  55.274 -11.702  -9.264
    4    HB3  GLN 703           HB3      GLN 703  54.203 -12.711 -10.224
    5    HG2  GLN 703           HG2      GLN 703  56.980 -11.832 -11.019
    6    HG3  GLN 703           HG3      GLN 703  56.532 -13.422 -10.413
    7   HE21  GLN 703          HE21      GLN 703  57.730 -12.556 -12.985
    8   HE22  GLN 703          HE22      GLN 703  56.681 -13.197 -14.194

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ARG 704           H        ARG 704  52.175 -11.775 -10.618
    2    HA   ARG 704           HA       ARG 704  50.780  -9.401 -10.061
    3    HB2  ARG 704           HB2      ARG 704  49.997 -12.253 -10.193
    4    HB3  ARG 704           HB3      ARG 704  48.921 -11.180  -9.312
    5    HG2  ARG 704           HG2      ARG 704  49.838 -10.691 -12.145
    6    HG3  ARG 704           HG3      ARG 704  48.309 -11.476 -11.715
    7    HD2  ARG 704           HD2      ARG 704  47.605  -9.532 -10.496
    8    HD3  ARG 704           HD3      ARG 704  49.144  -8.742 -10.773
    9    HE   ARG 704           HE       ARG 704  47.446  -9.428 -13.061
   10   HH11  ARG 704          HH11      ARG 704  49.039  -6.964 -11.060
   11   HH12  ARG 704          HH12      ARG 704  48.476  -5.635 -11.935
   12   HH21  ARG 704          HH21      ARG 704  46.662  -7.605 -14.316
   13   HH22  ARG 704          HH22      ARG 704  47.039  -6.008 -13.856

  No H/Q in entry =          13
  In of MODEL   41
    1    H    TRP 705           H        TRP 705  52.572 -11.286  -8.000
    2    HA   TRP 705           HA       TRP 705  51.237 -10.138  -5.671
    3    HB2  TRP 705           HB2      TRP 705  52.612 -11.806  -4.349
    4    HB3  TRP 705           HB3      TRP 705  51.420 -12.528  -5.415
    5    HD1  TRP 705           HD1      TRP 705  55.126 -12.394  -4.724
    6    HE1  TRP 705           HE1      TRP 705  56.358 -13.949  -6.308
    7    HE3  TRP 705           HE3      TRP 705  51.252 -13.582  -7.849
    8    HZ2  TRP 705           HZ2      TRP 705  55.758 -15.527  -8.618
    9    HZ3  TRP 705           HZ3      TRP 705  51.667 -15.137  -9.695
   10    HH2  TRP 705           HH2      TRP 705  53.875 -16.089 -10.070

  No H/Q in entry =          10
  In of MODEL   41
    1    H    GLU 706           H        GLU 706  53.374  -9.098  -7.732
    2    HA   GLU 706           HA       GLU 706  55.227  -8.084  -5.718
    3    HB2  GLU 706           HB2      GLU 706  55.869  -8.937  -8.528
    4    HB3  GLU 706           HB3      GLU 706  56.955  -8.005  -7.506
    5    HG2  GLU 706           HG2      GLU 706  56.897  -9.871  -5.867
    6    HG3  GLU 706           HG3      GLU 706  55.954 -10.797  -7.037

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LYS 707           H        LYS 707  56.313  -6.167  -6.274
    2    HA   LYS 707           HA       LYS 707  55.065  -4.360  -8.163
    3    HB2  LYS 707           HB2      LYS 707  54.822  -2.594  -6.453
    4    HB3  LYS 707           HB3      LYS 707  53.780  -3.966  -6.110
    5    HG2  LYS 707           HG2      LYS 707  55.392  -4.756  -4.422
    6    HG3  LYS 707           HG3      LYS 707  56.414  -3.362  -4.757
    7    HD2  LYS 707           HD2      LYS 707  53.565  -3.219  -3.755
    8    HD3  LYS 707           HD3      LYS 707  54.994  -3.083  -2.735
    9    HE2  LYS 707           HE2      LYS 707  54.329  -1.230  -5.029
   10    HE3  LYS 707           HE3      LYS 707  53.977  -0.894  -3.345
   11    HZ2  LYS 707           HZ1      LYS 707  55.994   0.184  -4.054
   12    HZ1  LYS 707           HZ2      LYS 707  56.717  -1.277  -4.469
   13    HZ3  LYS 707           HZ3      LYS 707  56.342  -0.937  -2.856

  No H/Q in entry =          13
  In of MODEL   41
    1    H    LEU 708           H        LEU 708  56.551  -2.546  -8.631
    2    HA   LEU 708           HA       LEU 708  59.252  -3.350  -8.005
    3    HB2  LEU 708           HB2      LEU 708  58.590  -3.157 -10.388
    4    HB3  LEU 708           HB3      LEU 708  58.263  -1.453 -10.152
    5    HG   LEU 708           HG       LEU 708  60.954  -2.596  -9.625
    6   HD12  LEU 708          HD11      LEU 708  61.533  -2.029 -11.978
    7   HD11  LEU 708          HD12      LEU 708  59.823  -1.727 -12.298
    8   HD13  LEU 708          HD13      LEU 708  60.375  -3.347 -11.853
    9   HD22  LEU 708          HD21      LEU 708  61.720  -0.350 -10.286
   10   HD21  LEU 708          HD22      LEU 708  60.575  -0.284  -8.946
   11   HD23  LEU 708          HD23      LEU 708  60.046   0.126 -10.579

  No H/Q in entry =          11
  In of MODEL   41
    1    H    GLN 709           H        GLN 709  60.475  -2.326  -6.695
    2    HA   GLN 709           HA       GLN 709  60.363   0.540  -6.370
    3    HB2  GLN 709           HB2      GLN 709  60.174   0.540  -3.995
    4    HB3  GLN 709           HB3      GLN 709  58.857  -0.473  -4.553
    5    HG2  GLN 709           HG2      GLN 709  60.290  -2.462  -4.089
    6    HG3  GLN 709           HG3      GLN 709  61.471  -1.367  -3.364
    7   HE21  GLN 709          HE21      GLN 709  61.249  -2.294  -1.342
    8   HE22  GLN 709          HE22      GLN 709  59.840  -2.081  -0.372

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ASN 710           H        ASN 710  62.406   1.278  -5.632
    2    HA   ASN 710           HA       ASN 710  64.691   1.214  -5.239
    3    HB2  ASN 710           HB2      ASN 710  63.808  -0.278  -3.356
    4    HB3  ASN 710           HB3      ASN 710  64.239  -1.653  -4.346
    5   HD21  ASN 710          HD21      ASN 710  65.383   0.927  -2.443
    6   HD22  ASN 710          HD22      ASN 710  67.046   0.447  -2.328

  No H/Q in entry =           6
  In of MODEL   41
    1    H    SER 711           H        SER 711  63.463   0.371  -7.725
    2    HA   SER 711           HA       SER 711  63.962  -0.320  -9.780
    3    HB2  SER 711           HB2      SER 711  66.769  -0.483  -8.675
    4    HB3  SER 711           HB3      SER 711  66.365  -0.511 -10.401
    5    HG   SER 711           HG       SER 711  65.958   1.585  -8.517

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ARG 712           H        ARG 712  63.306  -2.313  -7.588
    2    HA   ARG 712           HA       ARG 712  63.936  -4.689  -9.167
    3    HB2  ARG 712           HB2      ARG 712  64.333  -6.002  -7.136
    4    HB3  ARG 712           HB3      ARG 712  65.538  -4.745  -7.331
    5    HG2  ARG 712           HG2      ARG 712  64.326  -3.373  -5.657
    6    HG3  ARG 712           HG3      ARG 712  63.161  -4.677  -5.494
    7    HD2  ARG 712           HD2      ARG 712  64.853  -4.726  -3.690
    8    HD3  ARG 712           HD3      ARG 712  64.889  -6.179  -4.694
    9    HE   ARG 712           HE       ARG 712  66.698  -4.579  -5.874
   10   HH11  ARG 712          HH11      ARG 712  66.397  -5.548  -2.473
   11   HH12  ARG 712          HH12      ARG 712  68.069  -5.572  -2.212
   12   HH21  ARG 712          HH21      ARG 712  68.948  -4.625  -5.511
   13   HH22  ARG 712          HH22      ARG 712  69.571  -5.058  -3.994

  No H/Q in entry =          13
  In of MODEL   41
    1    H    CYS 713           H        CYS 713  62.512  -6.524  -8.482
    2    HA   CYS 713           HA       CYS 713  59.843  -5.472  -7.954
    3    HB2  CYS 713           HB2      CYS 713  60.644  -8.229  -8.949
    4    HB3  CYS 713           HB3      CYS 713  59.029  -7.541  -8.924

  No H/Q in entry =           4
  In of MODEL   41
    1    H    VAL 714           H        VAL 714  59.151  -5.668  -5.955
    2    HA   VAL 714           HA       VAL 714  60.190  -7.862  -4.302
    3    HB   VAL 714           HB       VAL 714  59.738  -6.489  -2.314
    4   HG13  VAL 714          HG11      VAL 714  61.490  -4.792  -2.561
    5   HG12  VAL 714          HG12      VAL 714  61.440  -5.010  -4.307
    6   HG11  VAL 714          HG13      VAL 714  61.969  -6.335  -3.272
    7   HG21  VAL 714          HG21      VAL 714  58.947  -4.322  -4.259
    8   HG23  VAL 714          HG22      VAL 714  59.145  -4.101  -2.521
    9   HG22  VAL 714          HG23      VAL 714  57.879  -5.164  -3.137

  No H/Q in entry =           9
  In of MODEL   41
    1    H    CYS 715           H        CYS 715  58.470  -8.277  -2.494
    2    HA   CYS 715           HA       CYS 715  56.030  -8.823  -3.954
    3    HB2  CYS 715           HB2      CYS 715  56.892  -9.622  -1.167
    4    HB3  CYS 715           HB3      CYS 715  55.441 -10.185  -1.986

  No H/Q in entry =           4
  In of MODEL   41
    1    H    LYS 716           H        LYS 716  54.015  -8.168  -3.259
    2    HA   LYS 716           HA       LYS 716  53.871  -5.595  -1.971
    3    HB2  LYS 716           HB2      LYS 716  51.654  -7.511  -2.722
    4    HB3  LYS 716           HB3      LYS 716  51.467  -5.801  -2.365
    5    HG2  LYS 716           HG2      LYS 716  52.766  -5.257  -4.381
    6    HG3  LYS 716           HG3      LYS 716  52.910  -6.978  -4.736
    7    HD2  LYS 716           HD2      LYS 716  50.357  -5.358  -4.621
    8    HD3  LYS 716           HD3      LYS 716  51.118  -6.016  -6.071
    9    HE2  LYS 716           HE2      LYS 716  50.789  -8.293  -5.101
   10    HE3  LYS 716           HE3      LYS 716  49.878  -7.546  -3.792
   11    HZ1  LYS 716           HZ1      LYS 716  48.334  -6.654  -5.547
   12    HZ3  LYS 716           HZ2      LYS 716  48.336  -8.317  -5.429
   13    HZ2  LYS 716           HZ3      LYS 716  49.145  -7.568  -6.679

  No H/Q in entry =          13
  In of MODEL   41
    1    H    MET 717           H        MET 717  52.039  -5.487  -0.181
    2    HA   MET 717           HA       MET 717  52.619  -7.631   1.705
    3    HB2  MET 717           HB2      MET 717  51.721  -4.813   2.017
    4    HB3  MET 717           HB3      MET 717  51.318  -5.977   3.266
    5    HG2  MET 717           HG2      MET 717  53.332  -4.749   3.789
    6    HG3  MET 717           HG3      MET 717  53.641  -6.482   3.605
    7    HE3  MET 717           HE1      MET 717  53.147  -3.980   0.679
    8    HE2  MET 717           HE2      MET 717  54.776  -3.274   0.548
    9    HE1  MET 717           HE3      MET 717  53.786  -3.031   2.016

  No H/Q in entry =           9
  In of MODEL   41
    1    HA   PRO 718           HA       PRO 718  48.782  -9.641   1.241
    2    HB2  PRO 718           HB2      PRO 718  48.211 -10.324   3.861
    3    HB3  PRO 718           HB3      PRO 718  49.319 -11.212   2.813
    4    HG2  PRO 718           HG2      PRO 718  49.921  -9.162   4.904
    5    HG3  PRO 718           HG3      PRO 718  50.779 -10.666   4.533
    6    HD2  PRO 718           HD2      PRO 718  51.712  -8.286   3.734
    7    HD3  PRO 718           HD3      PRO 718  51.874  -9.735   2.721

  No H/Q in entry =           7
  In of MODEL   41
    1    H    TYR 719           H        TYR 719  48.995  -6.916   3.295
    2    HA   TYR 719           HA       TYR 719  46.101  -6.696   3.490
    3    HB2  TYR 719           HB2      TYR 719  46.451  -4.868   5.066
    4    HB3  TYR 719           HB3      TYR 719  47.364  -6.280   5.552
    5    HD1  TYR 719           HD1      TYR 719  47.516  -2.805   4.544
    6    HD2  TYR 719           HD2      TYR 719  49.900  -6.239   5.330
    7    HE1  TYR 719           HE1      TYR 719  49.488  -1.375   4.810
    8    HE2  TYR 719           HE2      TYR 719  51.869  -4.803   5.589
    9    HH   TYR 719           HH       TYR 719  52.681  -2.677   5.092

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLU 720           H        GLU 720  48.444  -5.846   1.373
    2    HA   GLU 720           HA       GLU 720  47.321  -3.291   0.527
    3    HB2  GLU 720           HB2      GLU 720  49.747  -3.571   0.642
    4    HB3  GLU 720           HB3      GLU 720  49.655  -4.983  -0.388
    5    HG2  GLU 720           HG2      GLU 720  48.936  -3.547  -2.247
    6    HG3  GLU 720           HG3      GLU 720  49.091  -2.141  -1.192

  No H/Q in entry =           6
  In of MODEL   41
    1    H    CYS 721           H        CYS 721  46.931  -6.545   0.102
    2    HA   CYS 721           HA       CYS 721  46.238  -6.669  -2.661
    3    HB2  CYS 721           HB2      CYS 721  45.552  -8.569  -0.429
    4    HB3  CYS 721           HB3      CYS 721  45.540  -8.921  -2.155

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLY 722           H        GLY 722  44.567  -5.351  -3.198
    2    HA3  GLY 722           HA2      GLY 722  42.210  -5.196  -1.551
    3    HA2  GLY 722           HA3      GLY 722  42.449  -4.409  -3.112

  No H/Q in entry =           3
  In of MODEL   41
    1    HA   PRO 723           HA       PRO 723  40.169  -7.649  -5.016
    2    HB2  PRO 723           HB2      PRO 723  41.465  -8.153  -7.352
    3    HB3  PRO 723           HB3      PRO 723  40.600  -6.637  -7.079
    4    HG2  PRO 723           HG2      PRO 723  43.513  -7.207  -6.833
    5    HG3  PRO 723           HG3      PRO 723  42.700  -5.821  -7.586
    6    HD2  PRO 723           HD2      PRO 723  43.763  -5.740  -5.093
    7    HD3  PRO 723           HD3      PRO 723  42.339  -4.782  -5.558

  No H/Q in entry =           7
  In of MODEL   41
    1    H    SER 724           H        SER 724  40.008  -9.913  -4.735
    2    HA   SER 724           HA       SER 724  42.107 -11.641  -5.268
    3    HB2  SER 724           HB2      SER 724  41.270 -11.381  -2.364
    4    HB3  SER 724           HB3      SER 724  42.379 -12.570  -3.043
    5    HG   SER 724           HG       SER 724  43.109 -10.052  -3.590

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU 725           H        LEU 725  41.247 -13.548  -5.766
    2    HA   LEU 725           HA       LEU 725  38.436 -14.072  -5.325
    3    HB2  LEU 725           HB2      LEU 725  40.618 -15.502  -6.743
    4    HB3  LEU 725           HB3      LEU 725  39.193 -16.410  -6.292
    5    HG   LEU 725           HG       LEU 725  38.936 -13.881  -7.869
    6   HD11  LEU 725          HD11      LEU 725  40.590 -15.415  -9.011
    7   HD13  LEU 725          HD12      LEU 725  39.076 -15.232  -9.888
    8   HD12  LEU 725          HD13      LEU 725  39.372 -16.696  -8.946
    9   HD21  LEU 725          HD21      LEU 725  36.948 -14.886  -6.930
   10   HD23  LEU 725          HD22      LEU 725  37.346 -16.424  -7.705
   11   HD22  LEU 725          HD23      LEU 725  36.974 -15.003  -8.688

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ASP 726           H        ASP 726  37.526 -15.435  -3.945
    2    HA   ASP 726           HA       ASP 726  38.843 -16.149  -1.534
    3    HB2  ASP 726           HB2      ASP 726  36.230 -17.244  -2.564
    4    HB3  ASP 726           HB3      ASP 726  36.757 -17.078  -0.895

  No H/Q in entry =           4
  In of MODEL   41
    1    H    VAL 727           H        VAL 727  40.044 -17.958  -1.192
    2    HA   VAL 727           HA       VAL 727  39.319 -20.391  -2.615
    3    HB   VAL 727           HB       VAL 727  41.729 -20.991  -2.931
    4   HG11  VAL 727          HG11      VAL 727  40.425 -20.186  -4.809
    5   HG13  VAL 727          HG12      VAL 727  42.089 -19.619  -4.932
    6   HG12  VAL 727          HG13      VAL 727  40.819 -18.519  -4.391
    7   HG21  VAL 727          HG21      VAL 727  42.220 -18.081  -2.269
    8   HG23  VAL 727          HG22      VAL 727  43.421 -19.193  -2.925
    9   HG22  VAL 727          HG23      VAL 727  42.751 -19.468  -1.315

  No H/Q in entry =           9
  In of MODEL   41
    1    H    CYS 728           H        CYS 728  40.414 -22.329  -1.647
    2    HA   CYS 728           HA       CYS 728  40.307 -22.064   1.272
    3    HB2  CYS 728           HB2      CYS 728  38.681 -23.660   0.204
    4    HB3  CYS 728           HB3      CYS 728  40.050 -24.582  -0.404

  No H/Q in entry =           4
  In of MODEL   41
    1    H    ALA 729           H        ALA 729  42.060 -22.525   2.472
    2    HA   ALA 729           HA       ALA 729  44.205 -23.912   1.143
    3    HB1  ALA 729           HB1      ALA 729  44.552 -21.331   2.632
    4    HB3  ALA 729           HB2      ALA 729  44.652 -21.505   0.879
    5    HB2  ALA 729           HB3      ALA 729  45.850 -22.284   1.916

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLN 730           H        GLN 730  45.708 -24.730   2.515
    2    HA   GLN 730           HA       GLN 730  44.715 -25.249   5.208
    3    HB2  GLN 730           HB2      GLN 730  45.033 -27.275   3.838
    4    HB3  GLN 730           HB3      GLN 730  46.704 -26.815   3.560
    5    HG2  GLN 730           HG2      GLN 730  47.154 -26.938   5.939
    6    HG3  GLN 730           HG3      GLN 730  45.501 -27.431   6.246
    7   HE21  GLN 730          HE21      GLN 730  46.051 -29.352   7.122
    8   HE22  GLN 730          HE22      GLN 730  46.791 -30.640   6.257

  No H/Q in entry =           8
  In of MODEL   41
    1    H    ASP 731           H        ASP 731  45.878 -24.560   6.808
    2    HA   ASP 731           HA       ASP 731  48.193 -22.920   6.395
    3    HB2  ASP 731           HB2      ASP 731  46.498 -22.475   8.182
    4    HB3  ASP 731           HB3      ASP 731  46.986 -23.967   8.972

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLU 732           H        GLU 732  50.330 -23.586   6.610
    2    HA   GLU 732           HA       GLU 732  50.748 -26.420   6.756
    3    HB2  GLU 732           HB2      GLU 732  52.552 -24.120   6.175
    4    HB3  GLU 732           HB3      GLU 732  53.199 -25.733   6.442
    5    HG2  GLU 732           HG2      GLU 732  51.133 -25.030   4.375
    6    HG3  GLU 732           HG3      GLU 732  52.863 -25.207   4.058

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ARG 733           H        ARG 733  50.685 -24.082   9.152
    2    HA   ARG 733           HA       ARG 733  52.663 -25.535  10.746
    3    HB2  ARG 733           HB2      ARG 733  52.926 -23.072  10.436
    4    HB3  ARG 733           HB3      ARG 733  51.378 -22.851  11.229
    5    HG2  ARG 733           HG2      ARG 733  53.185 -22.397  12.758
    6    HG3  ARG 733           HG3      ARG 733  52.297 -23.831  13.275
    7    HD2  ARG 733           HD2      ARG 733  53.998 -25.272  12.393
    8    HD3  ARG 733           HD3      ARG 733  54.861 -23.908  11.678
    9    HE   ARG 733           HE       ARG 733  54.480 -23.638  14.479
   10   HH11  ARG 733          HH11      ARG 733  56.550 -25.282  12.123
   11   HH12  ARG 733          HH12      ARG 733  57.934 -25.236  13.116
   12   HH21  ARG 733          HH21      ARG 733  56.341 -23.638  15.854
   13   HH22  ARG 733          HH22      ARG 733  57.803 -24.314  15.314

  No H/Q in entry =          13
  In of MODEL   41
    1    H    SER 734           H        SER 734  49.390 -24.330  10.684
    2    HA   SER 734           HA       SER 734  48.728 -25.733  13.144
    3    HB2  SER 734           HB2      SER 734  47.909 -23.434  12.790
    4    HB3  SER 734           HB3      SER 734  47.054 -23.964  11.351
    5    HG   SER 734           HG       SER 734  46.178 -25.560  13.185

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LYS 735           H        LYS 735  48.507 -26.178   9.692
    2    HA   LYS 735           HA       LYS 735  47.656 -27.648   8.355
    3    HB2  LYS 735           HB2      LYS 735  47.634 -29.363  10.824
    4    HB3  LYS 735           HB3      LYS 735  47.254 -29.976   9.218
    5    HG2  LYS 735           HG2      LYS 735  49.864 -28.748  10.098
    6    HG3  LYS 735           HG3      LYS 735  49.557 -30.452   9.755
    7    HD2  LYS 735           HD2      LYS 735  48.876 -29.701   7.416
    8    HD3  LYS 735           HD3      LYS 735  49.526 -28.145   7.846
    9    HE2  LYS 735           HE2      LYS 735  51.702 -28.954   8.169
   10    HE3  LYS 735           HE3      LYS 735  51.188 -30.636   8.061
   11    HZ2  LYS 735           HZ1      LYS 735  52.270 -29.813   6.027
   12    HZ1  LYS 735           HZ2      LYS 735  51.033 -28.695   5.783
   13    HZ3  LYS 735           HZ3      LYS 735  50.703 -30.344   5.765

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ARG 736           H        ARG 736  45.869 -25.870   9.794
    2    HA   ARG 736           HA       ARG 736  43.307 -27.273   9.670
    3    HB2  ARG 736           HB2      ARG 736  42.382 -25.320  10.699
    4    HB3  ARG 736           HB3      ARG 736  43.858 -25.740  11.564
    5    HG2  ARG 736           HG2      ARG 736  45.073 -24.058  10.255
    6    HG3  ARG 736           HG3      ARG 736  43.552 -23.586   9.507
    7    HD2  ARG 736           HD2      ARG 736  44.195 -23.498  12.429
    8    HD3  ARG 736           HD3      ARG 736  44.190 -22.153  11.283
    9    HE   ARG 736           HE       ARG 736  41.672 -23.504  11.386
   10   HH11  ARG 736          HH11      ARG 736  43.629 -21.030  12.943
   11   HH12  ARG 736          HH12      ARG 736  42.314 -20.283  13.733
   12   HH21  ARG 736          HH21      ARG 736  39.868 -22.485  12.447
   13   HH22  ARG 736          HH22      ARG 736  40.135 -21.129  13.443

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ILE 737           H        ILE 737  41.597 -26.489   8.390
    2    HA   ILE 737           HA       ILE 737  42.503 -25.332   5.904
    3    HB   ILE 737           HB       ILE 737  39.848 -26.541   6.730
    4   HG12  ILE 737          HG12      ILE 737  41.686 -28.192   6.592
    5   HG13  ILE 737          HG13      ILE 737  40.486 -28.435   5.328
    6   HG22  ILE 737          HG21      ILE 737  40.860 -25.635   4.068
    7   HG21  ILE 737          HG22      ILE 737  39.602 -24.861   5.023
    8   HG23  ILE 737          HG23      ILE 737  39.340 -26.476   4.347
    9   HD13  ILE 737          HD11      ILE 737  42.693 -28.721   4.425
   10   HD12  ILE 737          HD12      ILE 737  43.172 -27.153   5.061
   11   HD11  ILE 737          HD13      ILE 737  41.980 -27.240   3.748

  No H/Q in entry =          11
  In of MODEL   41
    1    H    LEU 738           H        LEU 738  42.272 -23.229   5.559
    2    HA   LEU 738           HA       LEU 738  40.109 -21.816   6.902
    3    HB2  LEU 738           HB2      LEU 738  41.438 -19.974   7.571
    4    HB3  LEU 738           HB3      LEU 738  42.236 -21.405   8.195
    5    HG   LEU 738           HG       LEU 738  43.096 -19.695   5.847
    6   HD12  LEU 738          HD11      LEU 738  44.306 -20.077   8.572
    7   HD11  LEU 738          HD12      LEU 738  43.460 -18.644   7.990
    8   HD13  LEU 738          HD13      LEU 738  44.994 -19.118   7.259
    9   HD22  LEU 738          HD21      LEU 738  45.093 -21.058   5.752
   10   HD21  LEU 738          HD22      LEU 738  43.632 -22.021   5.499
   11   HD23  LEU 738          HD23      LEU 738  44.463 -22.083   7.058

  No H/Q in entry =          11
  In of MODEL   41
    1    HA   PRO 739           HA       PRO 739  39.595 -19.921   2.940
    2    HB2  PRO 739           HB2      PRO 739  38.292 -17.671   3.633
    3    HB3  PRO 739           HB3      PRO 739  37.530 -19.272   3.735
    4    HG2  PRO 739           HG2      PRO 739  38.677 -17.556   5.884
    5    HG3  PRO 739           HG3      PRO 739  37.244 -18.597   5.921
    6    HD2  PRO 739           HD2      PRO 739  39.746 -19.297   6.939
    7    HD3  PRO 739           HD3      PRO 739  38.466 -20.441   6.470

  No H/Q in entry =           7
  In of MODEL   41
    1    H    LEU 740           H        LEU 740  41.204 -19.058   1.844
    2    HA   LEU 740           HA       LEU 740  42.383 -16.510   2.721
    3    HB2  LEU 740           HB2      LEU 740  43.732 -18.880   1.459
    4    HB3  LEU 740           HB3      LEU 740  44.325 -17.225   1.297
    5    HG   LEU 740           HG       LEU 740  43.911 -18.541   3.983
    6   HD12  LEU 740          HD11      LEU 740  46.492 -18.142   2.485
    7   HD11  LEU 740          HD12      LEU 740  45.632 -19.674   2.572
    8   HD13  LEU 740          HD13      LEU 740  46.266 -18.937   4.047
    9   HD23  LEU 740          HD21      LEU 740  45.382 -16.673   4.702
   10   HD22  LEU 740          HD22      LEU 740  43.848 -16.122   4.038
   11   HD21  LEU 740          HD23      LEU 740  45.305 -16.027   3.059

  No H/Q in entry =          11
  In of MODEL   41
    1    H    THR 741           H        THR 741  43.347 -15.463   0.772
    2    HA   THR 741           HA       THR 741  41.398 -15.707  -1.381
    3    HB   THR 741           HB       THR 741  42.464 -13.090  -1.151
    4    HG1  THR 741           HG1      THR 741  41.361 -14.041   1.316
    5   HG22  THR 741          HG21      THR 741  40.138 -12.506  -0.675
    6   HG21  THR 741          HG22      THR 741  39.747 -14.218  -0.416
    7   HG23  THR 741          HG23      THR 741  40.267 -13.642  -2.011

  No H/Q in entry =           7
  In of MODEL   41
    1    H    VAL 742           H        VAL 742  42.268 -15.378  -3.456
    2    HA   VAL 742           HA       VAL 742  44.661 -16.508  -4.086
    3    HB   VAL 742           HB       VAL 742  43.195 -14.421  -5.700
    4   HG12  VAL 742          HG11      VAL 742  44.374 -15.305  -7.644
    5   HG11  VAL 742          HG12      VAL 742  45.397 -16.289  -6.577
    6   HG13  VAL 742          HG13      VAL 742  45.450 -14.526  -6.495
    7   HG23  VAL 742          HG21      VAL 742  42.439 -16.358  -6.954
    8   HG22  VAL 742          HG22      VAL 742  41.884 -16.309  -5.275
    9   HG21  VAL 742          HG23      VAL 742  43.206 -17.407  -5.750

  No H/Q in entry =           9
  In of MODEL   41
    1    H    CYS 743           H        CYS 743  44.244 -12.999  -4.489
    2    HA   CYS 743           HA       CYS 743  46.920 -12.456  -4.873
    3    HB2  CYS 743           HB2      CYS 743  44.932 -10.939  -5.332
    4    HB3  CYS 743           HB3      CYS 743  44.904 -10.631  -3.625

  No H/Q in entry =           4
  In of MODEL   41
    1    H    LYS 744           H        LYS 744  45.010 -12.542  -1.888
    2    HA   LYS 744           HA       LYS 744  46.988 -11.484  -0.240
    3    HB2  LYS 744           HB2      LYS 744  44.552 -13.150   0.303
    4    HB3  LYS 744           HB3      LYS 744  45.545 -12.571   1.611
    5    HG2  LYS 744           HG2      LYS 744  45.190 -10.240   0.850
    6    HG3  LYS 744           HG3      LYS 744  44.177 -10.830  -0.466
    7    HD2  LYS 744           HD2      LYS 744  42.783  -9.999   1.319
    8    HD3  LYS 744           HD3      LYS 744  42.614 -11.745   1.221
    9    HE2  LYS 744           HE2      LYS 744  42.760 -11.113   3.521
   10    HE3  LYS 744           HE3      LYS 744  44.239 -11.957   3.086
   11    HZ2  LYS 744           HZ1      LYS 744  43.874  -9.032   3.392
   12    HZ1  LYS 744           HZ2      LYS 744  45.289  -9.704   2.803
   13    HZ3  LYS 744           HZ3      LYS 744  44.781 -10.050   4.375

  No H/Q in entry =          13
  In of MODEL   41
    1    H    MET 745           H        MET 745  45.971 -14.870  -0.616
    2    HA   MET 745           HA       MET 745  47.979 -16.041   1.056
    3    HB2  MET 745           HB2      MET 745  46.946 -17.923   0.599
    4    HB3  MET 745           HB3      MET 745  45.698 -16.902  -0.097
    5    HG2  MET 745           HG2      MET 745  45.939 -18.471  -1.758
    6    HG3  MET 745           HG3      MET 745  47.067 -17.234  -2.286
    7    HE3  MET 745           HE1      MET 745  47.387 -19.979   0.576
    8    HE2  MET 745           HE2      MET 745  48.229 -21.243  -0.331
    9    HE1  MET 745           HE3      MET 745  46.604 -20.752  -0.803

  No H/Q in entry =           9
  In of MODEL   41
    1    H    HIS 746           H        HIS 746  47.989 -15.297  -2.502
    2    HA   HIS 746           HA       HIS 746  50.455 -16.576  -2.998
    3    HB2  HIS 746           HB2      HIS 746  48.835 -14.608  -4.441
    4    HB3  HIS 746           HB3      HIS 746  50.566 -14.386  -4.672
    5    HD1  HIS 746           HD1      HIS 746  51.845 -16.503  -5.755
    6    HD2  HIS 746           HD2      HIS 746  47.698 -16.592  -5.837
    7    HE1  HIS 746           HE1      HIS 746  51.262 -18.123  -7.533
    8    HE2  HIS 746           HE2      HIS 746  48.750 -17.903  -7.761

  No H/Q in entry =           8
  In of MODEL   41
    1    H    VAL 747           H        VAL 747  49.804 -13.210  -2.124
    2    HA   VAL 747           HA       VAL 747  52.487 -12.382  -2.002
    3    HB   VAL 747           HB       VAL 747  49.940 -11.355  -0.731
    4   HG12  VAL 747          HG11      VAL 747  52.679 -10.106  -0.624
    5   HG11  VAL 747          HG12      VAL 747  51.814 -10.810   0.739
    6   HG13  VAL 747          HG13      VAL 747  51.181  -9.372  -0.055
    7   HG21  VAL 747          HG21      VAL 747  50.178 -11.090  -3.139
    8   HG23  VAL 747          HG22      VAL 747  51.730 -10.281  -2.892
    9   HG22  VAL 747          HG23      VAL 747  50.240  -9.530  -2.311

  No H/Q in entry =           9
  In of MODEL   41
    1    H    LEU 748           H        LEU 748  50.238 -13.360   0.432
    2    HA   LEU 748           HA       LEU 748  51.660 -13.443   2.760
    3    HB2  LEU 748           HB2      LEU 748  49.382 -13.667   2.859
    4    HB3  LEU 748           HB3      LEU 748  49.311 -14.643   1.449
    5    HG   LEU 748           HG       LEU 748  48.290 -15.698   3.250
    6   HD11  LEU 748          HD11      LEU 748  49.363 -17.178   1.765
    7   HD13  LEU 748          HD12      LEU 748  49.288 -17.792   3.396
    8   HD12  LEU 748          HD13      LEU 748  50.821 -17.166   2.767
    9   HD23  LEU 748          HD21      LEU 748  49.390 -16.395   5.237
   10   HD22  LEU 748          HD22      LEU 748  49.233 -14.641   5.086
   11   HD21  LEU 748          HD23      LEU 748  50.816 -15.427   4.809

  No H/Q in entry =          11
  In of MODEL   41
    1    H    HIS 749           H        HIS 749  51.504 -15.842   0.197
    2    HA   HIS 749           HA       HIS 749  53.081 -17.881   1.356
    3    HB2  HIS 749           HB2      HIS 749  51.480 -17.996  -0.634
    4    HB3  HIS 749           HB3      HIS 749  52.771 -17.289  -1.586
    5    HD1  HIS 749           HD1      HIS 749  54.642 -18.901  -2.382
    6    HD2  HIS 749           HD2      HIS 749  51.893 -20.603   0.223
    7    HE1  HIS 749           HE1      HIS 749  55.037 -21.352  -2.499
    8    HE2  HIS 749           HE2      HIS 749  53.310 -22.374  -0.996

  No H/Q in entry =           8
  In of MODEL   41
    1    H    CYS 750           H        CYS 750  53.834 -15.213  -0.905
    2    HA   CYS 750           HA       CYS 750  56.549 -16.001  -1.160
    3    HB2  CYS 750           HB2      CYS 750  55.124 -13.508  -2.070
    4    HB3  CYS 750           HB3      CYS 750  56.759 -13.984  -2.531

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLN 751           H        GLN 751  54.831 -13.908   1.041
    2    HA   GLN 751           HA       GLN 751  57.154 -12.568   1.926
    3    HB2  GLN 751           HB2      GLN 751  54.386 -12.849   3.063
    4    HB3  GLN 751           HB3      GLN 751  55.647 -11.868   3.809
    5    HG2  GLN 751           HG2      GLN 751  54.820 -11.505   0.961
    6    HG3  GLN 751           HG3      GLN 751  53.988 -10.691   2.275
    7   HE21  GLN 751          HE21      GLN 751  54.619  -8.790   1.351
    8   HE22  GLN 751          HE22      GLN 751  56.150  -8.051   1.575

  No H/Q in entry =           8
  In of MODEL   41
    1    H    GLY 752           H        GLY 752  56.423 -15.734   2.216
    2    HA3  GLY 752           HA2      GLY 752  58.119 -17.041   3.346
    3    HA2  GLY 752           HA3      GLY 752  58.103 -15.848   4.630

  No H/Q in entry =           3
  In of MODEL   41
    1    H    ARG 753           H        ARG 753  54.947 -16.507   3.686
    2    HA   ARG 753           HA       ARG 753  54.698 -18.300   5.974
    3    HB2  ARG 753           HB2      ARG 753  52.519 -16.914   4.398
    4    HB3  ARG 753           HB3      ARG 753  52.313 -17.797   5.905
    5    HG2  ARG 753           HG2      ARG 753  53.882 -15.248   5.561
    6    HG3  ARG 753           HG3      ARG 753  52.264 -15.356   6.236
    7    HD2  ARG 753           HD2      ARG 753  53.134 -16.784   8.061
    8    HD3  ARG 753           HD3      ARG 753  54.760 -16.608   7.398
    9    HE   ARG 753           HE       ARG 753  53.787 -14.060   7.775
   10   HH11  ARG 753          HH11      ARG 753  54.532 -16.832   9.905
   11   HH12  ARG 753          HH12      ARG 753  54.936 -15.860  11.231
   12   HH21  ARG 753          HH21      ARG 753  54.315 -12.759   9.645
   13   HH22  ARG 753          HH22      ARG 753  54.822 -13.504  11.083

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ASN 754           H        ASN 754  53.800 -20.331   5.757
    2    HA   ASN 754           HA       ASN 754  53.869 -21.315   2.995
    3    HB2  ASN 754           HB2      ASN 754  54.294 -22.863   5.561
    4    HB3  ASN 754           HB3      ASN 754  54.326 -23.550   3.947
    5   HD21  ASN 754          HD21      ASN 754  56.026 -21.704   6.302
    6   HD22  ASN 754          HD22      ASN 754  57.530 -21.627   5.476

  No H/Q in entry =           6
  In of MODEL   41
    1    H    TYR 755           H        TYR 755  52.114 -22.080   2.103
    2    HA   TYR 755           HA       TYR 755  49.945 -23.102   3.697
    3    HB2  TYR 755           HB2      TYR 755  49.749 -20.605   2.060
    4    HB3  TYR 755           HB3      TYR 755  48.325 -21.580   2.216
    5    HD1  TYR 755           HD1      TYR 755  47.270 -21.831   4.446
    6    HD2  TYR 755           HD2      TYR 755  50.650 -19.361   3.872
    7    HE1  TYR 755           HE1      TYR 755  46.859 -20.754   6.620
    8    HE2  TYR 755           HE2      TYR 755  50.246 -18.265   5.985
    9    HH   TYR 755           HH       TYR 755  48.171 -19.625   8.286

  No H/Q in entry =           9
  In of MODEL   41
    1    H    THR 756           H        THR 756  48.637 -24.445   2.628
    2    HA   THR 756           HA       THR 756  49.520 -25.267  -0.042
    3    HB   THR 756           HB       THR 756  48.220 -26.797   2.224
    4    HG1  THR 756           HG1      THR 756  50.223 -26.941   2.871
    5   HG22  THR 756          HG21      THR 756  49.278 -27.766  -0.417
    6   HG21  THR 756          HG22      THR 756  47.581 -27.567   0.022
    7   HG23  THR 756          HG23      THR 756  48.568 -28.783   0.861

  No H/Q in entry =           7
  In of MODEL   41
    1    H    LEU 757           H        LEU 757  47.735 -25.685  -1.541
    2    HA   LEU 757           HA       LEU 757  45.279 -24.494  -0.576
    3    HB2  LEU 757           HB2      LEU 757  46.189 -24.959  -3.377
    4    HB3  LEU 757           HB3      LEU 757  44.567 -24.435  -2.957
    5    HG   LEU 757           HG       LEU 757  46.092 -22.662  -1.609
    6   HD12  LEU 757          HD11      LEU 757  47.518 -23.204  -4.196
    7   HD11  LEU 757          HD12      LEU 757  48.154 -23.433  -2.569
    8   HD13  LEU 757          HD13      LEU 757  47.777 -21.810  -3.148
    9   HD21  LEU 757          HD21      LEU 757  44.108 -22.260  -2.900
   10   HD23  LEU 757          HD22      LEU 757  45.029 -22.398  -4.407
   11   HD22  LEU 757          HD23      LEU 757  45.368 -21.092  -3.255

  No H/Q in entry =          11
  In of MODEL   41
    1    H    THR 758           H        THR 758  43.373 -25.369  -0.691
    2    HA   THR 758           HA       THR 758  43.301 -28.230  -1.214
    3    HB   THR 758           HB       THR 758  41.663 -28.181   0.836
    4    HG1  THR 758           HG1      THR 758  41.488 -26.302   1.771
    5   HG21  THR 758          HG21      THR 758  43.942 -29.201   0.867
    6   HG23  THR 758          HG22      THR 758  43.534 -28.426   2.394
    7   HG22  THR 758          HG23      THR 758  44.614 -27.618   1.264

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLY 759           H        GLY 759  40.549 -28.547  -0.708
    2    HA3  GLY 759           HA2      GLY 759  39.440 -27.174  -3.041
    3    HA2  GLY 759           HA3      GLY 759  38.804 -28.638  -2.298

  No H/Q in entry =           3
  In of MODEL   41
    1    H    ARG 760           H        ARG 760  37.297 -26.270  -2.954
    2    HA   ARG 760           HA       ARG 760  36.991 -24.497  -0.789
    3    HB2  ARG 760           HB2      ARG 760  35.004 -23.661  -1.887
    4    HB3  ARG 760           HB3      ARG 760  36.225 -23.992  -3.098
    5    HG2  ARG 760           HG2      ARG 760  34.288 -24.797  -4.118
    6    HG3  ARG 760           HG3      ARG 760  34.976 -26.244  -3.373
    7    HD2  ARG 760           HD2      ARG 760  33.445 -25.997  -1.468
    8    HD3  ARG 760           HD3      ARG 760  32.740 -24.567  -2.212
    9    HE   ARG 760           HE       ARG 760  32.570 -26.631  -4.034
   10   HH11  ARG 760          HH11      ARG 760  31.262 -25.986  -0.778
   11   HH12  ARG 760          HH12      ARG 760  29.797 -26.785  -1.084
   12   HH21  ARG 760          HH21      ARG 760  30.565 -27.746  -4.391
   13   HH22  ARG 760          HH22      ARG 760  29.382 -27.806  -3.178

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ASP 761           H        ASP 761  35.747 -27.633  -1.314
    2    HA   ASP 761           HA       ASP 761  33.450 -27.632   0.277
    3    HB2  ASP 761           HB2      ASP 761  33.877 -29.460  -1.212
    4    HB3  ASP 761           HB3      ASP 761  35.402 -29.809  -0.409

  No H/Q in entry =           4
  In of MODEL   41
    1    H    SER 762           H        SER 762  36.820 -28.027   1.086
    2    HA   SER 762           HA       SER 762  36.365 -28.995   3.709
    3    HB2  SER 762           HB2      SER 762  38.845 -27.732   2.554
    4    HB3  SER 762           HB3      SER 762  38.761 -28.713   4.014
    5    HG   SER 762           HG       SER 762  37.782 -30.354   2.508

  No H/Q in entry =           5
  In of MODEL   41
    1    H    CYS 763           H        CYS 763  36.695 -25.745   2.384
    2    HA   CYS 763           HA       CYS 763  36.851 -24.715   5.123
    3    HB2  CYS 763           HB2      CYS 763  37.534 -22.607   4.141
    4    HB3  CYS 763           HB3      CYS 763  38.448 -23.903   3.416

  No H/Q in entry =           4
  In of MODEL   41
    1    H    THR 764           H        THR 764  35.580 -22.789   5.560
    2    HA   THR 764           HA       THR 764  33.028 -22.730   4.142
    3    HB   THR 764           HB       THR 764  33.787 -21.318   6.737
    4    HG1  THR 764           HG1      THR 764  32.608 -23.844   6.225
    5   HG23  THR 764          HG21      THR 764  31.893 -20.328   5.526
    6   HG22  THR 764          HG22      THR 764  31.348 -21.095   7.021
    7   HG21  THR 764          HG23      THR 764  31.098 -21.903   5.475

  No H/Q in entry =           7
  In of MODEL   41
    1    H    LEU 765           H        LEU 765  33.418 -21.607   2.398
    2    HA   LEU 765           HA       LEU 765  35.287 -19.420   2.450
    3    HB2  LEU 765           HB2      LEU 765  34.943 -21.341   0.685
    4    HB3  LEU 765           HB3      LEU 765  33.692 -20.265   0.087
    5    HG   LEU 765           HG       LEU 765  35.364 -18.533  -0.319
    6   HD11  LEU 765          HD11      LEU 765  37.262 -20.628   0.707
    7   HD13  LEU 765          HD12      LEU 765  36.931 -19.073   1.457
    8   HD12  LEU 765          HD13      LEU 765  37.764 -19.144  -0.101
    9   HD21  LEU 765          HD21      LEU 765  34.842 -20.150  -2.084
   10   HD23  LEU 765          HD22      LEU 765  36.108 -21.221  -1.479
   11   HD22  LEU 765          HD23      LEU 765  36.530 -19.647  -2.153

  No H/Q in entry =          11
  In of MODEL   41
    1    HA   PRO 766           HA       PRO 766  32.027 -16.503   3.015
    2    HB2  PRO 766           HB2      PRO 766  33.345 -14.228   2.225
    3    HB3  PRO 766           HB3      PRO 766  33.514 -14.985   3.809
    4    HG2  PRO 766           HG2      PRO 766  35.328 -15.083   1.463
    5    HG3  PRO 766           HG3      PRO 766  35.719 -15.120   3.190
    6    HD2  PRO 766           HD2      PRO 766  35.711 -17.303   1.512
    7    HD3  PRO 766           HD3      PRO 766  35.549 -17.400   3.270

  No H/Q in entry =           7
  In of MODEL   41
    1    H    ALA 767           H        ALA 767  33.815 -15.984  -0.076
    2    HA   ALA 767           HA       ALA 767  31.175 -15.636  -1.293
    3    HB2  ALA 767           HB1      ALA 767  33.706 -14.229  -2.123
    4    HB1  ALA 767           HB2      ALA 767  32.416 -13.492  -1.176
    5    HB3  ALA 767           HB3      ALA 767  32.105 -14.020  -2.833

  No H/Q in entry =           5
  In of MODEL   41
    1    H    SER 768           H        SER 768  30.727 -16.716  -2.995
    2    HA   SER 768           HA       SER 768  32.718 -17.925  -4.678
    3    HB2  SER 768           HB2      SER 768  30.766 -19.669  -3.139
    4    HB3  SER 768           HB3      SER 768  31.881 -20.196  -4.395
    5    HG   SER 768           HG       SER 768  33.191 -18.839  -2.497

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA 769           H        ALA 769  29.358 -17.871  -3.631
    2    HA   ALA 769           HA       ALA 769  28.425 -17.896  -6.379
    3    HB2  ALA 769           HB1      ALA 769  27.355 -19.425  -4.775
    4    HB1  ALA 769           HB2      ALA 769  26.218 -18.195  -5.317
    5    HB3  ALA 769           HB3      ALA 769  26.970 -18.061  -3.726

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLU 770           H        GLU 770  26.085 -16.393  -5.831
    2    HA   GLU 770           HA       GLU 770  27.016 -13.767  -6.260
    3    HB2  GLU 770           HB2      GLU 770  24.688 -13.161  -6.214
    4    HB3  GLU 770           HB3      GLU 770  24.901 -14.641  -7.136
    5    HG2  GLU 770           HG2      GLU 770  24.173 -15.932  -5.140
    6    HG3  GLU 770           HG3      GLU 770  23.869 -14.408  -4.319

  No H/Q in entry =           6
  In of MODEL   41
    1    H    LYS 771           H        LYS 771  26.658 -11.909  -4.990
    2    HA   LYS 771           HA       LYS 771  26.474 -12.465  -2.151
    3    HB2  LYS 771           HB2      LYS 771  28.023 -10.263  -3.543
    4    HB3  LYS 771           HB3      LYS 771  27.812 -10.396  -1.812
    5    HG2  LYS 771           HG2      LYS 771  29.093 -12.594  -3.405
    6    HG3  LYS 771           HG3      LYS 771  30.016 -11.218  -2.834
    7    HD2  LYS 771           HD2      LYS 771  30.301 -13.064  -1.320
    8    HD3  LYS 771           HD3      LYS 771  29.373 -11.819  -0.486
    9    HE2  LYS 771           HE2      LYS 771  27.383 -13.141  -0.729
   10    HE3  LYS 771           HE3      LYS 771  28.215 -14.310  -1.777
   11    HZ1  LYS 771           HZ1      LYS 771  28.754 -13.734   1.095
   12    HZ3  LYS 771           HZ2      LYS 771  29.547 -14.926   0.209
   13    HZ2  LYS 771           HZ3      LYS 771  27.910 -15.053   0.528

  No H/Q in entry =          13
  In of MODEL   41
    1    H    ALA 772           H        ALA 772  25.292 -10.846  -0.943
    2    HA   ALA 772           HA       ALA 772  23.112  -9.798  -2.538
    3    HB1  ALA 772           HB1      ALA 772  22.004  -9.408  -0.398
    4    HB2  ALA 772           HB2      ALA 772  23.468  -9.917   0.452
    5    HB3  ALA 772           HB3      ALA 772  22.574 -11.068  -0.542

  No H/Q in entry =           5
  In of MODEL   41
    1    H    CYS 773           H        CYS 773  22.364  -7.653  -2.291
    2    HA   CYS 773           HA       CYS 773  24.327  -5.692  -2.583
    3    HB2  CYS 773           HB2      CYS 773  22.012  -5.495  -3.453
    4    HB3  CYS 773           HB3      CYS 773  21.419  -5.331  -1.805

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLY 774           H        GLY 774  25.653  -4.954  -1.092
    2    HA3  GLY 774           HA2      GLY 774  25.610  -3.558   1.009
    3    HA2  GLY 774           HA3      GLY 774  24.775  -4.940   1.716

  No H/Q in entry =           3
  In of MODEL   41
    1    H    ALA 775           H        ALA 775  26.416  -6.780   0.022
    2    HA   ALA 775           HA       ALA 775  29.045  -6.447   1.263
    3    HB3  ALA 775           HB1      ALA 775  27.821  -8.240   2.446
    4    HB2  ALA 775           HB2      ALA 775  29.142  -8.914   1.493
    5    HB1  ALA 775           HB3      ALA 775  27.486  -9.029   0.906

  No H/Q in entry =           5
  In of MODEL   41
    1    H    CYS 776           H        CYS 776  30.211  -5.872  -0.458
    2    HA   CYS 776           HA       CYS 776  29.683  -7.254  -2.979
    3    HB2  CYS 776           HB2      CYS 776  30.357  -4.335  -2.584
    4    HB3  CYS 776           HB3      CYS 776  30.068  -5.155  -4.117

  No H/Q in entry =           4
  In of MODEL   41
    1    HA   PRO 777           HA       PRO 777  34.186  -7.826  -2.696
    2    HB2  PRO 777           HB2      PRO 777  34.381  -9.680  -4.640
    3    HB3  PRO 777           HB3      PRO 777  33.708 -10.079  -3.057
    4    HG2  PRO 777           HG2      PRO 777  32.294  -9.521  -5.627
    5    HG3  PRO 777           HG3      PRO 777  31.933 -10.735  -4.393
    6    HD2  PRO 777           HD2      PRO 777  30.628  -8.316  -4.641
    7    HD3  PRO 777           HD3      PRO 777  30.706  -9.264  -3.146

  No H/Q in entry =           7
  In of MODEL   41
    1    H    LEU 778           H        LEU 778  35.736  -8.238  -4.937
    2    HA   LEU 778           HA       LEU 778  35.524  -5.670  -6.106
    3    HB2  LEU 778           HB2      LEU 778  37.646  -6.078  -7.330
    4    HB3  LEU 778           HB3      LEU 778  37.729  -6.229  -5.598
    5    HG   LEU 778           HG       LEU 778  39.167  -7.785  -6.507
    6   HD11  LEU 778          HD11      LEU 778  38.075  -8.654  -4.628
    7   HD13  LEU 778          HD12      LEU 778  38.457  -9.936  -5.780
    8   HD12  LEU 778          HD13      LEU 778  36.808  -9.355  -5.643
    9   HD23  LEU 778          HD21      LEU 778  38.597  -9.567  -8.069
   10   HD22  LEU 778          HD22      LEU 778  38.518  -7.955  -8.772
   11   HD21  LEU 778          HD23      LEU 778  37.020  -8.803  -8.334

  No H/Q in entry =          11
  In of MODEL   41
    1    H    TRP 779           H        TRP 779  34.799  -8.801  -7.378
    2    HA   TRP 779           HA       TRP 779  34.316  -7.710 -10.002
    3    HB2  TRP 779           HB2      TRP 779  33.163  -9.995 -10.392
    4    HB3  TRP 779           HB3      TRP 779  34.895 -10.018 -10.086
    5    HD1  TRP 779           HD1      TRP 779  31.528 -11.035  -8.423
    6    HE1  TRP 779           HE1      TRP 779  32.057 -12.534  -6.434
    7    HE3  TRP 779           HE3      TRP 779  36.614 -10.695  -8.486
    8    HZ2  TRP 779           HZ2      TRP 779  34.404 -13.472  -5.051
    9    HZ3  TRP 779           HZ3      TRP 779  37.900 -11.921  -6.807
   10    HH2  TRP 779           HH2      TRP 779  36.798 -13.270  -5.132

  No H/Q in entry =          10
  In of MODEL   41
    1    H    GLY 780           H        GLY 780  32.658  -7.842  -7.096
    2    HA3  GLY 780           HA2      GLY 780  30.077  -7.448  -8.453
    3    HA2  GLY 780           HA3      GLY 780  30.234  -8.294  -6.919

  No H/Q in entry =           3
  In of MODEL   41
    1    H    LYS 781           H        LYS 781  29.644  -5.417  -8.381
    2    HA   LYS 781           HA       LYS 781  30.247  -3.970  -5.908
    3    HB2  LYS 781           HB2      LYS 781  30.166  -2.905  -8.748
    4    HB3  LYS 781           HB3      LYS 781  30.338  -1.885  -7.319
    5    HG2  LYS 781           HG2      LYS 781  32.294  -3.995  -8.264
    6    HG3  LYS 781           HG3      LYS 781  32.473  -2.257  -8.478
    7    HD2  LYS 781           HD2      LYS 781  32.625  -1.943  -6.074
    8    HD3  LYS 781           HD3      LYS 781  32.303  -3.653  -5.798
    9    HE2  LYS 781           HE2      LYS 781  34.648  -3.322  -5.545
   10    HE3  LYS 781           HE3      LYS 781  34.390  -4.181  -7.055
   11    HZ2  LYS 781           HZ1      LYS 781  35.070  -1.306  -6.727
   12    HZ1  LYS 781           HZ2      LYS 781  34.633  -1.953  -8.190
   13    HZ3  LYS 781           HZ3      LYS 781  36.042  -2.501  -7.417

  No H/Q in entry =          13
  In of MODEL   41
    1    H    CYS 782           H        CYS 782  28.614  -1.856  -6.062
    2    HA   CYS 782           HA       CYS 782  26.078  -3.237  -5.923
    3    HB2  CYS 782           HB2      CYS 782  26.779  -1.889  -4.046
    4    HB3  CYS 782           HB3      CYS 782  26.785  -0.443  -5.062

  No H/Q in entry =           4
  In of MODEL   41
    1    H    ASP 783           H        ASP 783  24.294  -2.775  -7.004
    2    HA   ASP 783           HA       ASP 783  24.540  -1.338  -9.516
    3    HB2  ASP 783           HB2      ASP 783  23.445  -3.507  -9.563
    4    HB3  ASP 783           HB3      ASP 783  22.317  -3.009  -8.309

  No H/Q in entry =           4
  In of MODEL   41
    1    H    ALA 784           H        ALA 784  22.101  -1.476  -6.996
    2    HA   ALA 784           HA       ALA 784  22.129   1.245  -6.295
    3    HB1  ALA 784           HB1      ALA 784  19.755   0.288  -7.948
    4    HB2  ALA 784           HB2      ALA 784  20.907   1.526  -8.440
    5    HB3  ALA 784           HB3      ALA 784  19.833   1.817  -7.072

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLU 785           H        GLU 785  19.896  -1.465  -6.714
    2    HA   GLU 785           HA       GLU 785  20.225  -2.102  -3.948
    3    HB2  GLU 785           HB2      GLU 785  17.768  -2.282  -3.503
    4    HB3  GLU 785           HB3      GLU 785  18.357  -0.644  -3.687
    5    HG2  GLU 785           HG2      GLU 785  17.403  -0.529  -5.920
    6    HG3  GLU 785           HG3      GLU 785  16.878  -2.208  -5.785

  No H/Q in entry =           6
  In of MODEL   41
    1    H    SER 786           H        SER 786  18.148  -2.961  -6.680
    2    HA   SER 786           HA       SER 786  17.219  -4.887  -7.217
    3    HB2  SER 786           HB2      SER 786  18.936  -6.610  -8.008
    4    HB3  SER 786           HB3      SER 786  19.102  -4.990  -8.676
    5    HG   SER 786           HG       SER 786  20.544  -5.070  -6.448

  No H/Q in entry =           5
  In of MODEL   41
    1    H    SER 787           H        SER 787  19.665  -6.841  -5.776
    2    HA   SER 787           HA       SER 787  18.502  -7.316  -3.253
    3    HB2  SER 787           HB2      SER 787  18.083  -9.484  -5.371
    4    HB3  SER 787           HB3      SER 787  17.812  -9.701  -3.647
    5    HG   SER 787           HG       SER 787  16.503  -7.544  -4.545

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LYS 788           H        LYS 788  20.223  -8.626  -5.962
    2    HA   LYS 788           HA       LYS 788  22.393  -9.724  -4.397
    3    HB2  LYS 788           HB2      LYS 788  21.313 -10.897  -6.374
    4    HB3  LYS 788           HB3      LYS 788  21.873  -9.556  -7.356
    5    HG2  LYS 788           HG2      LYS 788  24.184 -10.154  -6.849
    6    HG3  LYS 788           HG3      LYS 788  23.604 -11.514  -5.899
    7    HD2  LYS 788           HD2      LYS 788  24.319 -12.272  -8.105
    8    HD3  LYS 788           HD3      LYS 788  22.582 -12.475  -7.928
    9    HE2  LYS 788           HE2      LYS 788  23.738 -10.037  -9.243
   10    HE3  LYS 788           HE3      LYS 788  23.549 -11.532 -10.144
   11    HZ2  LYS 788           HZ1      LYS 788  21.687 -10.044 -10.462
   12    HZ1  LYS 788           HZ2      LYS 788  21.304 -10.031  -8.828
   13    HZ3  LYS 788           HZ3      LYS 788  21.176 -11.448  -9.725

  No H/Q in entry =          13
  In of MODEL   41
    1    H    CYS 789           H        CYS 789  24.641  -9.046  -5.398
    2    HA   CYS 789           HA       CYS 789  24.643  -6.167  -5.937
    3    HB2  CYS 789           HB2      CYS 789  27.078  -6.351  -5.562
    4    HB3  CYS 789           HB3      CYS 789  26.213  -7.039  -4.195

  No H/Q in entry =           4
  In of MODEL   41
    1    H    VAL 790           H        VAL 790  26.270  -5.616  -7.817
    2    HA   VAL 790           HA       VAL 790  25.513  -7.544  -9.864
    3    HB   VAL 790           HB       VAL 790  24.492  -5.346 -10.207
    4   HG12  VAL 790          HG11      VAL 790  25.849  -3.395 -10.862
    5   HG11  VAL 790          HG12      VAL 790  27.300  -4.325 -10.465
    6   HG13  VAL 790          HG13      VAL 790  26.148  -3.907  -9.196
    7   HG21  VAL 790          HG21      VAL 790  24.951  -6.710 -12.160
    8   HG23  VAL 790          HG22      VAL 790  26.563  -6.005 -12.300
    9   HG22  VAL 790          HG23      VAL 790  25.137  -5.001 -12.553

  No H/Q in entry =           9
  In of MODEL   41
    1    H    CYS 791           H        CYS 791  26.945  -8.427 -11.068
    2    HA   CYS 791           HA       CYS 791  29.653  -7.852 -10.280
    3    HB2  CYS 791           HB2      CYS 791  28.472 -10.360 -11.405
    4    HB3  CYS 791           HB3      CYS 791  30.211 -10.083 -11.318

  No H/Q in entry =           4
  In of MODEL   41
    1    H    ARG 792           H        ARG 792  30.828  -6.868 -11.346
    2    HA   ARG 792           HA       ARG 792  30.258  -5.882 -13.937
    3    HB2  ARG 792           HB2      ARG 792  32.618  -5.734 -12.093
    4    HB3  ARG 792           HB3      ARG 792  32.570  -4.854 -13.611
    5    HG2  ARG 792           HG2      ARG 792  30.553  -3.668 -12.733
    6    HG3  ARG 792           HG3      ARG 792  30.812  -4.496 -11.194
    7    HD2  ARG 792           HD2      ARG 792  32.714  -2.618 -12.589
    8    HD3  ARG 792           HD3      ARG 792  31.826  -2.311 -11.094
    9    HE   ARG 792           HE       ARG 792  33.209  -4.566 -10.578
   10   HH11  ARG 792          HH11      ARG 792  34.181  -1.296 -11.574
   11   HH12  ARG 792          HH12      ARG 792  35.723  -1.406 -10.884
   12   HH21  ARG 792          HH21      ARG 792  35.335  -4.703  -9.670
   13   HH22  ARG 792          HH22      ARG 792  36.444  -3.449  -9.864

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLU 793           H        GLU 793  30.983  -6.662 -15.764
    2    HA   GLU 793           HA       GLU 793  32.044  -9.263 -15.881
    3    HB2  GLU 793           HB2      GLU 793  31.728  -7.195 -18.070
    4    HB3  GLU 793           HB3      GLU 793  31.993  -8.919 -18.300
    5    HG2  GLU 793           HG2      GLU 793  29.887  -9.440 -17.247
    6    HG3  GLU 793           HG3      GLU 793  29.626  -7.742 -16.871

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ALA 794           H        ALA 794  34.008  -9.518 -17.613
    2    HA   ALA 794           HA       ALA 794  36.233  -9.028 -15.985
    3    HB2  ALA 794           HB1      ALA 794  36.037 -10.945 -17.461
    4    HB3  ALA 794           HB2      ALA 794  37.518 -10.036 -17.777
    5    HB1  ALA 794           HB3      ALA 794  36.136  -9.878 -18.862

  No H/Q in entry =           5
  In of MODEL   41
    1    H    SER 795           H        SER 795  34.932  -7.392 -18.754
    2    HA   SER 795           HA       SER 795  37.224  -5.822 -19.210
    3    HB2  SER 795           HB2      SER 795  35.539  -4.690 -20.784
    4    HB3  SER 795           HB3      SER 795  35.964  -6.380 -21.086
    5    HG   SER 795           HG       SER 795  33.601  -5.270 -20.055

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLU 796           H        GLU 796  34.703  -5.676 -16.950
    2    HA   GLU 796           HA       GLU 796  34.386  -2.780 -17.068
    3    HB2  GLU 796           HB2      GLU 796  32.931  -4.784 -15.400
    4    HB3  GLU 796           HB3      GLU 796  32.426  -3.113 -15.688
    5    HG2  GLU 796           HG2      GLU 796  32.497  -5.434 -17.597
    6    HG3  GLU 796           HG3      GLU 796  31.062  -4.650 -16.944

  No H/Q in entry =           6
  In of MODEL   41
    1    H    CYS 797           H        CYS 797  36.199  -5.049 -15.327
    2    HA   CYS 797           HA       CYS 797  36.176  -3.545 -12.846
    3    HB2  CYS 797           HB2      CYS 797  37.687  -6.037 -13.659
    4    HB3  CYS 797           HB3      CYS 797  37.788  -5.302 -12.058

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLU 798           H        GLU 798  38.172  -2.677 -11.859
    2    HA   GLU 798           HA       GLU 798  40.011  -1.691 -13.955
    3    HB2  GLU 798           HB2      GLU 798  38.379   0.047 -13.172
    4    HB3  GLU 798           HB3      GLU 798  39.081  -0.099 -11.567
    5    HG2  GLU 798           HG2      GLU 798  41.317   0.412 -12.753
    6    HG3  GLU 798           HG3      GLU 798  40.295   1.014 -14.052

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU 799           H        GLU 799  39.598  -2.878 -10.708
    2    HA   GLU 799           HA       GLU 799  42.174  -2.217  -9.780
    3    HB2  GLU 799           HB2      GLU 799  41.704  -3.959  -7.975
    4    HB3  GLU 799           HB3      GLU 799  40.603  -2.604  -8.055
    5    HG2  GLU 799           HG2      GLU 799  40.007  -5.197  -9.383
    6    HG3  GLU 799           HG3      GLU 799  39.658  -4.944  -7.669

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLU 800           H        GLU 800  43.795  -3.941  -9.078
    2    HA   GLU 800           HA       GLU 800  44.923  -4.699 -11.445
    3    HB2  GLU 800           HB2      GLU 800  46.651  -5.951 -10.200
    4    HB3  GLU 800           HB3      GLU 800  46.348  -4.360  -9.542
    5    HG2  GLU 800           HG2      GLU 800  45.041  -5.386  -7.728
    6    HG3  GLU 800           HG3      GLU 800  45.378  -6.974  -8.411

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLY 801           H        GLY 801  43.585  -7.167  -9.197
    2    HA3  GLY 801           HA2      GLY 801  42.546  -9.108  -9.714
    3    HA2  GLY 801           HA3      GLY 801  42.420  -8.544 -11.371

  No H/Q in entry =           3
  In of MODEL   41
    1    H    PHE 802           H        PHE 802  43.914 -10.654  -9.265
    2    HA   PHE 802           HA       PHE 802  46.366 -11.285 -10.393
    3    HB2  PHE 802           HB2      PHE 802  44.530 -12.393  -8.543
    4    HB3  PHE 802           HB3      PHE 802  45.088 -13.664  -9.620
    5    HD1  PHE 802           HD1      PHE 802  47.097 -14.689  -9.233
    6    HD2  PHE 802           HD2      PHE 802  46.297 -10.899  -7.510
    7    HE1  PHE 802           HE1      PHE 802  49.145 -14.848  -7.961
    8    HE2  PHE 802           HE2      PHE 802  48.341 -11.036  -6.232
    9    HZ   PHE 802           HZ       PHE 802  49.797 -13.014  -6.439

  No H/Q in entry =           9
  In of MODEL   41
    1    H    SER 803           H        SER 803  46.960 -13.062 -11.731
    2    HA   SER 803           HA       SER 803  44.911 -13.947 -13.595
    3    HB2  SER 803           HB2      SER 803  47.030 -14.505 -14.978
    4    HB3  SER 803           HB3      SER 803  46.595 -12.802 -14.777
    5    HG   SER 803           HG       SER 803  48.646 -14.262 -13.498

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ILE 804           H        ILE 804  44.330 -16.052 -13.430
    2    HA   ILE 804           HA       ILE 804  46.090 -17.859 -11.924
    3    HB   ILE 804           HB       ILE 804  44.242 -18.790 -10.643
    4   HG12  ILE 804          HG12      ILE 804  42.422 -18.248 -12.291
    5   HG13  ILE 804          HG13      ILE 804  41.984 -17.974 -10.611
    6   HG23  ILE 804          HG21      ILE 804  45.465 -17.017  -9.586
    7   HG22  ILE 804          HG22      ILE 804  43.767 -16.932  -9.115
    8   HG21  ILE 804          HG23      ILE 804  44.404 -15.812 -10.320
    9   HD11  ILE 804          HD11      ILE 804  42.351 -15.547 -10.992
   10   HD13  ILE 804          HD12      ILE 804  41.094 -16.234 -12.022
   11   HD12  ILE 804          HD13      ILE 804  42.688 -15.895 -12.689

  No H/Q in entry =          11
  In of MODEL   41
    1    H    CYS 805           H        CYS 805  45.089 -20.217 -12.025
    2    HA   CYS 805           HA       CYS 805  44.506 -20.718 -14.842
    3    HB2  CYS 805           HB2      CYS 805  46.558 -21.746 -14.049
    4    HB3  CYS 805           HB3      CYS 805  45.703 -22.473 -12.693

  No H/Q in entry =           4
  In of MODEL   41
    1    H    VAL 806           H        VAL 806  42.374 -21.114 -15.176
    2    HA   VAL 806           HA       VAL 806  40.937 -22.632 -13.119
    3    HB   VAL 806           HB       VAL 806  39.784 -20.344 -14.763
    4   HG13  VAL 806          HG11      VAL 806  38.107 -21.995 -14.390
    5   HG12  VAL 806          HG12      VAL 806  37.810 -20.580 -13.369
    6   HG11  VAL 806          HG13      VAL 806  38.486 -22.057 -12.670
    7   HG23  VAL 806          HG21      VAL 806  39.549 -19.196 -12.605
    8   HG22  VAL 806          HG22      VAL 806  41.217 -19.502 -13.084
    9   HG21  VAL 806          HG23      VAL 806  40.469 -20.505 -11.842

  No H/Q in entry =           9
  In of MODEL   41
    1    H    GLU 807           H        GLU 807  39.750 -24.301 -13.839
    2    HA   GLU 807           HA       GLU 807  39.925 -24.995 -16.620
    3    HB2  GLU 807           HB2      GLU 807  40.182 -26.691 -14.830
    4    HB3  GLU 807           HB3      GLU 807  38.539 -26.356 -14.310
    5    HG2  GLU 807           HG2      GLU 807  37.719 -27.110 -16.498
    6    HG3  GLU 807           HG3      GLU 807  39.386 -27.471 -16.957

  No H/Q in entry =           6
  In of MODEL   41
    1    H    VAL 808           H        VAL 808  38.602 -24.354 -17.983
    2    HA   VAL 808           HA       VAL 808  35.852 -23.714 -17.313
    3    HB   VAL 808           HB       VAL 808  37.159 -21.637 -17.209
    4   HG11  VAL 808          HG11      VAL 808  37.999 -22.243 -20.027
    5   HG13  VAL 808          HG12      VAL 808  39.028 -22.180 -18.600
    6   HG12  VAL 808          HG13      VAL 808  38.264 -20.705 -19.201
    7   HG22  VAL 808          HG21      VAL 808  34.896 -21.432 -18.011
    8   HG21  VAL 808          HG22      VAL 808  35.441 -21.795 -19.656
    9   HG23  VAL 808          HG23      VAL 808  35.960 -20.302 -18.862

  No H/Q in entry =           9
  In of MODEL   41
    1    H    ASN 809           H        ASN 809  34.509 -24.380 -18.877
    2    HA   ASN 809           HA       ASN 809  33.729 -25.355 -20.745
    3    HB2  ASN 809           HB2      ASN 809  36.094 -23.936 -21.737
    4    HB3  ASN 809           HB3      ASN 809  35.283 -25.039 -22.867
    5   HD21  ASN 809          HD21      ASN 809  35.440 -21.963 -21.512
    6   HD22  ASN 809          HD22      ASN 809  33.922 -21.352 -22.055

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLY 810           H        GLY 810  35.966 -26.614 -19.031
    2    HA3  GLY 810           HA2      GLY 810  36.288 -28.971 -19.013
    3    HA2  GLY 810           HA3      GLY 810  36.250 -28.918 -20.791

  No H/Q in entry =           3
  In of MODEL   41
    1    H    LYS 811           H        LYS 811  38.013 -26.384 -20.342
    2    HA   LYS 811           HA       LYS 811  40.525 -27.921 -20.135
    3    HB2  LYS 811           HB2      LYS 811  41.441 -26.337 -21.817
    4    HB3  LYS 811           HB3      LYS 811  40.174 -27.387 -22.431
    5    HG2  LYS 811           HG2      LYS 811  38.547 -25.548 -22.180
    6    HG3  LYS 811           HG3      LYS 811  39.847 -24.500 -21.622
    7    HD2  LYS 811           HD2      LYS 811  39.748 -25.873 -24.285
    8    HD3  LYS 811           HD3      LYS 811  39.275 -24.193 -24.016
    9    HE2  LYS 811           HE2      LYS 811  41.578 -23.719 -23.187
   10    HE3  LYS 811           HE3      LYS 811  42.006 -25.385 -23.541
   11    HZ1  LYS 811           HZ1      LYS 811  41.116 -23.422 -25.597
   12    HZ3  LYS 811           HZ2      LYS 811  41.641 -25.003 -25.860
   13    HZ2  LYS 811           HZ3      LYS 811  42.705 -23.849 -25.246

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLU 812           H        GLU 812  42.347 -26.819 -19.251
    2    HA   GLU 812           HA       GLU 812  41.614 -24.745 -17.368
    3    HB2  GLU 812           HB2      GLU 812  44.150 -26.307 -17.807
    4    HB3  GLU 812           HB3      GLU 812  44.002 -25.021 -16.614
    5    HG2  GLU 812           HG2      GLU 812  42.343 -26.219 -15.412
    6    HG3  GLU 812           HG3      GLU 812  42.216 -27.434 -16.681

  No H/Q in entry =           6
  In of MODEL   41
    1    H    GLN 813           H        GLN 813  41.820 -22.706 -17.673
    2    HA   GLN 813           HA       GLN 813  43.723 -21.751 -19.682
    3    HB2  GLN 813           HB2      GLN 813  41.581 -21.852 -20.736
    4    HB3  GLN 813           HB3      GLN 813  40.805 -21.103 -19.353
    5    HG2  GLN 813           HG2      GLN 813  41.956 -19.038 -19.818
    6    HG3  GLN 813           HG3      GLN 813  42.757 -19.802 -21.208
    7   HE21  GLN 813          HE21      GLN 813  40.814 -17.513 -20.958
    8   HE22  GLN 813          HE22      GLN 813  39.533 -17.914 -22.029

  No H/Q in entry =           8
  In of MODEL   41
    1    H    THR 814           H        THR 814  44.561 -19.678 -19.264
    2    HA   THR 814           HA       THR 814  44.405 -18.786 -16.504
    3    HB   THR 814           HB       THR 814  45.858 -17.549 -18.778
    4    HG1  THR 814           HG1      THR 814  46.240 -19.901 -17.967
    5   HG21  THR 814          HG21      THR 814  45.703 -16.123 -16.805
    6   HG23  THR 814          HG22      THR 814  47.368 -16.659 -17.017
    7   HG22  THR 814          HG23      THR 814  46.345 -17.419 -15.796

  No H/Q in entry =           7
  In of MODEL   41
    1    H    MET 815           H        MET 815  43.096 -17.336 -15.916
    2    HA   MET 815           HA       MET 815  42.106 -15.317 -17.767
    3    HB2  MET 815           HB2      MET 815  39.901 -15.537 -16.590
    4    HB3  MET 815           HB3      MET 815  40.348 -16.890 -17.624
    5    HG2  MET 815           HG2      MET 815  41.180 -18.057 -15.694
    6    HG3  MET 815           HG3      MET 815  40.606 -16.775 -14.634
    7    HE2  MET 815           HE1      MET 815  37.895 -19.535 -17.115
    8    HE1  MET 815           HE2      MET 815  39.655 -19.654 -16.989
    9    HE3  MET 815           HE3      MET 815  38.924 -18.301 -17.850

  No H/Q in entry =           9
  In of MODEL   41
    1    H    SER 816           H        SER 816  41.051 -13.552 -16.433
    2    HA   SER 816           HA       SER 816  42.926 -12.858 -14.350
    3    HB2  SER 816           HB2      SER 816  40.667 -11.237 -15.533
    4    HB3  SER 816           HB3      SER 816  42.002 -10.649 -14.533
    5    HG   SER 816           HG       SER 816  42.600 -10.263 -16.639

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLU 817           H        GLU 817  42.317 -12.266 -12.305
    2    HA   GLU 817           HA       GLU 817  40.596 -13.813 -10.831
    3    HB2  GLU 817           HB2      GLU 817  42.581 -12.402 -10.166
    4    HB3  GLU 817           HB3      GLU 817  41.478 -11.048 -10.229
    5    HG2  GLU 817           HG2      GLU 817  40.287 -11.690  -8.399
    6    HG3  GLU 817           HG3      GLU 817  40.952 -13.340  -8.408

  No H/Q in entry =           6
  In of MODEL   41
    1    H    CYS 818           H        CYS 818  40.112 -10.504 -11.973
    2    HA   CYS 818           HA       CYS 818  37.545 -10.148 -10.875
    3    HB2  CYS 818           HB2      CYS 818  37.390  -8.276 -12.573
    4    HB3  CYS 818           HB3      CYS 818  38.802  -8.220 -11.529

  No H/Q in entry =           4
  In of MODEL   41
    1    H    GLU 819           H        GLU 819  38.692 -11.564 -13.840
    2    HA   GLU 819           HA       GLU 819  36.178 -11.717 -15.163
    3    HB2  GLU 819           HB2      GLU 819  38.241 -11.707 -16.432
    4    HB3  GLU 819           HB3      GLU 819  38.801 -13.142 -15.600
    5    HG2  GLU 819           HG2      GLU 819  37.193 -14.502 -16.700
    6    HG3  GLU 819           HG3      GLU 819  36.373 -13.096 -17.372

  No H/Q in entry =           6
  In of MODEL   41
    1    H    ALA 820           H        ALA 820  38.263 -14.132 -13.616
    2    HA   ALA 820           HA       ALA 820  36.528 -16.272 -13.784
    3    HB3  ALA 820           HB1      ALA 820  38.643 -15.701 -11.718
    4    HB1  ALA 820           HB2      ALA 820  38.853 -16.574 -13.234
    5    HB2  ALA 820           HB3      ALA 820  37.868 -17.267 -11.947

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLY 821           H        GLY 821  36.853 -13.745 -11.348
    2    HA3  GLY 821           HA2      GLY 821  35.037 -14.779  -9.448
    3    HA2  GLY 821           HA3      GLY 821  35.523 -13.094  -9.599

  No H/Q in entry =           3
  In of MODEL   41
    1    H    ALA 822           H        ALA 822  34.614 -12.477 -12.112
    2    HA   ALA 822           HA       ALA 822  31.884 -12.005 -11.711
    3    HB2  ALA 822           HB1      ALA 822  33.307 -10.588 -13.152
    4    HB3  ALA 822           HB2      ALA 822  31.901 -11.179 -14.031
    5    HB1  ALA 822           HB3      ALA 822  33.478 -11.921 -14.287

  No H/Q in entry =           5
  In of MODEL   41
    1    H    LEU 823           H        LEU 823  33.666 -14.437 -13.507
    2    HA   LEU 823           HA       LEU 823  31.528 -15.690 -14.782
    3    HB2  LEU 823           HB2      LEU 823  34.143 -16.871 -13.846
    4    HB3  LEU 823           HB3      LEU 823  33.036 -17.683 -14.923
    5    HG   LEU 823           HG       LEU 823  34.640 -15.195 -15.488
    6   HD13  LEU 823          HD11      LEU 823  35.689 -16.545 -17.212
    7   HD12  LEU 823          HD12      LEU 823  34.737 -17.938 -16.699
    8   HD11  LEU 823          HD13      LEU 823  35.927 -17.232 -15.607
    9   HD22  LEU 823          HD21      LEU 823  32.495 -14.919 -16.540
   10   HD21  LEU 823          HD22      LEU 823  32.567 -16.544 -17.217
   11   HD23  LEU 823          HD23      LEU 823  33.697 -15.303 -17.770

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ARG 824           H        ARG 824  32.941 -16.212 -11.583
    2    HA   ARG 824           HA       ARG 824  31.417 -18.484 -10.917
    3    HB2  ARG 824           HB2      ARG 824  32.374 -16.383  -8.964
    4    HB3  ARG 824           HB3      ARG 824  31.836 -17.994  -8.536
    5    HG2  ARG 824           HG2      ARG 824  33.856 -18.770  -9.995
    6    HG3  ARG 824           HG3      ARG 824  34.376 -17.102  -9.833
    7    HD2  ARG 824           HD2      ARG 824  33.825 -19.019  -7.565
    8    HD3  ARG 824           HD3      ARG 824  35.408 -18.489  -8.119
    9    HE   ARG 824           HE       ARG 824  33.810 -16.281  -7.395
   10   HH11  ARG 824          HH11      ARG 824  35.689 -18.924  -5.893
   11   HH12  ARG 824          HH12      ARG 824  36.013 -18.100  -4.455
   12   HH21  ARG 824          HH21      ARG 824  34.230 -15.137  -5.349
   13   HH22  ARG 824          HH22      ARG 824  35.126 -15.824  -4.120

  No H/Q in entry =          13
  In of MODEL   41
    1    H    CYS 825           H        CYS 825  30.679 -15.050 -10.599
    2    HA   CYS 825           HA       CYS 825  28.295 -15.514  -9.127
    3    HB2  CYS 825           HB2      CYS 825  29.455 -13.280  -9.043
    4    HB3  CYS 825           HB3      CYS 825  28.993 -13.060 -10.716

  No H/Q in entry =           4
  In of MODEL   41
    1    H    ARG 826           H        ARG 826  28.986 -14.914 -12.566
    2    HA   ARG 826           HA       ARG 826  26.260 -14.622 -13.297
    3    HB2  ARG 826           HB2      ARG 826  27.028 -14.826 -15.651
    4    HB3  ARG 826           HB3      ARG 826  27.825 -13.551 -14.709
    5    HG2  ARG 826           HG2      ARG 826  29.772 -14.885 -14.553
    6    HG3  ARG 826           HG3      ARG 826  28.969 -16.264 -15.314
    7    HD2  ARG 826           HD2      ARG 826  29.367 -13.582 -16.655
    8    HD3  ARG 826           HD3      ARG 826  30.467 -14.948 -16.843
    9    HE   ARG 826           HE       ARG 826  28.051 -15.981 -17.481
   10   HH11  ARG 826          HH11      ARG 826  29.780 -13.110 -18.725
   11   HH12  ARG 826          HH12      ARG 826  29.160 -13.303 -20.285
   12   HH21  ARG 826          HH21      ARG 826  27.279 -16.207 -19.677
   13   HH22  ARG 826          HH22      ARG 826  27.744 -15.077 -20.844

  No H/Q in entry =          13
  In of MODEL   41
    1    H    GLY 827           H        GLY 827  27.880 -17.441 -12.564
    2    HA3  GLY 827           HA2      GLY 827  26.702 -19.499 -12.511
    3    HA2  GLY 827           HA3      GLY 827  25.680 -18.894 -13.809

  No H/Q in entry =           3
  In of MODEL   41
    1    H    GLN 828           H        GLN 828  28.907 -18.246 -14.376
    2    HA   GLN 828           HA       GLN 828  29.114 -20.143 -16.485
    3    HB2  GLN 828           HB2      GLN 828  30.335 -18.004 -16.532
    4    HB3  GLN 828           HB3      GLN 828  31.217 -18.472 -15.088
    5    HG2  GLN 828           HG2      GLN 828  32.602 -18.721 -17.074
    6    HG3  GLN 828           HG3      GLN 828  32.280 -20.290 -16.337
    7   HE21  GLN 828          HE21      GLN 828  31.650 -18.214 -19.019
    8   HE22  GLN 828          HE22      GLN 828  30.936 -19.419 -20.020

  No H/Q in entry =           8
  In of MODEL   41
    1    H    SER 829           H        SER 829  30.243 -22.101 -16.468
    2    HA   SER 829           HA       SER 829  30.566 -23.210 -13.819
    3    HB2  SER 829           HB2      SER 829  30.765 -24.537 -16.539
    4    HB3  SER 829           HB3      SER 829  30.766 -25.365 -14.981
    5    HG   SER 829           HG       SER 829  28.663 -23.627 -15.682

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ILE 830           H        ILE 830  32.466 -22.966 -12.867
    2    HA   ILE 830           HA       ILE 830  34.885 -23.168 -14.473
    3    HB   ILE 830           HB       ILE 830  36.005 -21.355 -13.385
    4   HG12  ILE 830          HG12      ILE 830  34.869 -21.314 -11.168
    5   HG13  ILE 830          HG13      ILE 830  34.988 -19.727 -11.882
    6   HG21  ILE 830          HG21      ILE 830  34.934 -20.783 -15.424
    7   HG23  ILE 830          HG22      ILE 830  34.867 -19.403 -14.326
    8   HG22  ILE 830          HG23      ILE 830  33.436 -20.405 -14.574
    9   HD12  ILE 830          HD11      ILE 830  32.806 -20.123 -10.773
   10   HD11  ILE 830          HD12      ILE 830  32.474 -21.394 -11.948
   11   HD13  ILE 830          HD13      ILE 830  32.678 -19.723 -12.477

  No H/Q in entry =          11
  In of MODEL   41
    1    H    SER 831           H        SER 831  36.633 -23.975 -13.435
    2    HA   SER 831           HA       SER 831  36.312 -24.668 -10.635
    3    HB2  SER 831           HB2      SER 831  37.253 -26.344 -12.922
    4    HB3  SER 831           HB3      SER 831  37.484 -26.773 -11.229
    5    HG   SER 831           HG       SER 831  34.959 -26.051 -11.635

  No H/Q in entry =           5
  In of MODEL   41
    1    H    VAL 832           H        VAL 832  37.738 -23.202  -9.830
    2    HA   VAL 832           HA       VAL 832  40.170 -22.484 -11.086
    3    HB   VAL 832           HB       VAL 832  39.420 -22.341  -8.153
    4   HG13  VAL 832          HG11      VAL 832  41.175 -20.602  -7.977
    5   HG12  VAL 832          HG12      VAL 832  41.567 -20.837  -9.679
    6   HG11  VAL 832          HG13      VAL 832  41.855 -22.137  -8.529
    7   HG21  VAL 832          HG21      VAL 832  37.840 -21.095  -9.528
    8   HG23  VAL 832          HG22      VAL 832  39.162 -20.215 -10.292
    9   HG22  VAL 832          HG23      VAL 832  38.830 -19.992  -8.577

  No H/Q in entry =           9
  In of MODEL   41
    1    H    THR 833           H        THR 833  41.676 -24.004 -11.525
    2    HA   THR 833           HA       THR 833  41.882 -26.293  -9.803
    3    HB   THR 833           HB       THR 833  43.570 -27.044 -11.509
    4    HG1  THR 833           HG1      THR 833  43.757 -25.863 -13.391
    5   HG23  THR 833          HG21      THR 833  41.236 -27.770 -11.645
    6   HG22  THR 833          HG22      THR 833  41.878 -27.488 -13.266
    7   HG21  THR 833          HG23      THR 833  40.818 -26.299 -12.521

  No H/Q in entry =           7
  In of MODEL   41
    1    H    SER 834           H        SER 834  43.689 -23.430 -10.652
    2    HA   SER 834           HA       SER 834  45.189 -23.729  -8.258
    3    HB2  SER 834           HB2      SER 834  47.382 -23.379  -9.520
    4    HB3  SER 834           HB3      SER 834  46.679 -24.996  -9.567
    5    HG   SER 834           HG       SER 834  45.701 -24.257 -11.595

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ILE 835           H        ILE 835  46.001 -21.814  -7.501
    2    HA   ILE 835           HA       ILE 835  44.813 -19.453  -8.697
    3    HB   ILE 835           HB       ILE 835  45.603 -18.266  -6.722
    4   HG12  ILE 835          HG12      ILE 835  46.855 -20.893  -5.877
    5   HG13  ILE 835          HG13      ILE 835  47.727 -19.468  -6.462
    6   HG21  ILE 835          HG21      ILE 835  44.326 -20.919  -6.090
    7   HG23  ILE 835          HG22      ILE 835  43.483 -19.444  -6.573
    8   HG22  ILE 835          HG23      ILE 835  44.337 -19.520  -5.022
    9   HD12  ILE 835          HD11      ILE 835  47.721 -19.760  -4.061
   10   HD11  ILE 835          HD12      ILE 835  45.966 -19.456  -4.086
   11   HD13  ILE 835          HD13      ILE 835  47.095 -18.222  -4.637

  No H/Q in entry =          11
  In of MODEL   41
    1    H    ARG 836           H        ARG 836  47.468 -21.130  -9.091
    2    HA   ARG 836           HA       ARG 836  49.274 -18.959  -9.656
    3    HB2  ARG 836           HB2      ARG 836  49.519 -21.918 -10.170
    4    HB3  ARG 836           HB3      ARG 836  50.800 -20.732 -10.402
    5    HG2  ARG 836           HG2      ARG 836  50.667 -20.185  -8.008
    6    HG3  ARG 836           HG3      ARG 836  49.476 -21.471  -7.814
    7    HD2  ARG 836           HD2      ARG 836  52.300 -21.786  -8.784
    8    HD3  ARG 836           HD3      ARG 836  51.641 -22.159  -7.190
    9    HE   ARG 836           HE       ARG 836  50.216 -23.844  -8.336
   10   HH11  ARG 836          HH11      ARG 836  53.197 -22.800  -9.952
   11   HH12  ARG 836          HH12      ARG 836  53.441 -24.297 -10.718
   12   HH21  ARG 836          HH21      ARG 836  50.571 -25.896  -9.484
   13   HH22  ARG 836          HH22      ARG 836  51.962 -26.039 -10.461

  No H/Q in entry =          13
  In of MODEL   41
    1    HA   PRO 837           HA       PRO 837  47.458 -18.644 -13.777
    2    HB2  PRO 837           HB2      PRO 837  49.581 -17.406 -15.022
    3    HB3  PRO 837           HB3      PRO 837  48.400 -16.551 -14.025
    4    HG2  PRO 837           HG2      PRO 837  51.136 -17.524 -13.300
    5    HG3  PRO 837           HG3      PRO 837  50.346 -15.995 -12.882
    6    HD2  PRO 837           HD2      PRO 837  50.528 -18.016 -11.129
    7    HD3  PRO 837           HD3      PRO 837  49.102 -16.956 -11.181

  No H/Q in entry =           7
  In of MODEL   41
    1    H    CYS 838           H        CYS 838  47.706 -19.773 -15.808
    2    HA   CYS 838           HA       CYS 838  49.925 -21.604 -15.659
    3    HB2  CYS 838           HB2      CYS 838  48.599 -23.095 -17.206
    4    HB3  CYS 838           HB3      CYS 838  47.875 -22.889 -15.632

  No H/Q in entry =           4
  In of MODEL   41
    1    H    ALA 839           H        ALA 839  50.314 -22.409 -18.194
    2    HA   ALA 839           HA       ALA 839  51.097 -19.969 -19.550
    3    HB3  ALA 839           HB1      ALA 839  52.301 -21.481 -21.050
    4    HB1  ALA 839           HB2      ALA 839  51.581 -22.873 -20.245
    5    HB2  ALA 839           HB3      ALA 839  52.696 -21.822 -19.366

  No H/Q in entry =           5
  In of MODEL   41
    1    H    ALA 840           H        ALA 840  48.461 -21.857 -19.373
    2    HA   ALA 840           HA       ALA 840  47.727 -22.035 -22.117
    3    HB1  ALA 840           HB1      ALA 840  45.613 -22.922 -21.291
    4    HB2  ALA 840           HB2      ALA 840  46.104 -22.518 -19.646
    5    HB3  ALA 840           HB3      ALA 840  46.997 -23.738 -20.546

  No H/Q in entry =           5
  In of MODEL   41
    1    H    GLU 841           H        GLU 841  47.995 -19.771 -22.517
    2    HA   GLU 841           HA       GLU 841  45.470 -18.385 -21.992
    3    HB2  GLU 841           HB2      GLU 841  48.115 -17.254 -22.953
    4    HB3  GLU 841           HB3      GLU 841  46.619 -16.331 -22.870
    5    HG2  GLU 841           HG2      GLU 841  46.586 -16.648 -20.450
    6    HG3  GLU 841           HG3      GLU 841  48.107 -17.544 -20.548

  No H/Q in entry =           6
  In of MODEL   41
    1    H    THR 842           H        THR 842  44.738 -20.082 -23.432
    2    HA   THR 842           HA       THR 842  44.616 -19.113 -26.145
    3    HB   THR 842           HB       THR 842  45.321 -22.004 -25.588
    4    HG1  THR 842           HG1      THR 842  46.924 -19.756 -25.825
    5   HG23  THR 842          HG21      THR 842  45.827 -22.049 -27.995
    6   HG22  THR 842          HG22      THR 842  45.400 -20.343 -28.116
    7   HG21  THR 842          HG23      THR 842  44.165 -21.534 -27.703

  No H/Q in entry =           7
  In of MODEL   41
    1    H    GLN 843           H        GLN 843  42.501 -18.949 -26.291
    2    HA   GLN 843           HA       GLN 843  40.675 -20.552 -24.739
    3    HB2  GLN 843           HB2      GLN 843  40.157 -18.468 -26.863
    4    HB3  GLN 843           HB3      GLN 843  38.957 -19.137 -25.766
    5    HG2  GLN 843           HG2      GLN 843  39.999 -18.143 -23.887
    6    HG3  GLN 843           HG3      GLN 843  41.400 -17.668 -24.838
    7   HE21  GLN 843          HE21      GLN 843  41.236 -15.547 -24.384
    8   HE22  GLN 843          HE22      GLN 843  39.953 -14.542 -24.956

  No H/Q in entry =           8
  In of MODEL   42
    1    H1   GLY 689           H3       GLY 689  47.696   1.416 -31.626
    2    H2   GLY 689           H2       GLY 689  46.496   1.056 -32.756
    3    H3   GLY 689           H1       GLY 689  46.096   1.334 -31.126
    4    HA2  GLY 689           HA2      GLY 689  47.680  -0.919 -32.180
    5    HA3  GLY 689           HA3      GLY 689  46.038  -1.013 -31.555

  No H/Q in entry =           5
  In of MODEL   42
    1    H    SER 690           H        SER 690  45.982   0.352 -29.312
    2    HA   SER 690           HA       SER 690  46.429   0.372 -27.154
    3    HB2  SER 690           HB2      SER 690  48.015  -2.152 -27.732
    4    HB3  SER 690           HB3      SER 690  47.481  -1.620 -26.133
    5    HG   SER 690           HG       SER 690  45.357  -1.810 -26.827

  No H/Q in entry =           5
  In of MODEL   42
    1    H    HIS 691           H        HIS 691  48.683  -0.130 -25.610
    2    HA   HIS 691           HA       HIS 691  50.533   0.828 -24.867
    3    HB2  HIS 691           HB2      HIS 691  51.378   0.821 -27.777
    4    HB3  HIS 691           HB3      HIS 691  52.445   1.224 -26.439
    5    HD1  HIS 691           HD1      HIS 691  51.537  -1.513 -28.525
    6    HD2  HIS 691           HD2      HIS 691  52.561  -1.092 -24.525
    7    HE1  HIS 691           HE1      HIS 691  52.203  -3.795 -27.759
    8    HE2  HIS 691           HE2      HIS 691  52.442  -3.541 -25.282

  No H/Q in entry =           8
  In of MODEL   42
    1    H    MET 692           H        MET 692  49.378   2.566 -24.149
    2    HA   MET 692           HA       MET 692  49.396   4.967 -25.782
    3    HB2  MET 692           HB2      MET 692  48.445   4.552 -22.926
    4    HB3  MET 692           HB3      MET 692  48.239   6.021 -23.864
    5    HG2  MET 692           HG2      MET 692  46.824   4.819 -25.457
    6    HG3  MET 692           HG3      MET 692  47.046   3.337 -24.538
    7    HE1  MET 692           HE1      MET 692  45.448   6.920 -24.609
    8    HE3  MET 692           HE2      MET 692  46.475   7.030 -23.176
    9    HE2  MET 692           HE3      MET 692  44.721   7.033 -23.008

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ASN 693           H        ASN 693  50.885   3.639 -22.920
    2    HA   ASN 693           HA       ASN 693  52.822   5.843 -22.901
    3    HB2  ASN 693           HB2      ASN 693  52.194   3.782 -20.768
    4    HB3  ASN 693           HB3      ASN 693  53.499   4.952 -20.659
    5   HD21  ASN 693          HD21      ASN 693  51.291   4.570 -18.878
    6   HD22  ASN 693          HD22      ASN 693  50.395   6.033 -18.851

  No H/Q in entry =           6
  In of MODEL   42
    1    HA   PRO 694           HA       PRO 694  55.578   2.596 -24.366
    2    HB2  PRO 694           HB2      PRO 694  57.627   4.559 -24.746
    3    HB3  PRO 694           HB3      PRO 694  56.638   3.784 -25.983
    4    HG2  PRO 694           HG2      PRO 694  56.516   6.470 -25.315
    5    HG3  PRO 694           HG3      PRO 694  55.238   5.571 -26.142
    6    HD2  PRO 694           HD2      PRO 694  55.443   6.350 -23.268
    7    HD3  PRO 694           HD3      PRO 694  54.026   6.238 -24.339

  No H/Q in entry =           7
  In of MODEL   42
    1    H    LEU 695           H        LEU 695  57.299   1.531 -23.371
    2    HA   LEU 695           HA       LEU 695  58.004   2.536 -20.754
    3    HB2  LEU 695           HB2      LEU 695  58.568  -0.099 -22.142
    4    HB3  LEU 695           HB3      LEU 695  59.256   0.303 -20.587
    5    HG   LEU 695           HG       LEU 695  56.954   0.338 -19.625
    6   HD12  LEU 695          HD11      LEU 695  56.079  -0.659 -22.337
    7   HD11  LEU 695          HD12      LEU 695  55.672   0.904 -21.628
    8   HD13  LEU 695          HD13      LEU 695  55.080  -0.582 -20.885
    9   HD21  LEU 695          HD21      LEU 695  58.294  -1.697 -19.504
   10   HD23  LEU 695          HD22      LEU 695  57.688  -2.196 -21.079
   11   HD22  LEU 695          HD23      LEU 695  56.586  -2.077 -19.711

  No H/Q in entry =          11
  In of MODEL   42
    1    H    THR 696           H        THR 696  59.307   4.244 -21.128
    2    HA   THR 696           HA       THR 696  61.194   4.537 -23.108
    3    HB   THR 696           HB       THR 696  61.387   5.842 -20.405
    4    HG1  THR 696           HG1      THR 696  59.717   7.125 -20.930
    5   HG23  THR 696          HG21      THR 696  63.082   6.405 -22.082
    6   HG22  THR 696          HG22      THR 696  62.027   7.785 -21.774
    7   HG21  THR 696          HG23      THR 696  61.817   6.820 -23.237

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLN 697           H        GLN 697  61.800   3.973 -19.639
    2    HA   GLN 697           HA       GLN 697  64.580   3.335 -20.168
    3    HB2  GLN 697           HB2      GLN 697  63.025   3.260 -17.596
    4    HB3  GLN 697           HB3      GLN 697  64.769   3.171 -17.769
    5    HG2  GLN 697           HG2      GLN 697  64.647   5.471 -18.825
    6    HG3  GLN 697           HG3      GLN 697  62.972   5.519 -18.294
    7   HE21  GLN 697          HE21      GLN 697  65.593   4.001 -16.520
    8   HE22  GLN 697          HE22      GLN 697  65.573   5.095 -15.215

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ALA 698           H        ALA 698  65.323   1.342 -18.636
    2    HA   ALA 698           HA       ALA 698  63.985  -0.983 -19.599
    3    HB1  ALA 698           HB1      ALA 698  66.421  -1.001 -19.189
    4    HB2  ALA 698           HB2      ALA 698  65.612  -2.207 -18.185
    5    HB3  ALA 698           HB3      ALA 698  66.137  -0.677 -17.479

  No H/Q in entry =           5
  In of MODEL   42
    1    H    VAL 699           H        VAL 699  61.954  -0.871 -18.899
    2    HA   VAL 699           HA       VAL 699  61.414  -0.439 -16.082
    3    HB   VAL 699           HB       VAL 699  59.547  -0.548 -18.463
    4   HG12  VAL 699          HG11      VAL 699  57.822   0.291 -16.933
    5   HG11  VAL 699          HG12      VAL 699  58.954   0.149 -15.586
    6   HG13  VAL 699          HG13      VAL 699  58.411  -1.296 -16.441
    7   HG21  VAL 699          HG21      VAL 699  60.957   1.434 -18.468
    8   HG23  VAL 699          HG22      VAL 699  60.487   1.790 -16.806
    9   HG22  VAL 699          HG23      VAL 699  59.289   1.863 -18.093

  No H/Q in entry =           9
  In of MODEL   42
    1    HA   PRO 700           HA       PRO 700  60.727  -4.848 -15.979
    2    HB2  PRO 700           HB2      PRO 700  61.051  -5.146 -13.339
    3    HB3  PRO 700           HB3      PRO 700  62.429  -4.917 -14.420
    4    HG2  PRO 700           HG2      PRO 700  61.161  -3.003 -12.540
    5    HG3  PRO 700           HG3      PRO 700  62.852  -3.122 -13.048
    6    HD2  PRO 700           HD2      PRO 700  60.921  -1.318 -14.027
    7    HD3  PRO 700           HD3      PRO 700  62.518  -1.643 -14.729

  No H/Q in entry =           7
  In of MODEL   42
    1    H    LYS 701           H        LYS 701  59.080  -6.105 -15.341
    2    HA   LYS 701           HA       LYS 701  56.870  -4.681 -14.089
    3    HB2  LYS 701           HB2      LYS 701  56.698  -6.911 -16.137
    4    HB3  LYS 701           HB3      LYS 701  55.331  -6.281 -15.251
    5    HG2  LYS 701           HG2      LYS 701  55.186  -5.207 -17.340
    6    HG3  LYS 701           HG3      LYS 701  55.908  -4.018 -16.258
    7    HD2  LYS 701           HD2      LYS 701  57.009  -4.007 -18.433
    8    HD3  LYS 701           HD3      LYS 701  58.115  -4.508 -17.156
    9    HE2  LYS 701           HE2      LYS 701  58.391  -5.872 -19.144
   10    HE3  LYS 701           HE3      LYS 701  57.814  -6.844 -17.803
   11    HZ1  LYS 701           HZ1      LYS 701  55.546  -6.727 -18.796
   12    HZ3  LYS 701           HZ2      LYS 701  56.686  -7.419 -19.808
   13    HZ2  LYS 701           HZ3      LYS 701  56.186  -5.863 -20.108

  No H/Q in entry =          13
  In of MODEL   42
    1    H    CYS 702           H        CYS 702  55.807  -5.718 -12.474
    2    HA   CYS 702           HA       CYS 702  57.346  -7.959 -11.391
    3    HB2  CYS 702           HB2      CYS 702  55.486  -6.067  -9.925
    4    HB3  CYS 702           HB3      CYS 702  56.566  -7.257  -9.225

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLN 703           H        GLN 703  55.984  -9.490 -10.031
    2    HA   GLN 703           HA       GLN 703  53.781 -10.332 -11.667
    3    HB2  GLN 703           HB2      GLN 703  54.777 -11.511  -9.072
    4    HB3  GLN 703           HB3      GLN 703  53.737 -12.297 -10.248
    5    HG2  GLN 703           HG2      GLN 703  56.622 -11.529 -10.626
    6    HG3  GLN 703           HG3      GLN 703  55.994 -13.151 -10.389
    7   HE21  GLN 703          HE21      GLN 703  53.713 -12.732 -12.222
    8   HE22  GLN 703          HE22      GLN 703  54.415 -12.760 -13.793

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ARG 704           H        ARG 704  51.830 -11.162 -10.252
    2    HA   ARG 704           HA       ARG 704  50.425  -8.849  -9.479
    3    HB2  ARG 704           HB2      ARG 704  49.815 -11.724  -8.894
    4    HB3  ARG 704           HB3      ARG 704  48.704 -10.401  -8.625
    5    HG2  ARG 704           HG2      ARG 704  49.837 -11.183 -11.291
    6    HG3  ARG 704           HG3      ARG 704  48.271 -11.662 -10.643
    7    HD2  ARG 704           HD2      ARG 704  47.619  -9.329 -10.529
    8    HD3  ARG 704           HD3      ARG 704  49.184  -8.858 -11.185
    9    HE   ARG 704           HE       ARG 704  48.030 -10.744 -12.899
   10   HH11  ARG 704          HH11      ARG 704  47.532  -7.411 -11.885
   11   HH12  ARG 704          HH12      ARG 704  46.901  -6.893 -13.384
   12   HH21  ARG 704          HH21      ARG 704  47.135 -10.033 -14.978
   13   HH22  ARG 704          HH22      ARG 704  46.653  -8.422 -15.142

  No H/Q in entry =          13
  In of MODEL   42
    1    H    TRP 705           H        TRP 705  52.323 -11.023  -7.595
    2    HA   TRP 705           HA       TRP 705  51.287  -9.903  -5.097
    3    HB2  TRP 705           HB2      TRP 705  52.370 -11.890  -4.041
    4    HB3  TRP 705           HB3      TRP 705  51.108 -12.278  -5.209
    5    HD1  TRP 705           HD1      TRP 705  54.784 -12.771  -4.517
    6    HE1  TRP 705           HE1      TRP 705  55.800 -14.294  -6.293
    7    HE3  TRP 705           HE3      TRP 705  50.852 -12.961  -7.766
    8    HZ2  TRP 705           HZ2      TRP 705  55.048 -15.428  -8.785
    9    HZ3  TRP 705           HZ3      TRP 705  51.080 -14.286  -9.829
   10    HH2  TRP 705           HH2      TRP 705  53.137 -15.497 -10.321

  No H/Q in entry =          10
  In of MODEL   42
    1    H    GLU 706           H        GLU 706  53.480  -9.042  -7.156
    2    HA   GLU 706           HA       GLU 706  55.478  -8.453  -5.133
    3    HB2  GLU 706           HB2      GLU 706  55.887  -9.065  -8.065
    4    HB3  GLU 706           HB3      GLU 706  57.132  -8.345  -7.047
    5    HG2  GLU 706           HG2      GLU 706  56.968 -10.381  -5.596
    6    HG3  GLU 706           HG3      GLU 706  55.881 -11.074  -6.795

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LYS 707           H        LYS 707  56.459  -6.437  -5.306
    2    HA   LYS 707           HA       LYS 707  54.945  -4.491  -6.900
    3    HB2  LYS 707           HB2      LYS 707  56.001  -4.119  -4.095
    4    HB3  LYS 707           HB3      LYS 707  55.479  -2.798  -5.128
    5    HG2  LYS 707           HG2      LYS 707  53.226  -3.885  -5.238
    6    HG3  LYS 707           HG3      LYS 707  53.802  -5.047  -4.045
    7    HD2  LYS 707           HD2      LYS 707  52.538  -3.264  -2.960
    8    HD3  LYS 707           HD3      LYS 707  54.230  -3.207  -2.466
    9    HE2  LYS 707           HE2      LYS 707  53.365  -0.964  -2.917
   10    HE3  LYS 707           HE3      LYS 707  54.635  -1.376  -4.054
   11    HZ3  LYS 707           HZ1      LYS 707  52.867  -0.331  -5.201
   12    HZ2  LYS 707           HZ2      LYS 707  51.710  -1.359  -4.559
   13    HZ1  LYS 707           HZ3      LYS 707  52.837  -1.946  -5.678

  No H/Q in entry =          13
  In of MODEL   42
    1    H    LEU 708           H        LEU 708  56.184  -2.427  -7.163
    2    HA   LEU 708           HA       LEU 708  58.863  -3.178  -8.030
    3    HB2  LEU 708           HB2      LEU 708  57.365  -2.539  -9.801
    4    HB3  LEU 708           HB3      LEU 708  56.954  -1.044  -8.982
    5    HG   LEU 708           HG       LEU 708  59.310  -0.292  -9.318
    6   HD13  LEU 708          HD11      LEU 708  60.397  -2.446  -9.519
    7   HD12  LEU 708          HD12      LEU 708  60.701  -1.461 -10.947
    8   HD11  LEU 708          HD13      LEU 708  59.516  -2.769 -11.011
    9   HD23  LEU 708          HD21      LEU 708  57.792  -1.028 -11.817
   10   HD22  LEU 708          HD22      LEU 708  59.063   0.189 -11.708
   11   HD21  LEU 708          HD23      LEU 708  57.546   0.417 -10.837

  No H/Q in entry =          11
  In of MODEL   42
    1    H    GLN 709           H        GLN 709  60.352  -2.536  -6.673
    2    HA   GLN 709           HA       GLN 709  60.598   0.299  -6.099
    3    HB2  GLN 709           HB2      GLN 709  61.085   0.076  -3.771
    4    HB3  GLN 709           HB3      GLN 709  59.573  -0.783  -3.995
    5    HG2  GLN 709           HG2      GLN 709  60.741  -2.914  -3.946
    6    HG3  GLN 709           HG3      GLN 709  62.287  -2.068  -3.866
    7   HE21  GLN 709          HE21      GLN 709  62.827  -3.067  -1.941
    8   HE22  GLN 709          HE22      GLN 709  62.084  -2.615  -0.449

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ASN 710           H        ASN 710  62.813   0.822  -5.796
    2    HA   ASN 710           HA       ASN 710  65.096   0.550  -5.999
    3    HB2  ASN 710           HB2      ASN 710  64.584  -1.111  -4.174
    4    HB3  ASN 710           HB3      ASN 710  64.481  -2.362  -5.381
    5   HD21  ASN 710          HD21      ASN 710  66.515  -0.298  -3.618
    6   HD22  ASN 710          HD22      ASN 710  68.027  -1.063  -4.004

  No H/Q in entry =           6
  In of MODEL   42
    1    H    SER 711           H        SER 711  63.085  -0.057  -8.179
    2    HA   SER 711           HA       SER 711  62.948  -0.590 -10.343
    3    HB2  SER 711           HB2      SER 711  65.109   0.740 -10.439
    4    HB3  SER 711           HB3      SER 711  65.991  -0.775 -10.297
    5    HG   SER 711           HG       SER 711  65.607  -1.199 -12.310

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ARG 712           H        ARG 712  62.922  -2.669  -8.240
    2    HA   ARG 712           HA       ARG 712  63.246  -4.935 -10.035
    3    HB2  ARG 712           HB2      ARG 712  63.998  -6.352  -8.153
    4    HB3  ARG 712           HB3      ARG 712  65.186  -5.118  -8.573
    5    HG2  ARG 712           HG2      ARG 712  64.711  -3.917  -6.617
    6    HG3  ARG 712           HG3      ARG 712  63.213  -4.812  -6.320
    7    HD2  ARG 712           HD2      ARG 712  65.974  -6.014  -6.307
    8    HD3  ARG 712           HD3      ARG 712  65.110  -5.498  -4.852
    9    HE   ARG 712           HE       ARG 712  63.352  -7.189  -5.992
   10   HH11  ARG 712          HH11      ARG 712  66.793  -7.614  -5.326
   11   HH12  ARG 712          HH12      ARG 712  66.676  -9.292  -5.070
   12   HH21  ARG 712          HH21      ARG 712  63.152  -9.451  -5.614
   13   HH22  ARG 712          HH22      ARG 712  64.502 -10.378  -5.192

  No H/Q in entry =          13
  In of MODEL   42
    1    H    CYS 713           H        CYS 713  62.196  -6.873  -8.848
    2    HA   CYS 713           HA       CYS 713  59.611  -5.968  -7.891
    3    HB2  CYS 713           HB2      CYS 713  58.976  -8.352  -8.319
    4    HB3  CYS 713           HB3      CYS 713  59.521  -7.492  -9.754

  No H/Q in entry =           4
  In of MODEL   42
    1    H    VAL 714           H        VAL 714  59.056  -6.289  -5.856
    2    HA   VAL 714           HA       VAL 714  60.571  -8.179  -4.195
    3    HB   VAL 714           HB       VAL 714  60.271  -6.648  -2.262
    4   HG11  VAL 714          HG11      VAL 714  61.776  -5.430  -4.581
    5   HG13  VAL 714          HG12      VAL 714  62.401  -6.587  -3.411
    6   HG12  VAL 714          HG13      VAL 714  61.966  -4.956  -2.895
    7   HG21  VAL 714          HG21      VAL 714  58.329  -5.397  -3.056
    8   HG23  VAL 714          HG22      VAL 714  59.316  -4.656  -4.318
    9   HG22  VAL 714          HG23      VAL 714  59.641  -4.299  -2.617

  No H/Q in entry =           9
  In of MODEL   42
    1    H    CYS 715           H        CYS 715  59.031  -8.497  -2.065
    2    HA   CYS 715           HA       CYS 715  56.547  -9.325  -3.346
    3    HB2  CYS 715           HB2      CYS 715  56.176 -10.628  -1.231
    4    HB3  CYS 715           HB3      CYS 715  57.701 -11.022  -2.002

  No H/Q in entry =           4
  In of MODEL   42
    1    H    LYS 716           H        LYS 716  54.537  -8.704  -2.726
    2    HA   LYS 716           HA       LYS 716  54.331  -6.065  -1.684
    3    HB2  LYS 716           HB2      LYS 716  52.921  -6.879  -3.555
    4    HB3  LYS 716           HB3      LYS 716  52.223  -8.088  -2.511
    5    HG2  LYS 716           HG2      LYS 716  50.863  -6.558  -1.425
    6    HG3  LYS 716           HG3      LYS 716  51.896  -5.191  -1.840
    7    HD2  LYS 716           HD2      LYS 716  49.764  -5.199  -3.112
    8    HD3  LYS 716           HD3      LYS 716  51.176  -5.293  -4.156
    9    HE2  LYS 716           HE2      LYS 716  50.822  -7.751  -4.307
   10    HE3  LYS 716           HE3      LYS 716  49.344  -7.556  -3.363
   11    HZ2  LYS 716           HZ1      LYS 716  48.970  -7.615  -5.829
   12    HZ1  LYS 716           HZ2      LYS 716  49.848  -6.214  -5.974
   13    HZ3  LYS 716           HZ3      LYS 716  48.405  -6.199  -5.116

  No H/Q in entry =          13
  In of MODEL   42
    1    H    MET 717           H        MET 717  52.491  -5.671   0.034
    2    HA   MET 717           HA       MET 717  53.317  -7.149   2.414
    3    HB2  MET 717           HB2      MET 717  51.624  -4.692   2.047
    4    HB3  MET 717           HB3      MET 717  52.036  -5.388   3.600
    5    HG2  MET 717           HG2      MET 717  54.012  -4.250   1.626
    6    HG3  MET 717           HG3      MET 717  53.322  -3.380   2.988
    7    HE3  MET 717           HE1      MET 717  55.162  -6.971   2.391
    8    HE2  MET 717           HE2      MET 717  56.691  -6.525   3.136
    9    HE1  MET 717           HE3      MET 717  56.113  -5.653   1.715

  No H/Q in entry =           9
  In of MODEL   42
    1    HA   PRO 718           HA       PRO 718  49.799  -9.776   2.059
    2    HB2  PRO 718           HB2      PRO 718  49.835 -10.815   4.594
    3    HB3  PRO 718           HB3      PRO 718  50.909 -11.349   3.295
    4    HG2  PRO 718           HG2      PRO 718  51.441  -9.436   5.527
    5    HG3  PRO 718           HG3      PRO 718  52.491 -10.707   4.876
    6    HD2  PRO 718           HD2      PRO 718  52.820  -8.106   4.257
    7    HD3  PRO 718           HD3      PRO 718  53.156  -9.399   3.085

  No H/Q in entry =           7
  In of MODEL   42
    1    H    TYR 719           H        TYR 719  50.087  -7.487   4.644
    2    HA   TYR 719           HA       TYR 719  47.305  -7.665   5.392
    3    HB2  TYR 719           HB2      TYR 719  47.817  -5.818   6.953
    4    HB3  TYR 719           HB3      TYR 719  48.955  -7.146   7.119
    5    HD1  TYR 719           HD1      TYR 719  48.543  -3.626   6.391
    6    HD2  TYR 719           HD2      TYR 719  51.302  -6.870   6.174
    7    HE1  TYR 719           HE1      TYR 719  50.397  -2.037   6.136
    8    HE2  TYR 719           HE2      TYR 719  53.145  -5.288   5.925
    9    HH   TYR 719           HH       TYR 719  52.823  -2.017   6.559

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLU 720           H        GLU 720  48.825  -6.391   2.805
    2    HA   GLU 720           HA       GLU 720  46.957  -4.154   2.499
    3    HB2  GLU 720           HB2      GLU 720  49.436  -3.668   2.555
    4    HB3  GLU 720           HB3      GLU 720  49.618  -4.669   1.129
    5    HG2  GLU 720           HG2      GLU 720  49.639  -2.267   0.642
    6    HG3  GLU 720           HG3      GLU 720  48.331  -3.117  -0.174

  No H/Q in entry =           6
  In of MODEL   42
    1    H    CYS 721           H        CYS 721  47.035  -7.232   1.960
    2    HA   CYS 721           HA       CYS 721  46.515  -7.333  -0.903
    3    HB2  CYS 721           HB2      CYS 721  46.659  -9.503   1.186
    4    HB3  CYS 721           HB3      CYS 721  46.419  -9.765  -0.538

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLY 722           H        GLY 722  44.490  -7.157  -1.618
    2    HA3  GLY 722           HA2      GLY 722  42.333  -8.175   0.080
    3    HA2  GLY 722           HA3      GLY 722  42.233  -6.531  -0.532

  No H/Q in entry =           3
  In of MODEL   42
    1    HA   PRO 723           HA       PRO 723  40.198  -7.704  -4.228
    2    HB2  PRO 723           HB2      PRO 723  42.384  -6.504  -5.860
    3    HB3  PRO 723           HB3      PRO 723  40.652  -6.173  -5.900
    4    HG2  PRO 723           HG2      PRO 723  42.290  -4.448  -4.756
    5    HG3  PRO 723           HG3      PRO 723  40.732  -4.830  -3.999
    6    HD2  PRO 723           HD2      PRO 723  43.473  -5.800  -3.271
    7    HD3  PRO 723           HD3      PRO 723  42.139  -5.287  -2.218

  No H/Q in entry =           7
  In of MODEL   42
    1    H    SER 724           H        SER 724  40.366  -9.950  -4.208
    2    HA   SER 724           HA       SER 724  41.606 -11.122  -6.397
    3    HB2  SER 724           HB2      SER 724  42.846 -12.763  -4.880
    4    HB3  SER 724           HB3      SER 724  43.636 -11.223  -5.271
    5    HG   SER 724           HG       SER 724  42.330 -10.666  -3.181

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU 725           H        LEU 725  41.227 -13.522  -6.264
    2    HA   LEU 725           HA       LEU 725  38.556 -14.012  -5.400
    3    HB2  LEU 725           HB2      LEU 725  40.657 -15.528  -6.779
    4    HB3  LEU 725           HB3      LEU 725  39.381 -16.468  -6.013
    5    HG   LEU 725           HG       LEU 725  39.032 -14.392  -8.186
    6   HD12  LEU 725          HD11      LEU 725  38.428 -16.314  -9.567
    7   HD11  LEU 725          HD12      LEU 725  38.832 -17.401  -8.235
    8   HD13  LEU 725          HD13      LEU 725  40.091 -16.428  -8.993
    9   HD21  LEU 725          HD21      LEU 725  37.102 -14.503  -6.668
   10   HD23  LEU 725          HD22      LEU 725  37.030 -16.251  -6.915
   11   HD22  LEU 725          HD23      LEU 725  36.757 -15.152  -8.264

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ASP 726           H        ASP 726  37.845 -15.159  -3.799
    2    HA   ASP 726           HA       ASP 726  39.629 -15.765  -1.676
    3    HB2  ASP 726           HB2      ASP 726  37.402 -16.737  -0.725
    4    HB3  ASP 726           HB3      ASP 726  37.675 -14.999  -0.775

  No H/Q in entry =           4
  In of MODEL   42
    1    H    VAL 727           H        VAL 727  40.484 -17.557  -1.216
    2    HA   VAL 727           HA       VAL 727  39.571 -19.933  -2.557
    3    HB   VAL 727           HB       VAL 727  42.012 -20.629  -2.825
    4   HG11  VAL 727          HG11      VAL 727  41.130 -18.211  -4.405
    5   HG13  VAL 727          HG12      VAL 727  40.728 -19.889  -4.764
    6   HG12  VAL 727          HG13      VAL 727  42.394 -19.336  -4.895
    7   HG21  VAL 727          HG21      VAL 727  42.522 -17.703  -2.292
    8   HG23  VAL 727          HG22      VAL 727  43.706 -18.848  -2.918
    9   HG22  VAL 727          HG23      VAL 727  43.053 -19.058  -1.291

  No H/Q in entry =           9
  In of MODEL   42
    1    H    CYS 728           H        CYS 728  40.257 -21.938  -1.381
    2    HA   CYS 728           HA       CYS 728  40.333 -21.370   1.483
    3    HB2  CYS 728           HB2      CYS 728  39.807 -24.032   0.146
    4    HB3  CYS 728           HB3      CYS 728  39.461 -23.550   1.795

  No H/Q in entry =           4
  In of MODEL   42
    1    H    ALA 729           H        ALA 729  42.181 -21.595   2.502
    2    HA   ALA 729           HA       ALA 729  44.166 -23.367   1.305
    3    HB2  ALA 729           HB1      ALA 729  45.870 -21.837   2.098
    4    HB1  ALA 729           HB2      ALA 729  44.609 -20.751   2.700
    5    HB3  ALA 729           HB3      ALA 729  44.768 -21.056   0.966

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLN 730           H        GLN 730  45.561 -24.296   2.771
    2    HA   GLN 730           HA       GLN 730  44.377 -24.581   5.425
    3    HB2  GLN 730           HB2      GLN 730  44.269 -26.609   4.023
    4    HB3  GLN 730           HB3      GLN 730  46.016 -26.581   3.895
    5    HG2  GLN 730           HG2      GLN 730  46.278 -26.927   6.226
    6    HG3  GLN 730           HG3      GLN 730  44.553 -26.798   6.516
    7   HE21  GLN 730          HE21      GLN 730  44.289 -28.885   7.324
    8   HE22  GLN 730          HE22      GLN 730  44.541 -30.286   6.350

  No H/Q in entry =           8
  In of MODEL   42
    1    H    ASP 731           H        ASP 731  45.520 -24.072   7.006
    2    HA   ASP 731           HA       ASP 731  48.149 -22.941   6.821
    3    HB2  ASP 731           HB2      ASP 731  46.330 -22.255   8.436
    4    HB3  ASP 731           HB3      ASP 731  46.554 -23.792   9.251

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLU 732           H        GLU 732  50.071 -24.143   6.977
    2    HA   GLU 732           HA       GLU 732  49.879 -26.964   7.241
    3    HB2  GLU 732           HB2      GLU 732  52.188 -25.112   6.863
    4    HB3  GLU 732           HB3      GLU 732  52.447 -26.821   7.185
    5    HG2  GLU 732           HG2      GLU 732  50.848 -25.690   4.895
    6    HG3  GLU 732           HG3      GLU 732  52.499 -26.309   4.795

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ARG 733           H        ARG 733  50.167 -24.596   9.669
    2    HA   ARG 733           HA       ARG 733  51.476 -26.491  11.424
    3    HB2  ARG 733           HB2      ARG 733  50.915 -23.559  11.569
    4    HB3  ARG 733           HB3      ARG 733  51.418 -24.497  12.959
    5    HG2  ARG 733           HG2      ARG 733  52.982 -24.186  10.393
    6    HG3  ARG 733           HG3      ARG 733  53.299 -23.323  11.903
    7    HD2  ARG 733           HD2      ARG 733  53.483 -26.310  11.459
    8    HD3  ARG 733           HD3      ARG 733  54.822 -25.195  11.701
    9    HE   ARG 733           HE       ARG 733  53.394 -24.779  13.895
   10   HH11  ARG 733          HH11      ARG 733  54.512 -27.803  12.422
   11   HH12  ARG 733          HH12      ARG 733  54.531 -28.661  13.895
   12   HH21  ARG 733          HH21      ARG 733  53.441 -25.986  15.927
   13   HH22  ARG 733          HH22      ARG 733  53.903 -27.627  15.910

  No H/Q in entry =          13
  In of MODEL   42
    1    H    SER 734           H        SER 734  48.713 -24.319  11.332
    2    HA   SER 734           HA       SER 734  47.513 -25.584  13.615
    3    HB2  SER 734           HB2      SER 734  46.390 -23.549  11.706
    4    HB3  SER 734           HB3      SER 734  45.793 -23.913  13.330
    5    HG   SER 734           HG       SER 734  47.392 -22.869  14.175

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LYS 735           H        LYS 735  47.474 -26.104  10.225
    2    HA   LYS 735           HA       LYS 735  46.394 -27.460   8.806
    3    HB2  LYS 735           HB2      LYS 735  45.587 -28.966  11.293
    4    HB3  LYS 735           HB3      LYS 735  45.497 -29.579   9.648
    5    HG2  LYS 735           HG2      LYS 735  47.978 -28.888  11.205
    6    HG3  LYS 735           HG3      LYS 735  47.444 -30.493  10.701
    7    HD2  LYS 735           HD2      LYS 735  48.284 -28.244   8.859
    8    HD3  LYS 735           HD3      LYS 735  49.279 -29.613   9.299
    9    HE2  LYS 735           HE2      LYS 735  46.652 -29.763   7.807
   10    HE3  LYS 735           HE3      LYS 735  48.251 -29.860   7.082
   11    HZ3  LYS 735           HZ1      LYS 735  47.334 -32.031   7.350
   12    HZ2  LYS 735           HZ2      LYS 735  47.067 -31.824   8.988
   13    HZ1  LYS 735           HZ3      LYS 735  48.647 -31.883   8.378

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ARG 736           H        ARG 736  44.998 -25.276  10.071
    2    HA   ARG 736           HA       ARG 736  42.185 -25.964   9.902
    3    HB2  ARG 736           HB2      ARG 736  41.859 -23.536  10.393
    4    HB3  ARG 736           HB3      ARG 736  42.865 -24.344  11.594
    5    HG2  ARG 736           HG2      ARG 736  44.866 -23.508  10.455
    6    HG3  ARG 736           HG3      ARG 736  43.847 -22.681   9.297
    7    HD2  ARG 736           HD2      ARG 736  43.003 -21.235  11.012
    8    HD3  ARG 736           HD3      ARG 736  43.875 -22.140  12.257
    9    HE   ARG 736           HE       ARG 736  45.880 -21.479  10.661
   10   HH11  ARG 736          HH11      ARG 736  43.280 -19.366  11.821
   11   HH12  ARG 736          HH12      ARG 736  44.287 -17.992  11.840
   12   HH21  ARG 736          HH21      ARG 736  47.165 -19.679  10.663
   13   HH22  ARG 736          HH22      ARG 736  46.553 -18.160  11.201

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ILE 737           H        ILE 737  40.872 -25.442   8.199
    2    HA   ILE 737           HA       ILE 737  42.117 -24.497   5.774
    3    HB   ILE 737           HB       ILE 737  39.199 -25.100   6.284
    4   HG12  ILE 737          HG12      ILE 737  40.553 -27.110   6.852
    5   HG13  ILE 737          HG13      ILE 737  39.531 -27.360   5.445
    6   HG22  ILE 737          HG21      ILE 737  40.834 -25.100   3.740
    7   HG21  ILE 737          HG22      ILE 737  39.751 -23.819   4.270
    8   HG23  ILE 737          HG23      ILE 737  39.096 -25.404   3.869
    9   HD12  ILE 737          HD11      ILE 737  42.478 -26.798   5.440
   10   HD11  ILE 737          HD12      ILE 737  41.454 -26.995   4.012
   11   HD13  ILE 737          HD13      ILE 737  41.697 -28.356   5.120

  No H/Q in entry =          11
  In of MODEL   42
    1    H    LEU 738           H        LEU 738  42.141 -22.374   5.441
    2    HA   LEU 738           HA       LEU 738  39.984 -20.823   6.564
    3    HB2  LEU 738           HB2      LEU 738  41.395 -18.966   7.188
    4    HB3  LEU 738           HB3      LEU 738  41.891 -20.398   8.057
    5    HG   LEU 738           HG       LEU 738  43.351 -19.221   5.677
    6   HD13  LEU 738          HD11      LEU 738  43.406 -17.717   7.602
    7   HD12  LEU 738          HD12      LEU 738  44.983 -18.455   7.327
    8   HD11  LEU 738          HD13      LEU 738  43.950 -19.043   8.629
    9   HD23  LEU 738          HD21      LEU 738  45.160 -20.711   6.408
   10   HD22  LEU 738          HD22      LEU 738  43.666 -21.556   5.958
   11   HD21  LEU 738          HD23      LEU 738  44.062 -21.336   7.661

  No H/Q in entry =          11
  In of MODEL   42
    1    HA   PRO 739           HA       PRO 739  39.649 -19.157   2.545
    2    HB2  PRO 739           HB2      PRO 739  38.241 -16.994   3.135
    3    HB3  PRO 739           HB3      PRO 739  37.522 -18.618   3.252
    4    HG2  PRO 739           HG2      PRO 739  38.608 -16.880   5.446
    5    HG3  PRO 739           HG3      PRO 739  37.122 -17.849   5.431
    6    HD2  PRO 739           HD2      PRO 739  39.470 -18.747   6.584
    7    HD3  PRO 739           HD3      PRO 739  38.258 -19.816   5.831

  No H/Q in entry =           7
  In of MODEL   42
    1    H    LEU 740           H        LEU 740  41.470 -18.427   1.814
    2    HA   LEU 740           HA       LEU 740  42.523 -15.830   2.734
    3    HB2  LEU 740           HB2      LEU 740  43.842 -18.048   1.186
    4    HB3  LEU 740           HB3      LEU 740  44.551 -16.475   1.450
    5    HG   LEU 740           HG       LEU 740  43.952 -18.550   3.550
    6   HD11  LEU 740          HD11      LEU 740  46.499 -17.421   2.437
    7   HD13  LEU 740          HD12      LEU 740  45.839 -19.036   2.150
    8   HD12  LEU 740          HD13      LEU 740  46.378 -18.578   3.767
    9   HD21  LEU 740          HD21      LEU 740  45.141 -15.786   3.833
   10   HD23  LEU 740          HD22      LEU 740  45.087 -17.010   5.098
   11   HD22  LEU 740          HD23      LEU 740  43.587 -16.323   4.478

  No H/Q in entry =          11
  In of MODEL   42
    1    H    THR 741           H        THR 741  43.366 -14.580   0.791
    2    HA   THR 741           HA       THR 741  41.707 -15.203  -1.505
    3    HB   THR 741           HB       THR 741  42.520 -12.780  -2.084
    4    HG1  THR 741           HG1      THR 741  42.319 -11.925   0.416
    5   HG21  THR 741          HG21      THR 741  40.364 -13.375  -0.063
    6   HG23  THR 741          HG22      THR 741  40.260 -13.441  -1.834
    7   HG22  THR 741          HG23      THR 741  40.498 -11.886  -1.027

  No H/Q in entry =           7
  In of MODEL   42
    1    H    VAL 742           H        VAL 742  42.698 -14.700  -3.557
    2    HA   VAL 742           HA       VAL 742  45.006 -16.144  -3.851
    3    HB   VAL 742           HB       VAL 742  43.830 -14.130  -5.771
    4   HG13  VAL 742          HG11      VAL 742  46.041 -14.530  -6.424
    5   HG12  VAL 742          HG12      VAL 742  44.959 -15.393  -7.524
    6   HG11  VAL 742          HG13      VAL 742  45.837 -16.272  -6.252
    7   HG23  VAL 742          HG21      VAL 742  42.851 -16.066  -6.853
    8   HG22  VAL 742          HG22      VAL 742  42.273 -15.820  -5.200
    9   HG21  VAL 742          HG23      VAL 742  43.467 -17.089  -5.546

  No H/Q in entry =           9
  In of MODEL   42
    1    H    CYS 743           H        CYS 743  44.520 -12.666  -3.586
    2    HA   CYS 743           HA       CYS 743  47.193 -11.911  -4.115
    3    HB2  CYS 743           HB2      CYS 743  45.225 -10.341  -4.226
    4    HB3  CYS 743           HB3      CYS 743  45.121 -10.417  -2.472

  No H/Q in entry =           4
  In of MODEL   42
    1    H    LYS 744           H        LYS 744  45.329 -12.654  -1.229
    2    HA   LYS 744           HA       LYS 744  47.236 -11.995   0.710
    3    HB2  LYS 744           HB2      LYS 744  44.746 -12.628   0.893
    4    HB3  LYS 744           HB3      LYS 744  45.307 -14.272   0.922
    5    HG2  LYS 744           HG2      LYS 744  44.966 -13.592   3.197
    6    HG3  LYS 744           HG3      LYS 744  46.701 -13.762   2.920
    7    HD2  LYS 744           HD2      LYS 744  46.894 -11.336   2.642
    8    HD3  LYS 744           HD3      LYS 744  45.155 -11.166   2.885
    9    HE2  LYS 744           HE2      LYS 744  47.113 -12.267   4.893
   10    HE3  LYS 744           HE3      LYS 744  46.469 -10.632   4.900
   11    HZ1  LYS 744           HZ1      LYS 744  44.786 -13.085   5.161
   12    HZ3  LYS 744           HZ2      LYS 744  44.269 -11.491   5.317
   13    HZ2  LYS 744           HZ3      LYS 744  45.339 -12.149   6.437

  No H/Q in entry =          13
  In of MODEL   42
    1    H    MET 745           H        MET 745  46.245 -15.207  -0.423
    2    HA   MET 745           HA       MET 745  48.197 -16.743   0.755
    3    HB2  MET 745           HB2      MET 745  46.739 -18.073   0.075
    4    HB3  MET 745           HB3      MET 745  46.181 -17.124  -1.323
    5    HG2  MET 745           HG2      MET 745  47.007 -19.099  -2.314
    6    HG3  MET 745           HG3      MET 745  48.348 -18.004  -2.412
    7    HE2  MET 745           HE1      MET 745  48.080 -21.510   0.524
    8    HE1  MET 745           HE2      MET 745  46.840 -21.005  -0.643
    9    HE3  MET 745           HE3      MET 745  47.153 -20.035   0.788

  No H/Q in entry =           9
  In of MODEL   42
    1    H    HIS 746           H        HIS 746  48.304 -15.274  -2.533
    2    HA   HIS 746           HA       HIS 746  50.758 -16.511  -3.241
    3    HB2  HIS 746           HB2      HIS 746  49.175 -14.341  -4.247
    4    HB3  HIS 746           HB3      HIS 746  50.912 -14.129  -4.572
    5    HD1  HIS 746           HD1      HIS 746  51.955 -16.376  -5.867
    6    HD2  HIS 746           HD2      HIS 746  47.858 -15.752  -6.006
    7    HE1  HIS 746           HE1      HIS 746  51.156 -17.599  -7.886
    8    HE2  HIS 746           HE2      HIS 746  48.695 -17.065  -8.036

  No H/Q in entry =           8
  In of MODEL   42
    1    H    VAL 747           H        VAL 747  50.155 -13.350  -1.768
    2    HA   VAL 747           HA       VAL 747  52.892 -12.687  -1.570
    3    HB   VAL 747           HB       VAL 747  50.442 -11.655  -0.109
    4   HG11  VAL 747          HG11      VAL 747  52.436 -11.345   1.280
    5   HG13  VAL 747          HG12      VAL 747  51.847  -9.810   0.646
    6   HG12  VAL 747          HG13      VAL 747  53.259 -10.580  -0.079
    7   HG23  VAL 747          HG21      VAL 747  52.139 -10.492  -2.308
    8   HG22  VAL 747          HG22      VAL 747  50.736  -9.718  -1.561
    9   HG21  VAL 747          HG23      VAL 747  50.535 -11.192  -2.505

  No H/Q in entry =           9
  In of MODEL   42
    1    H    LEU 748           H        LEU 748  50.551 -13.941   0.650
    2    HA   LEU 748           HA       LEU 748  51.766 -14.526   3.021
    3    HB2  LEU 748           HB2      LEU 748  49.449 -14.833   2.449
    4    HB3  LEU 748           HB3      LEU 748  49.878 -15.925   1.186
    5    HG   LEU 748           HG       LEU 748  48.634 -16.999   2.797
    6   HD11  LEU 748          HD11      LEU 748  51.397 -18.014   2.865
    7   HD13  LEU 748          HD12      LEU 748  49.998 -18.453   1.855
    8   HD12  LEU 748          HD13      LEU 748  50.000 -18.840   3.568
    9   HD23  LEU 748          HD21      LEU 748  49.340 -17.310   5.125
   10   HD22  LEU 748          HD22      LEU 748  48.759 -15.734   4.640
   11   HD21  LEU 748          HD23      LEU 748  50.514 -15.987   4.888

  No H/Q in entry =          11
  In of MODEL   42
    1    H    HIS 749           H        HIS 749  51.771 -16.446   0.076
    2    HA   HIS 749           HA       HIS 749  53.336 -18.619   0.920
    3    HB2  HIS 749           HB2      HIS 749  51.708 -18.189  -1.112
    4    HB3  HIS 749           HB3      HIS 749  53.196 -17.733  -1.933
    5    HD1  HIS 749           HD1      HIS 749  54.546 -19.643  -2.866
    6    HD2  HIS 749           HD2      HIS 749  51.611 -20.842  -0.204
    7    HE1  HIS 749           HE1      HIS 749  54.459 -22.144  -3.038
    8    HE2  HIS 749           HE2      HIS 749  53.093 -22.758  -1.046

  No H/Q in entry =           8
  In of MODEL   42
    1    H    CYS 750           H        CYS 750  54.054 -15.664  -0.913
    2    HA   CYS 750           HA       CYS 750  56.792 -16.360  -1.341
    3    HB2  CYS 750           HB2      CYS 750  55.582 -15.061  -3.013
    4    HB3  CYS 750           HB3      CYS 750  55.303 -13.751  -1.890

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLN 751           H        GLN 751  55.081 -14.720   1.135
    2    HA   GLN 751           HA       GLN 751  57.230 -13.303   2.295
    3    HB2  GLN 751           HB2      GLN 751  54.672 -14.380   3.492
    4    HB3  GLN 751           HB3      GLN 751  55.815 -13.407   4.404
    5    HG2  GLN 751           HG2      GLN 751  54.544 -12.496   1.857
    6    HG3  GLN 751           HG3      GLN 751  53.819 -12.196   3.424
    7   HE21  GLN 751          HE21      GLN 751  54.744 -10.262   1.467
    8   HE22  GLN 751          HE22      GLN 751  55.995  -9.361   2.201

  No H/Q in entry =           8
  In of MODEL   42
    1    H    GLY 752           H        GLY 752  56.413 -16.618   2.181
    2    HA3  GLY 752           HA2      GLY 752  58.117 -18.226   2.719
    3    HA2  GLY 752           HA3      GLY 752  58.577 -17.220   4.080

  No H/Q in entry =           3
  In of MODEL   42
    1    H    ARG 753           H        ARG 753  55.191 -17.740   3.483
    2    HA   ARG 753           HA       ARG 753  55.115 -19.396   5.894
    3    HB2  ARG 753           HB2      ARG 753  52.788 -18.066   4.472
    4    HB3  ARG 753           HB3      ARG 753  52.750 -18.867   6.025
    5    HG2  ARG 753           HG2      ARG 753  54.268 -16.345   5.411
    6    HG3  ARG 753           HG3      ARG 753  52.714 -16.441   6.237
    7    HD2  ARG 753           HD2      ARG 753  53.761 -17.729   8.044
    8    HD3  ARG 753           HD3      ARG 753  55.313 -17.639   7.207
    9    HE   ARG 753           HE       ARG 753  54.425 -15.063   7.451
   10   HH11  ARG 753          HH11      ARG 753  55.312 -17.619   9.710
   11   HH12  ARG 753          HH12      ARG 753  55.795 -16.578  10.956
   12   HH21  ARG 753          HH21      ARG 753  55.093 -13.622   9.096
   13   HH22  ARG 753          HH22      ARG 753  55.697 -14.220  10.585

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ASN 754           H        ASN 754  54.332 -21.435   5.864
    2    HA   ASN 754           HA       ASN 754  54.018 -22.660   3.256
    3    HB2  ASN 754           HB2      ASN 754  54.273 -23.887   6.014
    4    HB3  ASN 754           HB3      ASN 754  54.066 -24.815   4.538
    5   HD21  ASN 754          HD21      ASN 754  56.223 -24.768   6.501
    6   HD22  ASN 754          HD22      ASN 754  57.661 -24.426   5.610

  No H/Q in entry =           6
  In of MODEL   42
    1    H    TYR 755           H        TYR 755  52.075 -22.588   2.448
    2    HA   TYR 755           HA       TYR 755  49.841 -23.538   4.080
    3    HB2  TYR 755           HB2      TYR 755  49.938 -21.106   2.334
    4    HB3  TYR 755           HB3      TYR 755  48.436 -21.985   2.553
    5    HD1  TYR 755           HD1      TYR 755  51.144 -20.917   4.955
    6    HD2  TYR 755           HD2      TYR 755  47.051 -20.743   3.870
    7    HE1  TYR 755           HE1      TYR 755  50.696 -19.525   6.917
    8    HE2  TYR 755           HE2      TYR 755  46.583 -19.353   5.799
    9    HH   TYR 755           HH       TYR 755  47.592 -18.981   8.059

  No H/Q in entry =           9
  In of MODEL   42
    1    H    THR 756           H        THR 756  48.477 -24.821   3.033
    2    HA   THR 756           HA       THR 756  49.222 -25.715   0.336
    3    HB   THR 756           HB       THR 756  47.739 -27.018   2.636
    4    HG1  THR 756           HG1      THR 756  49.683 -27.512   3.193
    5   HG23  THR 756          HG21      THR 756  47.726 -29.074   1.311
    6   HG22  THR 756          HG22      THR 756  48.458 -28.195  -0.050
    7   HG21  THR 756          HG23      THR 756  46.834 -27.776   0.510

  No H/Q in entry =           7
  In of MODEL   42
    1    H    LEU 757           H        LEU 757  47.359 -25.957  -1.200
    2    HA   LEU 757           HA       LEU 757  45.119 -24.382  -0.273
    3    HB2  LEU 757           HB2      LEU 757  45.886 -25.102  -3.087
    4    HB3  LEU 757           HB3      LEU 757  44.386 -24.302  -2.657
    5    HG   LEU 757           HG       LEU 757  46.128 -22.697  -1.441
    6   HD13  LEU 757          HD11      LEU 757  48.102 -23.812  -2.172
    7   HD12  LEU 757          HD12      LEU 757  48.008 -22.215  -2.916
    8   HD11  LEU 757          HD13      LEU 757  47.619 -23.655  -3.861
    9   HD23  LEU 757          HD21      LEU 757  45.236 -22.504  -4.303
   10   HD22  LEU 757          HD22      LEU 757  45.809 -21.163  -3.289
   11   HD21  LEU 757          HD23      LEU 757  44.340 -22.036  -2.855

  No H/Q in entry =          11
  In of MODEL   42
    1    H    THR 758           H        THR 758  43.001 -25.000  -0.659
    2    HA   THR 758           HA       THR 758  42.662 -27.885  -0.830
    3    HB   THR 758           HB       THR 758  41.066 -27.644   1.198
    4    HG1  THR 758           HG1      THR 758  42.210 -25.174   1.049
    5   HG22  THR 758          HG21      THR 758  44.057 -27.389   1.636
    6   HG21  THR 758          HG22      THR 758  43.209 -28.891   1.275
    7   HG23  THR 758          HG23      THR 758  42.903 -28.047   2.791

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLY 759           H        GLY 759  40.143 -28.307  -0.557
    2    HA3  GLY 759           HA2      GLY 759  38.990 -27.152  -2.867
    3    HA2  GLY 759           HA3      GLY 759  38.241 -28.314  -1.786

  No H/Q in entry =           3
  In of MODEL   42
    1    H    ARG 760           H        ARG 760  36.910 -26.323  -2.973
    2    HA   ARG 760           HA       ARG 760  36.588 -23.827  -1.800
    3    HB2  ARG 760           HB2      ARG 760  35.646 -24.220  -3.934
    4    HB3  ARG 760           HB3      ARG 760  34.769 -25.632  -3.383
    5    HG2  ARG 760           HG2      ARG 760  34.167 -23.031  -2.247
    6    HG3  ARG 760           HG3      ARG 760  33.646 -23.320  -3.933
    7    HD2  ARG 760           HD2      ARG 760  32.940 -24.709  -1.377
    8    HD3  ARG 760           HD3      ARG 760  31.864 -23.802  -2.455
    9    HE   ARG 760           HE       ARG 760  32.969 -26.507  -2.921
   10   HH11  ARG 760          HH11      ARG 760  30.667 -24.006  -3.882
   11   HH12  ARG 760          HH12      ARG 760  29.588 -25.066  -4.633
   12   HH21  ARG 760          HH21      ARG 760  31.501 -27.998  -4.001
   13   HH22  ARG 760          HH22      ARG 760  30.082 -27.387  -4.724

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ASP 761           H        ASP 761  34.966 -26.791  -1.143
    2    HA   ASP 761           HA       ASP 761  33.419 -25.505   0.932
    3    HB2  ASP 761           HB2      ASP 761  32.175 -27.748   0.996
    4    HB3  ASP 761           HB3      ASP 761  32.021 -26.721  -0.429

  No H/Q in entry =           4
  In of MODEL   42
    1    H    SER 762           H        SER 762  36.318 -26.361   1.114
    2    HA   SER 762           HA       SER 762  36.194 -28.129   3.391
    3    HB2  SER 762           HB2      SER 762  38.537 -26.586   2.250
    4    HB3  SER 762           HB3      SER 762  38.652 -27.789   3.533
    5    HG   SER 762           HG       SER 762  37.322 -28.555   1.216

  No H/Q in entry =           5
  In of MODEL   42
    1    H    CYS 763           H        CYS 763  35.949 -24.768   2.830
    2    HA   CYS 763           HA       CYS 763  35.427 -24.327   5.638
    3    HB2  CYS 763           HB2      CYS 763  36.850 -22.350   5.830
    4    HB3  CYS 763           HB3      CYS 763  37.856 -23.711   5.329

  No H/Q in entry =           4
  In of MODEL   42
    1    H    THR 764           H        THR 764  34.729 -21.744   5.672
    2    HA   THR 764           HA       THR 764  32.659 -21.664   3.671
    3    HB   THR 764           HB       THR 764  33.236 -19.757   5.954
    4    HG1  THR 764           HG1      THR 764  32.388 -22.251   6.013
    5   HG22  THR 764          HG21      THR 764  30.770 -20.202   4.270
    6   HG21  THR 764          HG22      THR 764  31.850 -18.811   4.163
    7   HG23  THR 764          HG23      THR 764  30.899 -19.077   5.627

  No H/Q in entry =           7
  In of MODEL   42
    1    H    LEU 765           H        LEU 765  33.132 -20.857   1.779
    2    HA   LEU 765           HA       LEU 765  35.164 -18.817   1.575
    3    HB2  LEU 765           HB2      LEU 765  34.837 -21.021   0.131
    4    HB3  LEU 765           HB3      LEU 765  33.734 -19.976  -0.747
    5    HG   LEU 765           HG       LEU 765  35.585 -18.388  -1.156
    6   HD12  LEU 765          HD11      LEU 765  37.872 -19.118  -0.691
    7   HD11  LEU 765          HD12      LEU 765  37.209 -20.465   0.254
    8   HD13  LEU 765          HD13      LEU 765  36.928 -18.811   0.765
    9   HD21  LEU 765          HD21      LEU 765  35.051 -20.121  -2.814
   10   HD23  LEU 765          HD22      LEU 765  36.168 -21.226  -2.006
   11   HD22  LEU 765          HD23      LEU 765  36.772 -19.748  -2.768

  No H/Q in entry =          11
  In of MODEL   42
    1    HA   PRO 766           HA       PRO 766  32.048 -15.762   1.638
    2    HB2  PRO 766           HB2      PRO 766  33.488 -13.768   0.303
    3    HB3  PRO 766           HB3      PRO 766  33.412 -14.048   2.039
    4    HG2  PRO 766           HG2      PRO 766  35.522 -14.716   0.119
    5    HG3  PRO 766           HG3      PRO 766  35.621 -14.516   1.872
    6    HD2  PRO 766           HD2      PRO 766  35.712 -16.926   0.502
    7    HD3  PRO 766           HD3      PRO 766  35.346 -16.755   2.223

  No H/Q in entry =           7
  In of MODEL   42
    1    H    ALA 767           H        ALA 767  33.599 -15.447  -1.688
    2    HA   ALA 767           HA       ALA 767  30.819 -14.853  -2.475
    3    HB3  ALA 767           HB1      ALA 767  31.485 -13.096  -3.896
    4    HB2  ALA 767           HB2      ALA 767  33.193 -13.456  -3.644
    5    HB1  ALA 767           HB3      ALA 767  32.221 -12.818  -2.315

  No H/Q in entry =           5
  In of MODEL   42
    1    H    SER 768           H        SER 768  30.165 -16.577  -3.274
    2    HA   SER 768           HA       SER 768  31.306 -17.285  -5.883
    3    HB2  SER 768           HB2      SER 768  29.776 -19.075  -3.981
    4    HB3  SER 768           HB3      SER 768  30.440 -19.513  -5.552
    5    HG   SER 768           HG       SER 768  31.793 -18.842  -3.184

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA 769           H        ALA 769  28.995 -15.522  -4.539
    2    HA   ALA 769           HA       ALA 769  27.149 -15.748  -6.701
    3    HB3  ALA 769           HB1      ALA 769  26.207 -16.370  -3.888
    4    HB2  ALA 769           HB2      ALA 769  26.304 -17.529  -5.213
    5    HB1  ALA 769           HB3      ALA 769  25.178 -16.176  -5.306

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLU 770           H        GLU 770  25.148 -14.213  -5.910
    2    HA   GLU 770           HA       GLU 770  26.183 -11.613  -5.824
    3    HB2  GLU 770           HB2      GLU 770  23.849 -10.915  -5.594
    4    HB3  GLU 770           HB3      GLU 770  24.051 -12.142  -6.840
    5    HG2  GLU 770           HG2      GLU 770  23.293 -13.845  -5.273
    6    HG3  GLU 770           HG3      GLU 770  23.086 -12.617  -4.042

  No H/Q in entry =           6
  In of MODEL   42
    1    H    LYS 771           H        LYS 771  25.759  -9.943  -4.266
    2    HA   LYS 771           HA       LYS 771  25.571 -10.789  -1.464
    3    HB2  LYS 771           HB2      LYS 771  27.828  -9.053  -2.553
    4    HB3  LYS 771           HB3      LYS 771  27.530  -9.426  -0.867
    5    HG2  LYS 771           HG2      LYS 771  28.169 -11.482  -2.966
    6    HG3  LYS 771           HG3      LYS 771  29.345 -10.770  -1.861
    7    HD2  LYS 771           HD2      LYS 771  28.349 -11.769   0.018
    8    HD3  LYS 771           HD3      LYS 771  26.861 -12.131  -0.848
    9    HE2  LYS 771           HE2      LYS 771  27.913 -13.745  -2.167
   10    HE3  LYS 771           HE3      LYS 771  29.520 -13.359  -1.531
   11    HZ2  LYS 771           HZ1      LYS 771  27.236 -14.534  -0.015
   12    HZ1  LYS 771           HZ2      LYS 771  28.715 -14.093   0.664
   13    HZ3  LYS 771           HZ3      LYS 771  28.662 -15.329  -0.474

  No H/Q in entry =          13
  In of MODEL   42
    1    H    ALA 772           H        ALA 772  25.580  -8.725  -0.075
    2    HA   ALA 772           HA       ALA 772  23.975  -6.684  -1.425
    3    HB1  ALA 772           HB1      ALA 772  23.004  -6.227   0.801
    4    HB3  ALA 772           HB2      ALA 772  23.983  -7.532   1.477
    5    HB2  ALA 772           HB3      ALA 772  22.727  -7.895   0.296

  No H/Q in entry =           5
  In of MODEL   42
    1    H    CYS 773           H        CYS 773  24.453  -4.471  -0.822
    2    HA   CYS 773           HA       CYS 773  27.137  -3.865  -0.796
    3    HB2  CYS 773           HB2      CYS 773  24.826  -2.133   0.070
    4    HB3  CYS 773           HB3      CYS 773  26.449  -1.541  -0.284

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLY 774           H        GLY 774  28.662  -3.472   0.636
    2    HA3  GLY 774           HA2      GLY 774  29.246  -2.851   2.959
    3    HA2  GLY 774           HA3      GLY 774  28.038  -4.043   3.456

  No H/Q in entry =           3
  In of MODEL   42
    1    H    ALA 775           H        ALA 775  28.699  -5.671   1.139
    2    HA   ALA 775           HA       ALA 775  31.412  -6.585   1.613
    3    HB1  ALA 775           HB1      ALA 775  30.580  -8.934   1.509
    4    HB2  ALA 775           HB2      ALA 775  28.926  -8.329   1.556
    5    HB3  ALA 775           HB3      ALA 775  29.992  -8.089   2.941

  No H/Q in entry =           5
  In of MODEL   42
    1    H    CYS 776           H        CYS 776  32.184  -6.069  -0.352
    2    HA   CYS 776           HA       CYS 776  30.518  -6.729  -2.656
    3    HB2  CYS 776           HB2      CYS 776  32.061  -4.153  -2.340
    4    HB3  CYS 776           HB3      CYS 776  31.004  -4.634  -3.673

  No H/Q in entry =           4
  In of MODEL   42
    1    HA   PRO 777           HA       PRO 777  34.583  -8.264  -3.830
    2    HB2  PRO 777           HB2      PRO 777  33.743 -10.023  -5.666
    3    HB3  PRO 777           HB3      PRO 777  33.540 -10.336  -3.940
    4    HG2  PRO 777           HG2      PRO 777  31.536  -9.440  -5.951
    5    HG3  PRO 777           HG3      PRO 777  31.330 -10.539  -4.578
    6    HD2  PRO 777           HD2      PRO 777  30.626  -7.836  -4.619
    7    HD3  PRO 777           HD3      PRO 777  30.835  -8.830  -3.164

  No H/Q in entry =           7
  In of MODEL   42
    1    H    LEU 778           H        LEU 778  35.417  -8.706  -6.299
    2    HA   LEU 778           HA       LEU 778  35.398  -6.079  -7.485
    3    HB2  LEU 778           HB2      LEU 778  36.487  -8.486  -8.907
    4    HB3  LEU 778           HB3      LEU 778  37.071  -6.844  -8.933
    5    HG   LEU 778           HG       LEU 778  37.432  -8.883  -6.761
    6   HD12  LEU 778          HD11      LEU 778  39.411  -7.517  -8.553
    7   HD11  LEU 778          HD12      LEU 778  38.888  -9.201  -8.627
    8   HD13  LEU 778          HD13      LEU 778  39.803  -8.623  -7.233
    9   HD23  LEU 778          HD21      LEU 778  38.757  -7.237  -5.571
   10   HD22  LEU 778          HD22      LEU 778  37.064  -6.776  -5.694
   11   HD21  LEU 778          HD23      LEU 778  38.275  -5.984  -6.730

  No H/Q in entry =          11
  In of MODEL   42
    1    H    TRP 779           H        TRP 779  34.486  -9.242  -8.544
    2    HA   TRP 779           HA       TRP 779  33.287  -8.626 -11.020
    3    HB2  TRP 779           HB2      TRP 779  32.494 -11.067 -10.689
    4    HB3  TRP 779           HB3      TRP 779  34.226 -10.759 -10.801
    5    HD1  TRP 779           HD1      TRP 779  31.547 -11.873  -8.315
    6    HE1  TRP 779           HE1      TRP 779  32.686 -12.746  -6.178
    7    HE3  TRP 779           HE3      TRP 779  36.379 -10.608  -9.372
    8    HZ2  TRP 779           HZ2      TRP 779  35.314 -12.837  -5.068
    9    HZ3  TRP 779           HZ3      TRP 779  38.124 -11.123  -7.729
   10    HH2  TRP 779           HH2      TRP 779  37.592 -12.218  -5.632

  No H/Q in entry =          10
  In of MODEL   42
    1    H    GLY 780           H        GLY 780  32.179  -8.308  -7.876
    2    HA3  GLY 780           HA2      GLY 780  29.370  -8.435  -8.721
    3    HA2  GLY 780           HA3      GLY 780  29.904  -8.742  -7.070

  No H/Q in entry =           3
  In of MODEL   42
    1    H    LYS 781           H        LYS 781  28.609  -6.500  -9.054
    2    HA   LYS 781           HA       LYS 781  29.531  -4.299  -7.312
    3    HB2  LYS 781           HB2      LYS 781  28.988  -4.211 -10.279
    4    HB3  LYS 781           HB3      LYS 781  29.196  -2.784  -9.285
    5    HG2  LYS 781           HG2      LYS 781  31.322  -4.819  -9.238
    6    HG3  LYS 781           HG3      LYS 781  31.167  -3.850 -10.714
    7    HD2  LYS 781           HD2      LYS 781  32.801  -2.788  -9.308
    8    HD3  LYS 781           HD3      LYS 781  31.349  -1.806  -9.232
    9    HE2  LYS 781           HE2      LYS 781  32.388  -2.029  -7.048
   10    HE3  LYS 781           HE3      LYS 781  30.808  -2.807  -7.044
   11    HZ1  LYS 781           HZ1      LYS 781  33.379  -4.223  -7.423
   12    HZ3  LYS 781           HZ2      LYS 781  31.883  -4.967  -7.114
   13    HZ2  LYS 781           HZ3      LYS 781  32.639  -4.040  -5.954

  No H/Q in entry =          13
  In of MODEL   42
    1    H    CYS 782           H        CYS 782  27.974  -2.702  -6.899
    2    HA   CYS 782           HA       CYS 782  25.240  -3.636  -7.224
    3    HB2  CYS 782           HB2      CYS 782  25.951  -2.629  -5.016
    4    HB3  CYS 782           HB3      CYS 782  26.248  -1.112  -5.857

  No H/Q in entry =           4
  In of MODEL   42
    1    H    ASP 783           H        ASP 783  25.117  -3.514  -9.326
    2    HA   ASP 783           HA       ASP 783  25.402  -0.897 -10.671
    3    HB2  ASP 783           HB2      ASP 783  27.145  -2.622 -11.162
    4    HB3  ASP 783           HB3      ASP 783  25.866  -3.697 -11.690

  No H/Q in entry =           4
  In of MODEL   42
    1    H    ALA 784           H        ALA 784  23.212  -2.781  -9.409
    2    HA   ALA 784           HA       ALA 784  21.318  -2.535 -11.595
    3    HB2  ALA 784           HB1      ALA 784  20.520  -4.810 -11.280
    4    HB3  ALA 784           HB2      ALA 784  21.749  -5.083 -10.047
    5    HB1  ALA 784           HB3      ALA 784  22.227  -4.806 -11.724

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLU 785           H        GLU 785  19.189  -3.633 -10.541
    2    HA   GLU 785           HA       GLU 785  18.073  -1.740  -8.885
    3    HB2  GLU 785           HB2      GLU 785  17.226  -4.568  -9.426
    4    HB3  GLU 785           HB3      GLU 785  16.208  -3.354  -8.660
    5    HG2  GLU 785           HG2      GLU 785  16.226  -1.998 -10.622
    6    HG3  GLU 785           HG3      GLU 785  17.440  -3.022 -11.375

  No H/Q in entry =           6
  In of MODEL   42
    1    H    SER 786           H        SER 786  17.681  -1.485  -6.806
    2    HA   SER 786           HA       SER 786  17.775  -1.585  -4.604
    3    HB2  SER 786           HB2      SER 786  16.692  -3.827  -4.808
    4    HB3  SER 786           HB3      SER 786  18.280  -4.577  -4.921
    5    HG   SER 786           HG       SER 786  17.842  -4.775  -2.857

  No H/Q in entry =           5
  In of MODEL   42
    1    H    SER 787           H        SER 787  19.402  -2.374  -2.749
    2    HA   SER 787           HA       SER 787  21.986  -1.651  -3.834
    3    HB2  SER 787           HB2      SER 787  21.045  -1.620  -0.957
    4    HB3  SER 787           HB3      SER 787  22.610  -1.039  -1.541
    5    HG   SER 787           HG       SER 787  20.065   0.035  -1.826

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LYS 788           H        LYS 788  22.116  -3.732  -4.746
    2    HA   LYS 788           HA       LYS 788  23.425  -5.523  -2.905
    3    HB2  LYS 788           HB2      LYS 788  22.391  -7.500  -3.888
    4    HB3  LYS 788           HB3      LYS 788  21.158  -6.466  -3.189
    5    HG2  LYS 788           HG2      LYS 788  20.454  -5.735  -5.362
    6    HG3  LYS 788           HG3      LYS 788  21.822  -6.552  -6.129
    7    HD2  LYS 788           HD2      LYS 788  20.946  -8.713  -5.318
    8    HD3  LYS 788           HD3      LYS 788  19.563  -7.868  -4.624
    9    HE2  LYS 788           HE2      LYS 788  20.276  -7.863  -7.557
   10    HE3  LYS 788           HE3      LYS 788  19.114  -8.958  -6.823
   11    HZ1  LYS 788           HZ1      LYS 788  17.818  -7.038  -6.146
   12    HZ3  LYS 788           HZ2      LYS 788  17.983  -7.104  -7.812
   13    HZ2  LYS 788           HZ3      LYS 788  18.885  -5.984  -6.924

  No H/Q in entry =          13
  In of MODEL   42
    1    H    CYS 789           H        CYS 789  24.821  -6.976  -4.027
    2    HA   CYS 789           HA       CYS 789  25.896  -5.664  -6.385
    3    HB2  CYS 789           HB2      CYS 789  27.155  -7.602  -4.441
    4    HB3  CYS 789           HB3      CYS 789  27.965  -6.867  -5.825

  No H/Q in entry =           4
  In of MODEL   42
    1    H    VAL 790           H        VAL 790  25.649  -6.596  -8.185
    2    HA   VAL 790           HA       VAL 790  24.656  -9.339  -8.276
    3    HB   VAL 790           HB       VAL 790  23.813  -8.755 -10.527
    4   HG12  VAL 790          HG11      VAL 790  22.961  -6.804  -8.394
    5   HG11  VAL 790          HG12      VAL 790  22.352  -8.443  -8.607
    6   HG13  VAL 790          HG13      VAL 790  22.035  -7.216  -9.837
    7   HG22  VAL 790          HG21      VAL 790  25.481  -7.069 -11.148
    8   HG21  VAL 790          HG22      VAL 790  24.841  -5.971  -9.923
    9   HG23  VAL 790          HG23      VAL 790  23.848  -6.418 -11.311

  No H/Q in entry =           9
  In of MODEL   42
    1    H    CYS 791           H        CYS 791  25.345 -10.256 -10.592
    2    HA   CYS 791           HA       CYS 791  28.245 -10.197 -10.378
    3    HB2  CYS 791           HB2      CYS 791  26.471 -12.141 -11.880
    4    HB3  CYS 791           HB3      CYS 791  28.181 -12.325 -11.492

  No H/Q in entry =           4
  In of MODEL   42
    1    H    ARG 792           H        ARG 792  29.372  -9.206 -11.867
    2    HA   ARG 792           HA       ARG 792  28.007  -8.288 -14.306
    3    HB2  ARG 792           HB2      ARG 792  30.484  -7.291 -12.893
    4    HB3  ARG 792           HB3      ARG 792  29.859  -6.633 -14.406
    5    HG2  ARG 792           HG2      ARG 792  28.275  -6.671 -11.837
    6    HG3  ARG 792           HG3      ARG 792  29.325  -5.337 -12.297
    7    HD2  ARG 792           HD2      ARG 792  26.974  -4.880 -12.851
    8    HD3  ARG 792           HD3      ARG 792  27.974  -4.929 -14.289
    9    HE   ARG 792           HE       ARG 792  26.751  -7.444 -13.805
   10   HH11  ARG 792          HH11      ARG 792  25.677  -4.176 -14.744
   11   HH12  ARG 792          HH12      ARG 792  24.737  -4.729 -16.040
   12   HH21  ARG 792          HH21      ARG 792  25.451  -8.185 -15.649
   13   HH22  ARG 792          HH22      ARG 792  24.595  -7.039 -16.560

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLU 793           H        GLU 793  29.491  -8.045 -16.141
    2    HA   GLU 793           HA       GLU 793  30.254 -10.715 -16.647
    3    HB2  GLU 793           HB2      GLU 793  30.399  -8.277 -18.400
    4    HB3  GLU 793           HB3      GLU 793  30.829  -9.895 -18.918
    5    HG2  GLU 793           HG2      GLU 793  28.600  -9.501 -19.695
    6    HG3  GLU 793           HG3      GLU 793  28.538 -10.628 -18.341

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ALA 794           H        ALA 794  32.233 -11.336 -17.576
    2    HA   ALA 794           HA       ALA 794  34.223 -11.250 -15.673
    3    HB3  ALA 794           HB1      ALA 794  35.457 -12.577 -17.291
    4    HB1  ALA 794           HB2      ALA 794  34.341 -12.077 -18.556
    5    HB2  ALA 794           HB3      ALA 794  33.768 -13.079 -17.223

  No H/Q in entry =           5
  In of MODEL   42
    1    H    SER 795           H        SER 795  34.077  -9.480 -18.727
    2    HA   SER 795           HA       SER 795  36.540  -8.388 -17.787
    3    HB2  SER 795           HB2      SER 795  35.530  -8.413 -20.628
    4    HB3  SER 795           HB3      SER 795  37.104  -7.803 -20.102
    5    HG   SER 795           HG       SER 795  37.440  -9.965 -19.204

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLU 796           H        GLU 796  33.523  -7.646 -17.499
    2    HA   GLU 796           HA       GLU 796  33.636  -4.846 -18.324
    3    HB2  GLU 796           HB2      GLU 796  31.377  -6.432 -17.092
    4    HB3  GLU 796           HB3      GLU 796  31.278  -4.748 -17.581
    5    HG2  GLU 796           HG2      GLU 796  31.771  -7.091 -19.401
    6    HG3  GLU 796           HG3      GLU 796  30.254  -6.200 -19.236

  No H/Q in entry =           6
  In of MODEL   42
    1    H    CYS 797           H        CYS 797  33.641  -6.919 -15.513
    2    HA   CYS 797           HA       CYS 797  33.704  -4.718 -13.720
    3    HB2  CYS 797           HB2      CYS 797  34.504  -6.586 -12.079
    4    HB3  CYS 797           HB3      CYS 797  32.875  -6.707 -12.739

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLU 798           H        GLU 798  35.327  -3.401 -13.497
    2    HA   GLU 798           HA       GLU 798  37.735  -4.193 -14.822
    3    HB2  GLU 798           HB2      GLU 798  38.192  -1.742 -15.112
    4    HB3  GLU 798           HB3      GLU 798  36.842  -2.420 -16.005
    5    HG2  GLU 798           HG2      GLU 798  35.347  -1.541 -14.190
    6    HG3  GLU 798           HG3      GLU 798  36.752  -0.684 -13.560

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU 799           H        GLU 799  38.161  -5.254 -12.983
    2    HA   GLU 799           HA       GLU 799  40.378  -3.841 -11.808
    3    HB2  GLU 799           HB2      GLU 799  38.692  -3.782  -9.979
    4    HB3  GLU 799           HB3      GLU 799  38.502  -5.525 -10.098
    5    HG2  GLU 799           HG2      GLU 799  39.927  -4.749  -8.178
    6    HG3  GLU 799           HG3      GLU 799  40.698  -5.912  -9.254

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLU 800           H        GLU 800  42.116  -5.150 -11.541
    2    HA   GLU 800           HA       GLU 800  42.127  -7.360 -13.408
    3    HB2  GLU 800           HB2      GLU 800  44.324  -6.352 -11.625
    4    HB3  GLU 800           HB3      GLU 800  44.491  -7.395 -13.022
    5    HG2  GLU 800           HG2      GLU 800  43.820  -5.564 -14.476
    6    HG3  GLU 800           HG3      GLU 800  43.606  -4.527 -13.059

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLY 801           H        GLY 801  42.907  -6.776 -10.023
    2    HA3  GLY 801           HA2      GLY 801  43.147  -8.189  -8.236
    3    HA2  GLY 801           HA3      GLY 801  42.202  -9.387  -9.132

  No H/Q in entry =           3
  In of MODEL   42
    1    H    PHE 802           H        PHE 802  43.376 -11.198  -9.270
    2    HA   PHE 802           HA       PHE 802  46.127 -10.892 -10.127
    3    HB2  PHE 802           HB2      PHE 802  44.743 -12.968  -8.488
    4    HB3  PHE 802           HB3      PHE 802  46.136 -13.433  -9.456
    5    HD1  PHE 802           HD1      PHE 802  47.663 -13.931  -7.743
    6    HD2  PHE 802           HD2      PHE 802  45.682 -10.175  -7.747
    7    HE1  PHE 802           HE1      PHE 802  49.174 -13.148  -6.039
    8    HE2  PHE 802           HE2      PHE 802  47.196  -9.368  -6.043
    9    HZ   PHE 802           HZ       PHE 802  48.971 -10.844  -5.158

  No H/Q in entry =           9
  In of MODEL   42
    1    H    SER 803           H        SER 803  46.870 -12.765 -11.489
    2    HA   SER 803           HA       SER 803  44.862 -13.386 -13.467
    3    HB2  SER 803           HB2      SER 803  47.106 -13.734 -14.830
    4    HB3  SER 803           HB3      SER 803  46.420 -12.121 -14.611
    5    HG   SER 803           HG       SER 803  48.807 -12.966 -13.904

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ILE 804           H        ILE 804  44.150 -15.251 -12.893
    2    HA   ILE 804           HA       ILE 804  45.987 -17.255 -11.823
    3    HB   ILE 804           HB       ILE 804  44.163 -18.280 -10.630
    4   HG12  ILE 804          HG12      ILE 804  42.311 -17.952 -12.298
    5   HG13  ILE 804          HG13      ILE 804  41.843 -17.533 -10.656
    6   HG21  ILE 804          HG21      ILE 804  45.167 -16.376  -9.517
    7   HG23  ILE 804          HG22      ILE 804  43.438 -16.451  -9.134
    8   HG22  ILE 804          HG23      ILE 804  44.019 -15.291 -10.308
    9   HD12  ILE 804          HD11      ILE 804  42.404 -15.666 -12.947
   10   HD11  ILE 804          HD12      ILE 804  42.207 -15.140 -11.278
   11   HD13  ILE 804          HD13      ILE 804  40.879 -15.945 -12.105

  No H/Q in entry =          11
  In of MODEL   42
    1    H    CYS 805           H        CYS 805  45.270 -19.597 -12.282
    2    HA   CYS 805           HA       CYS 805  44.667 -19.757 -15.142
    3    HB2  CYS 805           HB2      CYS 805  46.886 -20.598 -14.512
    4    HB3  CYS 805           HB3      CYS 805  46.144 -21.712 -13.367

  No H/Q in entry =           4
  In of MODEL   42
    1    H    VAL 806           H        VAL 806  42.721 -20.589 -15.611
    2    HA   VAL 806           HA       VAL 806  41.555 -22.435 -13.648
    3    HB   VAL 806           HB       VAL 806  40.084 -20.252 -15.127
    4   HG13  VAL 806          HG11      VAL 806  38.655 -22.158 -14.912
    5   HG12  VAL 806          HG12      VAL 806  38.151 -20.913 -13.758
    6   HG11  VAL 806          HG13      VAL 806  39.051 -22.326 -13.204
    7   HG23  VAL 806          HG21      VAL 806  40.648 -20.542 -12.183
    8   HG22  VAL 806          HG22      VAL 806  39.674 -19.270 -12.931
    9   HG21  VAL 806          HG23      VAL 806  41.399 -19.404 -13.297

  No H/Q in entry =           9
  In of MODEL   42
    1    H    GLU 807           H        GLU 807  40.701 -24.267 -14.446
    2    HA   GLU 807           HA       GLU 807  40.850 -24.681 -17.270
    3    HB2  GLU 807           HB2      GLU 807  41.558 -26.491 -15.726
    4    HB3  GLU 807           HB3      GLU 807  39.930 -26.562 -15.071
    5    HG2  GLU 807           HG2      GLU 807  39.062 -27.263 -17.243
    6    HG3  GLU 807           HG3      GLU 807  40.684 -27.101 -17.920

  No H/Q in entry =           6
  In of MODEL   42
    1    H    VAL 808           H        VAL 808  39.333 -24.263 -18.503
    2    HA   VAL 808           HA       VAL 808  36.561 -24.338 -17.665
    3    HB   VAL 808           HB       VAL 808  37.201 -22.016 -17.305
    4   HG11  VAL 808          HG11      VAL 808  38.190 -21.997 -20.147
    5   HG13  VAL 808          HG12      VAL 808  39.173 -21.868 -18.688
    6   HG12  VAL 808          HG13      VAL 808  38.044 -20.577 -19.111
    7   HG22  VAL 808          HG21      VAL 808  35.672 -20.859 -18.822
    8   HG21  VAL 808          HG22      VAL 808  34.977 -22.367 -18.214
    9   HG23  VAL 808          HG23      VAL 808  35.632 -22.287 -19.855

  No H/Q in entry =           9
  In of MODEL   42
    1    H    ASN 809           H        ASN 809  35.374 -25.298 -19.119
    2    HA   ASN 809           HA       ASN 809  34.593 -26.111 -21.083
    3    HB2  ASN 809           HB2      ASN 809  36.417 -23.985 -22.028
    4    HB3  ASN 809           HB3      ASN 809  35.772 -25.098 -23.248
    5   HD21  ASN 809          HD21      ASN 809  34.034 -23.973 -20.366
    6   HD22  ASN 809          HD22      ASN 809  32.890 -23.023 -21.211

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLY 810           H        GLY 810  37.463 -26.726 -19.856
    2    HA3  GLY 810           HA2      GLY 810  38.281 -28.994 -20.149
    3    HA2  GLY 810           HA3      GLY 810  38.102 -28.711 -21.906

  No H/Q in entry =           3
  In of MODEL   42
    1    H    LYS 811           H        LYS 811  39.050 -25.922 -21.306
    2    HA   LYS 811           HA       LYS 811  41.883 -26.526 -21.734
    3    HB2  LYS 811           HB2      LYS 811  40.215 -24.087 -22.192
    4    HB3  LYS 811           HB3      LYS 811  41.951 -24.183 -22.429
    5    HG2  LYS 811           HG2      LYS 811  41.671 -25.767 -24.201
    6    HG3  LYS 811           HG3      LYS 811  39.932 -25.860 -23.884
    7    HD2  LYS 811           HD2      LYS 811  40.442 -24.398 -25.778
    8    HD3  LYS 811           HD3      LYS 811  39.650 -23.564 -24.442
    9    HE2  LYS 811           HE2      LYS 811  41.478 -22.119 -25.232
   10    HE3  LYS 811           HE3      LYS 811  41.874 -22.735 -23.673
   11    HZ3  LYS 811           HZ1      LYS 811  43.356 -24.340 -24.621
   12    HZ2  LYS 811           HZ2      LYS 811  43.748 -22.837 -25.233
   13    HZ1  LYS 811           HZ3      LYS 811  42.885 -23.935 -26.184

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLU 812           H        GLU 812  43.233 -24.537 -21.001
    2    HA   GLU 812           HA       GLU 812  42.429 -23.717 -18.306
    3    HB2  GLU 812           HB2      GLU 812  45.178 -24.694 -19.121
    4    HB3  GLU 812           HB3      GLU 812  44.892 -23.754 -17.668
    5    HG2  GLU 812           HG2      GLU 812  43.385 -25.540 -16.864
    6    HG3  GLU 812           HG3      GLU 812  43.797 -26.483 -18.295

  No H/Q in entry =           6
  In of MODEL   42
    1    H    GLN 813           H        GLN 813  42.050 -21.692 -18.484
    2    HA   GLN 813           HA       GLN 813  43.797 -20.131 -20.245
    3    HB2  GLN 813           HB2      GLN 813  41.560 -20.199 -21.053
    4    HB3  GLN 813           HB3      GLN 813  40.898 -19.719 -19.489
    5    HG2  GLN 813           HG2      GLN 813  42.000 -17.582 -19.718
    6    HG3  GLN 813           HG3      GLN 813  42.625 -18.040 -21.309
    7   HE21  GLN 813          HE21      GLN 813  39.858 -17.001 -19.520
    8   HE22  GLN 813          HE22      GLN 813  38.796 -16.786 -20.865

  No H/Q in entry =           8
  In of MODEL   42
    1    H    THR 814           H        THR 814  44.796 -18.438 -19.464
    2    HA   THR 814           HA       THR 814  44.787 -17.868 -16.639
    3    HB   THR 814           HB       THR 814  45.916 -16.198 -18.821
    4    HG1  THR 814           HG1      THR 814  47.922 -17.499 -18.295
    5   HG23  THR 814          HG21      THR 814  47.608 -15.594 -17.112
    6   HG22  THR 814          HG22      THR 814  46.792 -16.666 -15.970
    7   HG21  THR 814          HG23      THR 814  45.956 -15.244 -16.595

  No H/Q in entry =           7
  In of MODEL   42
    1    H    MET 815           H        MET 815  43.349 -16.567 -15.855
    2    HA   MET 815           HA       MET 815  42.192 -14.593 -17.622
    3    HB2  MET 815           HB2      MET 815  39.979 -15.062 -16.503
    4    HB3  MET 815           HB3      MET 815  40.555 -16.291 -17.617
    5    HG2  MET 815           HG2      MET 815  41.441 -17.542 -15.752
    6    HG3  MET 815           HG3      MET 815  40.751 -16.396 -14.613
    7    HE2  MET 815           HE1      MET 815  38.381 -19.294 -17.292
    8    HE1  MET 815           HE2      MET 815  40.140 -19.242 -17.098
    9    HE3  MET 815           HE3      MET 815  39.307 -17.946 -17.962

  No H/Q in entry =           9
  In of MODEL   42
    1    H    SER 816           H        SER 816  40.980 -12.999 -16.335
    2    HA   SER 816           HA       SER 816  42.725 -12.087 -14.240
    3    HB2  SER 816           HB2      SER 816  40.207 -10.966 -15.409
    4    HB3  SER 816           HB3      SER 816  41.375 -10.060 -14.423
    5    HG   SER 816           HG       SER 816  41.512 -10.991 -17.056

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLU 817           H        GLU 817  41.771 -11.364 -12.226
    2    HA   GLU 817           HA       GLU 817  40.430 -13.398 -10.893
    3    HB2  GLU 817           HB2      GLU 817  41.959 -11.448 -10.166
    4    HB3  GLU 817           HB3      GLU 817  40.437 -10.588  -9.976
    5    HG2  GLU 817           HG2      GLU 817  40.710 -11.457  -7.916
    6    HG3  GLU 817           HG3      GLU 817  39.728 -12.672  -8.723

  No H/Q in entry =           6
  In of MODEL   42
    1    H    CYS 818           H        CYS 818  39.389 -10.483 -12.446
    2    HA   CYS 818           HA       CYS 818  36.810 -10.254 -11.248
    3    HB2  CYS 818           HB2      CYS 818  36.424  -8.679 -13.196
    4    HB3  CYS 818           HB3      CYS 818  37.816  -8.294 -12.193

  No H/Q in entry =           4
  In of MODEL   42
    1    H    GLU 819           H        GLU 819  38.114 -11.459 -14.164
    2    HA   GLU 819           HA       GLU 819  35.910 -12.386 -15.496
    3    HB2  GLU 819           HB2      GLU 819  38.729 -12.596 -15.436
    4    HB3  GLU 819           HB3      GLU 819  38.102 -13.968 -16.270
    5    HG2  GLU 819           HG2      GLU 819  37.295 -12.594 -17.997
    6    HG3  GLU 819           HG3      GLU 819  37.246 -11.165 -16.960

  No H/Q in entry =           6
  In of MODEL   42
    1    H    ALA 820           H        ALA 820  38.262 -14.284 -13.618
    2    HA   ALA 820           HA       ALA 820  36.803 -16.685 -13.673
    3    HB3  ALA 820           HB1      ALA 820  38.816 -15.774 -11.634
    4    HB1  ALA 820           HB2      ALA 820  39.168 -16.610 -13.153
    5    HB2  ALA 820           HB3      ALA 820  38.273 -17.435 -11.878

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLY 821           H        GLY 821  36.828 -14.062 -11.301
    2    HA3  GLY 821           HA2      GLY 821  35.237 -15.345  -9.373
    3    HA2  GLY 821           HA3      GLY 821  35.438 -13.596  -9.535

  No H/Q in entry =           3
  In of MODEL   42
    1    H    ALA 822           H        ALA 822  34.334 -13.211 -12.031
    2    HA   ALA 822           HA       ALA 822  31.595 -13.218 -11.419
    3    HB1  ALA 822           HB1      ALA 822  32.914 -12.817 -14.101
    4    HB3  ALA 822           HB2      ALA 822  32.613 -11.569 -12.882
    5    HB2  ALA 822           HB3      ALA 822  31.255 -12.395 -13.648

  No H/Q in entry =           5
  In of MODEL   42
    1    H    LEU 823           H        LEU 823  33.617 -15.277 -13.391
    2    HA   LEU 823           HA       LEU 823  31.570 -16.828 -14.470
    3    HB2  LEU 823           HB2      LEU 823  34.430 -17.572 -13.879
    4    HB3  LEU 823           HB3      LEU 823  33.324 -18.578 -14.798
    5    HG   LEU 823           HG       LEU 823  34.160 -15.789 -15.579
    6   HD13  LEU 823          HD11      LEU 823  36.041 -17.288 -15.740
    7   HD12  LEU 823          HD12      LEU 823  35.465 -16.842 -17.334
    8   HD11  LEU 823          HD13      LEU 823  35.081 -18.440 -16.675
    9   HD21  LEU 823          HD21      LEU 823  32.526 -17.873 -17.032
   10   HD23  LEU 823          HD22      LEU 823  33.118 -16.372 -17.743
   11   HD22  LEU 823          HD23      LEU 823  31.954 -16.323 -16.422

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ARG 824           H        ARG 824  33.352 -17.202 -11.426
    2    HA   ARG 824           HA       ARG 824  32.022 -19.610 -10.656
    3    HB2  ARG 824           HB2      ARG 824  32.902 -17.475  -8.702
    4    HB3  ARG 824           HB3      ARG 824  32.668 -19.174  -8.353
    5    HG2  ARG 824           HG2      ARG 824  34.676 -19.532  -9.953
    6    HG3  ARG 824           HG3      ARG 824  34.937 -17.801  -9.746
    7    HD2  ARG 824           HD2      ARG 824  34.975 -19.964  -7.653
    8    HD3  ARG 824           HD3      ARG 824  36.295 -18.921  -8.155
    9    HE   ARG 824           HE       ARG 824  34.126 -17.418  -7.080
   10   HH11  ARG 824          HH11      ARG 824  36.989 -19.296  -6.116
   11   HH12  ARG 824          HH12      ARG 824  37.044 -18.628  -4.543
   12   HH21  ARG 824          HH21      ARG 824  34.195 -16.591  -4.880
   13   HH22  ARG 824          HH22      ARG 824  35.361 -17.090  -3.796

  No H/Q in entry =          13
  In of MODEL   42
    1    H    CYS 825           H        CYS 825  31.380 -16.217 -10.053
    2    HA   CYS 825           HA       CYS 825  29.127 -16.551  -8.461
    3    HB2  CYS 825           HB2      CYS 825  30.270 -14.296  -9.996
    4    HB3  CYS 825           HB3      CYS 825  28.740 -14.051  -9.190

  No H/Q in entry =           4
  In of MODEL   42
    1    H    ARG 826           H        ARG 826  29.291 -16.221 -12.003
    2    HA   ARG 826           HA       ARG 826  26.446 -16.038 -12.190
    3    HB2  ARG 826           HB2      ARG 826  26.703 -16.266 -14.588
    4    HB3  ARG 826           HB3      ARG 826  27.841 -15.078 -13.952
    5    HG2  ARG 826           HG2      ARG 826  29.634 -16.622 -14.197
    6    HG3  ARG 826           HG3      ARG 826  28.520 -17.917 -14.646
    7    HD2  ARG 826           HD2      ARG 826  28.982 -15.365 -16.194
    8    HD3  ARG 826           HD3      ARG 826  29.592 -16.966 -16.628
    9    HE   ARG 826           HE       ARG 826  26.865 -17.210 -16.327
   10   HH11  ARG 826          HH11      ARG 826  29.095 -15.650 -18.595
   11   HH12  ARG 826          HH12      ARG 826  27.905 -15.442 -19.792
   12   HH21  ARG 826          HH21      ARG 826  25.275 -16.924 -18.035
   13   HH22  ARG 826          HH22      ARG 826  25.745 -16.164 -19.486

  No H/Q in entry =          13
  In of MODEL   42
    1    H    GLY 827           H        GLY 827  28.565 -18.623 -11.764
    2    HA3  GLY 827           HA2      GLY 827  27.725 -20.771 -11.223
    3    HA2  GLY 827           HA3      GLY 827  26.318 -20.437 -12.227

  No H/Q in entry =           3
  In of MODEL   42
    1    H    GLN 828           H        GLN 828  29.193 -19.456 -13.673
    2    HA   GLN 828           HA       GLN 828  29.101 -21.428 -15.705
    3    HB2  GLN 828           HB2      GLN 828  30.074 -19.201 -16.105
    4    HB3  GLN 828           HB3      GLN 828  31.333 -19.533 -14.925
    5    HG2  GLN 828           HG2      GLN 828  32.162 -19.777 -17.235
    6    HG3  GLN 828           HG3      GLN 828  32.218 -21.291 -16.334
    7   HE21  GLN 828          HE21      GLN 828  30.607 -19.541 -18.849
    8   HE22  GLN 828          HE22      GLN 828  29.879 -20.915 -19.584

  No H/Q in entry =           8
  In of MODEL   42
    1    H    SER 829           H        SER 829  30.509 -23.178 -15.994
    2    HA   SER 829           HA       SER 829  31.351 -24.327 -13.462
    3    HB2  SER 829           HB2      SER 829  29.982 -25.496 -15.308
    4    HB3  SER 829           HB3      SER 829  31.509 -25.600 -16.173
    5    HG   SER 829           HG       SER 829  32.296 -26.611 -14.120

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ILE 830           H        ILE 830  33.301 -23.682 -12.881
    2    HA   ILE 830           HA       ILE 830  35.339 -23.959 -14.866
    3    HB   ILE 830           HB       ILE 830  36.571 -21.973 -14.202
    4   HG12  ILE 830          HG12      ILE 830  35.750 -21.813 -11.836
    5   HG13  ILE 830          HG13      ILE 830  35.792 -20.265 -12.668
    6   HG21  ILE 830          HG21      ILE 830  33.763 -21.325 -14.961
    7   HG23  ILE 830          HG22      ILE 830  35.100 -21.700 -16.051
    8   HG22  ILE 830          HG23      ILE 830  35.118 -20.204 -15.108
    9   HD11  ILE 830          HD11      ILE 830  33.355 -21.954 -12.184
   10   HD13  ILE 830          HD12      ILE 830  33.376 -20.379 -12.974
   11   HD12  ILE 830          HD13      ILE 830  33.794 -20.514 -11.270

  No H/Q in entry =          11
  In of MODEL   42
    1    H    SER 831           H        SER 831  37.372 -24.514 -14.028
    2    HA   SER 831           HA       SER 831  37.348 -25.316 -11.223
    3    HB2  SER 831           HB2      SER 831  38.506 -26.639 -13.641
    4    HB3  SER 831           HB3      SER 831  38.765 -27.176 -11.987
    5    HG   SER 831           HG       SER 831  36.973 -28.041 -13.470

  No H/Q in entry =           5
  In of MODEL   42
    1    H    VAL 832           H        VAL 832  38.640 -23.702 -10.349
    2    HA   VAL 832           HA       VAL 832  40.889 -22.677 -11.713
    3    HB   VAL 832           HB       VAL 832  39.831 -21.308  -9.982
    4   HG13  VAL 832          HG11      VAL 832  39.040 -23.001  -8.457
    5   HG12  VAL 832          HG12      VAL 832  40.004 -21.805  -7.590
    6   HG11  VAL 832          HG13      VAL 832  40.695 -23.380  -7.977
    7   HG22  VAL 832          HG21      VAL 832  42.182 -20.867 -10.388
    8   HG21  VAL 832          HG22      VAL 832  42.639 -22.072  -9.185
    9   HG23  VAL 832          HG23      VAL 832  41.805 -20.602  -8.684

  No H/Q in entry =           9
  In of MODEL   42
    1    H    THR 833           H        THR 833  42.637 -23.775 -12.220
    2    HA   THR 833           HA       THR 833  43.217 -26.180 -10.783
    3    HB   THR 833           HB       THR 833  45.028 -26.389 -12.562
    4    HG1  THR 833           HG1      THR 833  44.695 -25.006 -14.379
    5   HG22  THR 833          HG21      THR 833  43.403 -26.969 -14.338
    6   HG21  THR 833          HG22      THR 833  42.160 -26.078 -13.471
    7   HG23  THR 833          HG23      THR 833  42.857 -27.529 -12.755

  No H/Q in entry =           7
  In of MODEL   42
    1    H    SER 834           H        SER 834  44.506 -22.976 -11.155
    2    HA   SER 834           HA       SER 834  45.932 -23.288  -8.727
    3    HB2  SER 834           HB2      SER 834  47.611 -24.219 -10.256
    4    HB3  SER 834           HB3      SER 834  47.531 -22.735 -11.232
    5    HG   SER 834           HG       SER 834  49.094 -23.221  -9.262

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ILE 835           H        ILE 835  46.658 -21.378  -7.947
    2    HA   ILE 835           HA       ILE 835  45.143 -19.052  -8.703
    3    HB   ILE 835           HB       ILE 835  46.245 -18.043  -6.756
    4   HG12  ILE 835          HG12      ILE 835  47.831 -20.638  -6.699
    5   HG13  ILE 835          HG13      ILE 835  48.407 -18.983  -6.893
    6   HG21  ILE 835          HG21      ILE 835  45.133 -20.803  -6.249
    7   HG23  ILE 835          HG22      ILE 835  44.204 -19.311  -6.395
    8   HG22  ILE 835          HG23      ILE 835  45.300 -19.542  -5.031
    9   HD11  ILE 835          HD11      ILE 835  47.766 -18.465  -4.676
   10   HD13  ILE 835          HD12      ILE 835  48.910 -19.829  -4.780
   11   HD12  ILE 835          HD13      ILE 835  47.189 -20.131  -4.465

  No H/Q in entry =          11
  In of MODEL   42
    1    H    ARG 836           H        ARG 836  47.957 -20.472  -9.726
    2    HA   ARG 836           HA       ARG 836  49.539 -18.064 -10.094
    3    HB2  ARG 836           HB2      ARG 836  50.131 -20.906 -10.929
    4    HB3  ARG 836           HB3      ARG 836  51.269 -19.570 -10.879
    5    HG2  ARG 836           HG2      ARG 836  51.019 -19.495  -8.412
    6    HG3  ARG 836           HG3      ARG 836  49.941 -20.889  -8.515
    7    HD2  ARG 836           HD2      ARG 836  51.740 -22.093  -9.678
    8    HD3  ARG 836           HD3      ARG 836  52.822 -20.746  -9.324
    9    HE   ARG 836           HE       ARG 836  51.622 -21.658  -6.949
   10   HH11  ARG 836          HH11      ARG 836  54.205 -22.437  -9.220
   11   HH12  ARG 836          HH12      ARG 836  54.988 -23.562  -8.245
   12   HH21  ARG 836          HH21      ARG 836  52.721 -23.200  -5.504
   13   HH22  ARG 836          HH22      ARG 836  54.139 -23.996  -6.032

  No H/Q in entry =          13
  In of MODEL   42
    1    HA   PRO 837           HA       PRO 837  47.944 -17.515 -14.202
    2    HB2  PRO 837           HB2      PRO 837  50.069 -16.309 -15.416
    3    HB3  PRO 837           HB3      PRO 837  48.987 -15.475 -14.298
    4    HG2  PRO 837           HG2      PRO 837  51.695 -16.650 -13.799
    5    HG3  PRO 837           HG3      PRO 837  51.012 -15.126 -13.202
    6    HD2  PRO 837           HD2      PRO 837  51.166 -17.355 -11.675
    7    HD3  PRO 837           HD3      PRO 837  49.862 -16.165 -11.501

  No H/Q in entry =           7
  In of MODEL   42
    1    H    CYS 838           H        CYS 838  47.881 -18.612 -16.119
    2    HA   CYS 838           HA       CYS 838  49.915 -20.649 -16.565
    3    HB2  CYS 838           HB2      CYS 838  47.450 -21.210 -16.702
    4    HB3  CYS 838           HB3      CYS 838  47.341 -20.109 -18.063

  No H/Q in entry =           4
  In of MODEL   42
    1    H    ALA 839           H        ALA 839  50.523 -20.892 -19.014
    2    HA   ALA 839           HA       ALA 839  51.499 -18.328 -19.922
    3    HB1  ALA 839           HB1      ALA 839  52.992 -20.276 -19.875
    4    HB3  ALA 839           HB2      ALA 839  52.811 -19.643 -21.510
    5    HB2  ALA 839           HB3      ALA 839  51.947 -21.103 -21.030

  No H/Q in entry =           5
  In of MODEL   42
    1    H    ALA 840           H        ALA 840  48.623 -19.405 -20.147
    2    HA   ALA 840           HA       ALA 840  47.880 -19.757 -22.826
    3    HB3  ALA 840           HB1      ALA 840  45.618 -19.234 -22.095
    4    HB1  ALA 840           HB2      ALA 840  46.255 -18.552 -20.598
    5    HB2  ALA 840           HB3      ALA 840  46.419 -20.274 -20.913

  No H/Q in entry =           5
  In of MODEL   42
    1    H    GLU 841           H        GLU 841  47.417 -16.895 -20.902
    2    HA   GLU 841           HA       GLU 841  47.298 -14.649 -21.320
    3    HB2  GLU 841           HB2      GLU 841  49.381 -15.372 -23.368
    4    HB3  GLU 841           HB3      GLU 841  48.956 -13.721 -22.959
    5    HG2  GLU 841           HG2      GLU 841  49.650 -14.130 -20.641
    6    HG3  GLU 841           HG3      GLU 841  50.105 -15.776 -21.086

  No H/Q in entry =           6
  In of MODEL   42
    1    H    THR 842           H        THR 842  45.644 -16.544 -23.145
    2    HA   THR 842           HA       THR 842  45.139 -14.667 -25.312
    3    HB   THR 842           HB       THR 842  43.907 -17.417 -24.957
    4    HG1  THR 842           HG1      THR 842  46.475 -16.949 -25.227
    5   HG22  THR 842          HG21      THR 842  44.461 -15.700 -27.393
    6   HG21  THR 842          HG22      THR 842  42.889 -15.894 -26.628
    7   HG23  THR 842          HG23      THR 842  43.670 -17.276 -27.400

  No H/Q in entry =           7
  In of MODEL   42
    1    H    GLN 843           H        GLN 843  43.229 -13.553 -25.420
    2    HA   GLN 843           HA       GLN 843  41.288 -14.010 -23.287
    3    HB2  GLN 843           HB2      GLN 843  42.203 -11.404 -24.542
    4    HB3  GLN 843           HB3      GLN 843  40.810 -11.544 -23.478
    5    HG2  GLN 843           HG2      GLN 843  42.232 -12.280 -21.664
    6    HG3  GLN 843           HG3      GLN 843  43.635 -12.252 -22.724
    7   HE21  GLN 843          HE21      GLN 843  43.023 -10.870 -20.249
    8   HE22  GLN 843          HE22      GLN 843  43.253  -9.184 -20.535

  No H/Q in entry =           8
  In of MODEL   43
    1    H1   GLY 689           H2       GLY 689  72.097 -20.793 -23.639
    2    H2   GLY 689           H1       GLY 689  72.409 -21.027 -21.985
    3    H3   GLY 689           H3       GLY 689  71.080 -20.111 -22.483
    4    HA2  GLY 689           HA2      GLY 689  73.909 -19.392 -22.893
    5    HA3  GLY 689           HA3      GLY 689  72.819 -18.663 -21.718

  No H/Q in entry =           5
  In of MODEL   43
    1    H    SER 690           H        SER 690  74.144 -18.304 -24.719
    2    HA   SER 690           HA       SER 690  73.831 -16.984 -26.496
    3    HB2  SER 690           HB2      SER 690  70.868 -17.457 -26.052
    4    HB3  SER 690           HB3      SER 690  71.637 -16.948 -27.552
    5    HG   SER 690           HG       SER 690  71.986 -18.949 -27.986

  No H/Q in entry =           5
  In of MODEL   43
    1    H    HIS 691           H        HIS 691  72.260 -14.951 -27.247
    2    HA   HIS 691           HA       HIS 691  72.552 -12.997 -25.142
    3    HB2  HIS 691           HB2      HIS 691  73.046 -12.541 -27.599
    4    HB3  HIS 691           HB3      HIS 691  71.325 -12.686 -27.911
    5    HD1  HIS 691           HD1      HIS 691  73.873 -10.448 -26.328
    6    HD2  HIS 691           HD2      HIS 691  69.824 -10.388 -27.243
    7    HE1  HIS 691           HE1      HIS 691  73.181  -8.076 -26.109
    8    HE2  HIS 691           HE2      HIS 691  70.878  -8.037 -27.047

  No H/Q in entry =           8
  In of MODEL   43
    1    H    MET 692           H        MET 692  71.010 -12.819 -23.677
    2    HA   MET 692           HA       MET 692  68.641 -14.364 -23.826
    3    HB2  MET 692           HB2      MET 692  69.445 -12.252 -21.828
    4    HB3  MET 692           HB3      MET 692  68.097 -13.358 -21.631
    5    HG2  MET 692           HG2      MET 692  69.633 -15.254 -21.633
    6    HG3  MET 692           HG3      MET 692  70.991 -14.162 -21.875
    7    HE3  MET 692           HE1      MET 692  71.026 -12.170 -18.476
    8    HE2  MET 692           HE2      MET 692  70.150 -11.699 -19.930
    9    HE1  MET 692           HE3      MET 692  71.783 -12.358 -20.059

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ASN 693           H        ASN 693  68.955 -10.851 -23.369
    2    HA   ASN 693           HA       ASN 693  66.772 -10.438 -25.180
    3    HB2  ASN 693           HB2      ASN 693  65.354  -9.232 -23.572
    4    HB3  ASN 693           HB3      ASN 693  65.576 -10.903 -23.088
    5   HD21  ASN 693          HD21      ASN 693  64.753  -8.645 -21.464
    6   HD22  ASN 693          HD22      ASN 693  65.923  -8.512 -20.198

  No H/Q in entry =           6
  In of MODEL   43
    1    HA   PRO 694           HA       PRO 694  69.074  -6.568 -25.462
    2    HB2  PRO 694           HB2      PRO 694  66.979  -5.494 -27.145
    3    HB3  PRO 694           HB3      PRO 694  68.585  -6.026 -27.636
    4    HG2  PRO 694           HG2      PRO 694  66.271  -7.305 -28.357
    5    HG3  PRO 694           HG3      PRO 694  67.844  -8.111 -28.234
    6    HD2  PRO 694           HD2      PRO 694  65.567  -8.083 -26.294
    7    HD3  PRO 694           HD3      PRO 694  66.648  -9.414 -26.777

  No H/Q in entry =           7
  In of MODEL   43
    1    H    LEU 695           H        LEU 695  68.928  -4.852 -24.061
    2    HA   LEU 695           HA       LEU 695  66.377  -4.483 -22.785
    3    HB2  LEU 695           HB2      LEU 695  69.030  -3.188 -22.154
    4    HB3  LEU 695           HB3      LEU 695  67.558  -3.016 -21.223
    5    HG   LEU 695           HG       LEU 695  69.091  -5.590 -21.589
    6   HD13  LEU 695          HD11      LEU 695  69.625  -5.342 -19.233
    7   HD12  LEU 695          HD12      LEU 695  68.817  -3.774 -19.209
    8   HD11  LEU 695          HD13      LEU 695  70.267  -4.004 -20.184
    9   HD23  LEU 695          HD21      LEU 695  67.570  -6.471 -19.874
   10   HD22  LEU 695          HD22      LEU 695  66.704  -6.010 -21.334
   11   HD21  LEU 695          HD23      LEU 695  66.654  -4.963 -19.914

  No H/Q in entry =          11
  In of MODEL   43
    1    H    THR 696           H        THR 696  65.134  -3.546 -24.165
    2    HA   THR 696           HA       THR 696  65.768  -0.829 -25.038
    3    HB   THR 696           HB       THR 696  65.240  -2.238 -26.937
    4    HG1  THR 696           HG1      THR 696  63.039  -0.639 -26.209
    5   HG23  THR 696          HG21      THR 696  64.131  -4.098 -25.811
    6   HG22  THR 696          HG22      THR 696  63.115  -3.515 -27.133
    7   HG21  THR 696          HG23      THR 696  62.731  -3.081 -25.467

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLN 697           H        GLN 697  65.399  -0.449 -22.695
    2    HA   GLN 697           HA       GLN 697  64.263   0.156 -20.863
    3    HB2  GLN 697           HB2      GLN 697  61.877   0.398 -22.738
    4    HB3  GLN 697           HB3      GLN 697  61.872   0.936 -21.064
    5    HG2  GLN 697           HG2      GLN 697  63.654   2.011 -23.239
    6    HG3  GLN 697           HG3      GLN 697  62.150   2.752 -22.699
    7   HE21  GLN 697          HE21      GLN 697  62.081   3.756 -20.697
    8   HE22  GLN 697          HE22      GLN 697  63.507   4.195 -19.845

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ALA 698           H        ALA 698  64.458  -1.609 -19.706
    2    HA   ALA 698           HA       ALA 698  63.535  -4.136 -20.352
    3    HB1  ALA 698           HB1      ALA 698  65.338  -3.683 -18.741
    4    HB3  ALA 698           HB2      ALA 698  64.114  -4.770 -18.082
    5    HB2  ALA 698           HB3      ALA 698  64.141  -3.078 -17.596

  No H/Q in entry =           5
  In of MODEL   43
    1    H    VAL 699           H        VAL 699  61.619  -5.000 -20.356
    2    HA   VAL 699           HA       VAL 699  59.338  -3.656 -19.279
    3    HB   VAL 699           HB       VAL 699  59.562  -6.486 -20.377
    4   HG13  VAL 699          HG11      VAL 699  57.141  -6.329 -20.749
    5   HG12  VAL 699          HG12      VAL 699  57.127  -4.737 -19.992
    6   HG11  VAL 699          HG13      VAL 699  57.544  -6.163 -19.040
    7   HG23  VAL 699          HG21      VAL 699  58.772  -3.935 -21.788
    8   HG22  VAL 699          HG22      VAL 699  58.714  -5.553 -22.487
    9   HG21  VAL 699          HG23      VAL 699  60.265  -4.841 -22.037

  No H/Q in entry =           9
  In of MODEL   43
    1    HA   PRO 700           HA       PRO 700  60.274  -5.198 -15.188
    2    HB2  PRO 700           HB2      PRO 700  57.509  -4.293 -14.654
    3    HB3  PRO 700           HB3      PRO 700  59.001  -3.901 -13.796
    4    HG2  PRO 700           HG2      PRO 700  57.878  -2.105 -15.394
    5    HG3  PRO 700           HG3      PRO 700  59.638  -2.304 -15.351
    6    HD2  PRO 700           HD2      PRO 700  57.680  -3.287 -17.392
    7    HD3  PRO 700           HD3      PRO 700  59.298  -2.581 -17.608

  No H/Q in entry =           7
  In of MODEL   43
    1    H    LYS 701           H        LYS 701  60.055  -7.084 -14.443
    2    HA   LYS 701           HA       LYS 701  57.655  -8.577 -15.057
    3    HB2  LYS 701           HB2      LYS 701  59.010 -10.679 -15.092
    4    HB3  LYS 701           HB3      LYS 701  59.383  -9.576 -16.397
    5    HG2  LYS 701           HG2      LYS 701  61.045  -9.734 -13.904
    6    HG3  LYS 701           HG3      LYS 701  61.291 -10.805 -15.286
    7    HD2  LYS 701           HD2      LYS 701  61.785  -8.904 -16.709
    8    HD3  LYS 701           HD3      LYS 701  61.396  -7.779 -15.414
    9    HE2  LYS 701           HE2      LYS 701  63.812  -8.044 -15.688
   10    HE3  LYS 701           HE3      LYS 701  63.290  -8.613 -14.108
   11    HZ1  LYS 701           HZ1      LYS 701  63.862 -10.339 -16.459
   12    HZ3  LYS 701           HZ2      LYS 701  63.410 -10.891 -14.935
   13    HZ2  LYS 701           HZ3      LYS 701  64.879 -10.119 -15.140

  No H/Q in entry =          13
  In of MODEL   43
    1    H    CYS 702           H        CYS 702  56.599  -8.165 -13.266
    2    HA   CYS 702           HA       CYS 702  57.692  -9.387 -10.852
    3    HB2  CYS 702           HB2      CYS 702  55.795  -7.010 -10.666
    4    HB3  CYS 702           HB3      CYS 702  56.816  -7.725  -9.478

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLN 703           H        GLN 703  56.275 -10.760  -9.941
    2    HA   GLN 703           HA       GLN 703  53.975 -11.503 -11.442
    3    HB2  GLN 703           HB2      GLN 703  54.815 -12.251  -8.651
    4    HB3  GLN 703           HB3      GLN 703  53.620 -13.088  -9.618
    5    HG2  GLN 703           HG2      GLN 703  56.542 -12.859 -10.311
    6    HG3  GLN 703           HG3      GLN 703  55.800 -14.235  -9.512
    7   HE21  GLN 703          HE21      GLN 703  56.370 -15.605 -11.093
    8   HE22  GLN 703          HE22      GLN 703  55.664 -15.644 -12.662

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ARG 704           H        ARG 704  51.852 -11.751 -10.093
    2    HA   ARG 704           HA       ARG 704  50.873  -9.151  -9.561
    3    HB2  ARG 704           HB2      ARG 704  49.734 -11.852  -8.979
    4    HB3  ARG 704           HB3      ARG 704  48.879 -10.376  -8.586
    5    HG2  ARG 704           HG2      ARG 704  49.789 -11.146 -11.338
    6    HG3  ARG 704           HG3      ARG 704  48.173 -11.439 -10.696
    7    HD2  ARG 704           HD2      ARG 704  48.042  -8.931 -10.276
    8    HD3  ARG 704           HD3      ARG 704  49.487  -8.785 -11.272
    9    HE   ARG 704           HE       ARG 704  47.664 -10.275 -12.741
   10   HH11  ARG 704          HH11      ARG 704  47.886  -6.883 -11.574
   11   HH12  ARG 704          HH12      ARG 704  46.775  -6.331 -12.758
   12   HH21  ARG 704          HH21      ARG 704  46.081  -9.384 -14.268
   13   HH22  ARG 704          HH22      ARG 704  45.700  -7.719 -14.188

  No H/Q in entry =          13
  In of MODEL   43
    1    H    TRP 705           H        TRP 705  52.414 -11.387  -7.490
    2    HA   TRP 705           HA       TRP 705  51.561 -10.012  -5.057
    3    HB2  TRP 705           HB2      TRP 705  52.792 -11.909  -3.925
    4    HB3  TRP 705           HB3      TRP 705  51.375 -12.359  -4.860
    5    HD1  TRP 705           HD1      TRP 705  55.136 -12.827  -4.688
    6    HE1  TRP 705           HE1      TRP 705  55.841 -14.645  -6.340
    7    HE3  TRP 705           HE3      TRP 705  50.711 -13.412  -7.178
    8    HZ2  TRP 705           HZ2      TRP 705  54.664 -16.179  -8.417
    9    HZ3  TRP 705           HZ3      TRP 705  50.585 -15.070  -8.981
   10    HH2  TRP 705           HH2      TRP 705  52.520 -16.429  -9.591

  No H/Q in entry =          10
  In of MODEL   43
    1    H    GLU 706           H        GLU 706  53.749  -9.428  -7.307
    2    HA   GLU 706           HA       GLU 706  55.795  -8.466  -5.430
    3    HB2  GLU 706           HB2      GLU 706  56.224  -9.451  -8.259
    4    HB3  GLU 706           HB3      GLU 706  57.457  -8.824  -7.146
    5    HG2  GLU 706           HG2      GLU 706  57.211 -10.762  -5.773
    6    HG3  GLU 706           HG3      GLU 706  55.856 -11.334  -6.753

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LYS 707           H        LYS 707  56.752  -6.522  -6.055
    2    HA   LYS 707           HA       LYS 707  55.425  -5.059  -8.187
    3    HB2  LYS 707           HB2      LYS 707  55.034  -3.093  -6.744
    4    HB3  LYS 707           HB3      LYS 707  54.082  -4.479  -6.252
    5    HG2  LYS 707           HG2      LYS 707  55.647  -4.907  -4.418
    6    HG3  LYS 707           HG3      LYS 707  56.611  -3.517  -4.919
    7    HD2  LYS 707           HD2      LYS 707  54.679  -2.046  -4.536
    8    HD3  LYS 707           HD3      LYS 707  53.727  -3.440  -4.028
    9    HE2  LYS 707           HE2      LYS 707  55.250  -3.809  -2.156
   10    HE3  LYS 707           HE3      LYS 707  56.240  -2.449  -2.677
   11    HZ1  LYS 707           HZ1      LYS 707  54.311  -1.001  -2.336
   12    HZ3  LYS 707           HZ2      LYS 707  54.765  -1.728  -0.920
   13    HZ2  LYS 707           HZ3      LYS 707  53.416  -2.296  -1.755

  No H/Q in entry =          13
  In of MODEL   43
    1    H    LEU 708           H        LEU 708  56.539  -3.051  -8.718
    2    HA   LEU 708           HA       LEU 708  59.413  -3.453  -8.449
    3    HB2  LEU 708           HB2      LEU 708  58.452  -3.307 -10.706
    4    HB3  LEU 708           HB3      LEU 708  57.778  -1.740 -10.324
    5    HG   LEU 708           HG       LEU 708  60.129  -0.895 -10.034
    6   HD11  LEU 708          HD11      LEU 708  60.841  -3.540 -11.278
    7   HD13  LEU 708          HD12      LEU 708  61.264  -3.000  -9.653
    8   HD12  LEU 708          HD13      LEU 708  61.939  -2.180 -11.060
    9   HD21  LEU 708          HD21      LEU 708  59.369  -1.988 -12.738
   10   HD23  LEU 708          HD22      LEU 708  60.554  -0.720 -12.436
   11   HD22  LEU 708          HD23      LEU 708  58.854  -0.448 -12.051

  No H/Q in entry =          11
  In of MODEL   43
    1    H    GLN 709           H        GLN 709  60.320  -2.295  -6.858
    2    HA   GLN 709           HA       GLN 709  59.764   0.535  -6.748
    3    HB2  GLN 709           HB2      GLN 709  59.377   0.650  -4.368
    4    HB3  GLN 709           HB3      GLN 709  58.241  -0.523  -5.021
    5    HG2  GLN 709           HG2      GLN 709  59.712  -2.338  -4.261
    6    HG3  GLN 709           HG3      GLN 709  60.793  -1.145  -3.584
    7   HE21  GLN 709          HE21      GLN 709  60.523  -1.983  -1.523
    8   HE22  GLN 709          HE22      GLN 709  59.096  -1.726  -0.604

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ASN 710           H        ASN 710  61.528   1.659  -5.974
    2    HA   ASN 710           HA       ASN 710  63.734   2.109  -5.515
    3    HB2  ASN 710           HB2      ASN 710  63.058   0.425  -3.568
    4    HB3  ASN 710           HB3      ASN 710  64.056  -0.700  -4.448
    5   HD21  ASN 710          HD21      ASN 710  64.420   0.364  -1.798
    6   HD22  ASN 710          HD22      ASN 710  65.969   1.105  -1.758

  No H/Q in entry =           6
  In of MODEL   43
    1    H    SER 711           H        SER 711  62.765   0.755  -7.958
    2    HA   SER 711           HA       SER 711  63.481   0.009  -9.946
    3    HB2  SER 711           HB2      SER 711  65.287   1.706  -9.645
    4    HB3  SER 711           HB3      SER 711  66.280   0.493  -8.847
    5    HG   SER 711           HG       SER 711  65.964  -0.724 -10.872

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ARG 712           H        ARG 712  63.164  -1.844  -7.581
    2    HA   ARG 712           HA       ARG 712  64.401  -4.161  -8.846
    3    HB2  ARG 712           HB2      ARG 712  64.988  -5.102  -6.649
    4    HB3  ARG 712           HB3      ARG 712  65.835  -3.585  -6.923
    5    HG2  ARG 712           HG2      ARG 712  64.235  -2.423  -5.527
    6    HG3  ARG 712           HG3      ARG 712  63.341  -3.917  -5.282
    7    HD2  ARG 712           HD2      ARG 712  65.349  -4.889  -4.215
    8    HD3  ARG 712           HD3      ARG 712  66.163  -3.331  -4.390
    9    HE   ARG 712           HE       ARG 712  63.971  -2.608  -3.093
   10   HH11  ARG 712          HH11      ARG 712  66.214  -5.262  -2.425
   11   HH12  ARG 712          HH12      ARG 712  65.909  -5.277  -0.748
   12   HH21  ARG 712          HH21      ARG 712  63.513  -2.682  -0.796
   13   HH22  ARG 712          HH22      ARG 712  64.320  -3.800   0.189

  No H/Q in entry =          13
  In of MODEL   43
    1    H    CYS 713           H        CYS 713  63.306  -6.185  -8.007
    2    HA   CYS 713           HA       CYS 713  60.436  -5.664  -7.829
    3    HB2  CYS 713           HB2      CYS 713  61.931  -8.225  -8.412
    4    HB3  CYS 713           HB3      CYS 713  60.197  -7.965  -8.588

  No H/Q in entry =           4
  In of MODEL   43
    1    H    VAL 714           H        VAL 714  59.435  -5.977  -5.918
    2    HA   VAL 714           HA       VAL 714  60.699  -7.768  -3.964
    3    HB   VAL 714           HB       VAL 714  60.083  -6.270  -2.121
    4   HG12  VAL 714          HG11      VAL 714  61.729  -4.854  -4.202
    5   HG11  VAL 714          HG12      VAL 714  62.317  -6.026  -3.023
    6   HG13  VAL 714          HG13      VAL 714  61.698  -4.464  -2.483
    7   HG21  VAL 714          HG21      VAL 714  59.170  -4.361  -4.277
    8   HG23  VAL 714          HG22      VAL 714  59.310  -3.964  -2.570
    9   HG22  VAL 714          HG23      VAL 714  58.150  -5.179  -3.098

  No H/Q in entry =           9
  In of MODEL   43
    1    H    CYS 715           H        CYS 715  59.137  -8.364  -2.193
    2    HA   CYS 715           HA       CYS 715  56.595  -9.043  -3.398
    3    HB2  CYS 715           HB2      CYS 715  57.723  -9.781  -0.670
    4    HB3  CYS 715           HB3      CYS 715  56.346 -10.516  -1.470

  No H/Q in entry =           4
  In of MODEL   43
    1    H    LYS 716           H        LYS 716  54.647  -8.324  -2.572
    2    HA   LYS 716           HA       LYS 716  54.763  -5.792  -1.146
    3    HB2  LYS 716           HB2      LYS 716  52.391  -5.585  -1.862
    4    HB3  LYS 716           HB3      LYS 716  53.452  -5.965  -3.209
    5    HG2  LYS 716           HG2      LYS 716  52.756  -8.401  -2.771
    6    HG3  LYS 716           HG3      LYS 716  51.440  -7.693  -1.838
    7    HD2  LYS 716           HD2      LYS 716  52.051  -7.187  -4.754
    8    HD3  LYS 716           HD3      LYS 716  50.745  -8.181  -4.126
    9    HE2  LYS 716           HE2      LYS 716  49.753  -6.187  -3.085
   10    HE3  LYS 716           HE3      LYS 716  51.056  -5.203  -3.761
   11    HZ1  LYS 716           HZ1      LYS 716  50.344  -5.900  -5.975
   12    HZ3  LYS 716           HZ2      LYS 716  49.132  -5.074  -5.176
   13    HZ2  LYS 716           HZ3      LYS 716  49.035  -6.738  -5.327

  No H/Q in entry =          13
  In of MODEL   43
    1    H    MET 717           H        MET 717  52.277  -5.738   0.238
    2    HA   MET 717           HA       MET 717  52.806  -7.672   2.388
    3    HB2  MET 717           HB2      MET 717  51.294  -5.079   2.341
    4    HB3  MET 717           HB3      MET 717  51.232  -6.162   3.718
    5    HG2  MET 717           HG2      MET 717  53.770  -4.909   2.676
    6    HG3  MET 717           HG3      MET 717  52.741  -4.139   3.870
    7    HE1  MET 717           HE1      MET 717  55.407  -6.789   3.079
    8    HE3  MET 717           HE2      MET 717  54.211  -8.020   3.543
    9    HE2  MET 717           HE3      MET 717  55.588  -7.691   4.573

  No H/Q in entry =           9
  In of MODEL   43
    1    HA   PRO 718           HA       PRO 718  49.358 -10.052   1.070
    2    HB2  PRO 718           HB2      PRO 718  48.868 -11.472   3.353
    3    HB3  PRO 718           HB3      PRO 718  50.202 -11.827   2.254
    4    HG2  PRO 718           HG2      PRO 718  50.222 -10.324   4.837
    5    HG3  PRO 718           HG3      PRO 718  51.407 -11.477   4.197
    6    HD2  PRO 718           HD2      PRO 718  51.781  -8.789   4.125
    7    HD3  PRO 718           HD3      PRO 718  52.439  -9.885   2.894

  No H/Q in entry =           7
  In of MODEL   43
    1    H    TYR 719           H        TYR 719  49.062  -8.354   4.121
    2    HA   TYR 719           HA       TYR 719  46.178  -8.546   4.090
    3    HB2  TYR 719           HB2      TYR 719  46.222  -7.403   6.213
    4    HB3  TYR 719           HB3      TYR 719  47.475  -8.633   6.222
    5    HD1  TYR 719           HD1      TYR 719  49.921  -7.798   5.703
    6    HD2  TYR 719           HD2      TYR 719  46.713  -5.234   6.806
    7    HE1  TYR 719           HE1      TYR 719  51.534  -6.096   6.429
    8    HE2  TYR 719           HE2      TYR 719  48.307  -3.532   7.523
    9    HH   TYR 719           HH       TYR 719  51.586  -3.619   6.752

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLU 720           H        GLU 720  48.329  -6.707   2.482
    2    HA   GLU 720           HA       GLU 720  46.537  -4.401   2.325
    3    HB2  GLU 720           HB2      GLU 720  49.474  -4.617   2.600
    4    HB3  GLU 720           HB3      GLU 720  48.832  -3.241   1.722
    5    HG2  GLU 720           HG2      GLU 720  48.097  -4.025   4.538
    6    HG3  GLU 720           HG3      GLU 720  49.315  -2.819   4.119

  No H/Q in entry =           6
  In of MODEL   43
    1    H    CYS 721           H        CYS 721  46.753  -6.888   0.736
    2    HA   CYS 721           HA       CYS 721  48.240  -6.102  -1.611
    3    HB2  CYS 721           HB2      CYS 721  48.276  -8.474  -0.676
    4    HB3  CYS 721           HB3      CYS 721  46.625  -8.620  -1.244

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLY 722           H        GLY 722  44.866  -6.613  -0.656
    2    HA3  GLY 722           HA2      GLY 722  43.363  -4.947  -1.679
    3    HA2  GLY 722           HA3      GLY 722  44.115  -5.368  -3.211

  No H/Q in entry =           3
  In of MODEL   43
    1    HA   PRO 723           HA       PRO 723  40.486  -8.124  -2.975
    2    HB2  PRO 723           HB2      PRO 723  39.531  -7.609  -5.418
    3    HB3  PRO 723           HB3      PRO 723  39.339  -6.433  -4.107
    4    HG2  PRO 723           HG2      PRO 723  41.206  -6.443  -6.424
    5    HG3  PRO 723           HG3      PRO 723  40.406  -5.077  -5.636
    6    HD2  PRO 723           HD2      PRO 723  43.053  -5.950  -5.209
    7    HD3  PRO 723           HD3      PRO 723  42.159  -4.791  -4.210

  No H/Q in entry =           7
  In of MODEL   43
    1    H    SER 724           H        SER 724  40.113 -10.286  -3.932
    2    HA   SER 724           HA       SER 724  41.377 -11.186  -6.281
    3    HB2  SER 724           HB2      SER 724  43.067 -12.634  -5.245
    4    HB3  SER 724           HB3      SER 724  43.309 -10.950  -4.901
    5    HG   SER 724           HG       SER 724  42.189 -11.253  -2.971

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU 725           H        LEU 725  41.315 -13.711  -6.290
    2    HA   LEU 725           HA       LEU 725  38.637 -14.604  -5.828
    3    HB2  LEU 725           HB2      LEU 725  41.031 -15.597  -7.007
    4    HB3  LEU 725           HB3      LEU 725  40.271 -16.826  -6.019
    5    HG   LEU 725           HG       LEU 725  39.262 -17.302  -7.880
    6   HD13  LEU 725          HD11      LEU 725  37.140 -16.564  -8.236
    7   HD12  LEU 725          HD12      LEU 725  37.469 -15.094  -7.375
    8   HD11  LEU 725          HD13      LEU 725  37.485 -16.646  -6.496
    9   HD23  LEU 725          HD21      LEU 725  39.418 -14.515  -8.940
   10   HD22  LEU 725          HD22      LEU 725  38.803 -15.917  -9.813
   11   HD21  LEU 725          HD23      LEU 725  40.503 -15.851  -9.342

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ASP 726           H        ASP 726  37.680 -15.474  -4.215
    2    HA   ASP 726           HA       ASP 726  38.926 -15.897  -1.707
    3    HB2  ASP 726           HB2      ASP 726  36.685 -17.007  -1.194
    4    HB3  ASP 726           HB3      ASP 726  36.656 -15.292  -1.576

  No H/Q in entry =           4
  In of MODEL   43
    1    H    VAL 727           H        VAL 727  40.113 -17.489  -1.144
    2    HA   VAL 727           HA       VAL 727  39.445 -20.084  -2.175
    3    HB   VAL 727           HB       VAL 727  41.833 -20.711  -2.567
    4   HG13  VAL 727          HG11      VAL 727  40.535 -20.079  -4.506
    5   HG12  VAL 727          HG12      VAL 727  42.198 -19.528  -4.695
    6   HG11  VAL 727          HG13      VAL 727  40.937 -18.383  -4.251
    7   HG23  VAL 727          HG21      VAL 727  43.561 -18.967  -2.773
    8   HG22  VAL 727          HG22      VAL 727  42.940 -19.108  -1.130
    9   HG21  VAL 727          HG23      VAL 727  42.412 -17.772  -2.160

  No H/Q in entry =           9
  In of MODEL   43
    1    H    CYS 728           H        CYS 728  40.577 -21.803  -0.846
    2    HA   CYS 728           HA       CYS 728  41.253 -20.776   1.781
    3    HB2  CYS 728           HB2      CYS 728  39.238 -22.748   0.989
    4    HB3  CYS 728           HB3      CYS 728  39.886 -22.957   2.580

  No H/Q in entry =           4
  In of MODEL   43
    1    H    ALA 729           H        ALA 729  42.648 -21.995   2.968
    2    HA   ALA 729           HA       ALA 729  43.872 -24.202   1.583
    3    HB3  ALA 729           HB1      ALA 729  45.011 -22.203   0.766
    4    HB2  ALA 729           HB2      ALA 729  46.062 -23.255   1.711
    5    HB1  ALA 729           HB3      ALA 729  45.419 -21.780   2.430

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLN 730           H        GLN 730  45.463 -25.124   2.860
    2    HA   GLN 730           HA       GLN 730  44.741 -25.204   5.648
    3    HB2  GLN 730           HB2      GLN 730  44.828 -27.303   4.342
    4    HB3  GLN 730           HB3      GLN 730  46.512 -26.980   4.007
    5    HG2  GLN 730           HG2      GLN 730  47.089 -27.119   6.301
    6    HG3  GLN 730           HG3      GLN 730  45.414 -27.333   6.778
    7   HE21  GLN 730          HE21      GLN 730  45.695 -29.379   7.665
    8   HE22  GLN 730          HE22      GLN 730  46.189 -30.727   6.712

  No H/Q in entry =           8
  In of MODEL   43
    1    H    ASP 731           H        ASP 731  45.891 -24.305   7.003
    2    HA   ASP 731           HA       ASP 731  48.395 -22.974   6.590
    3    HB2  ASP 731           HB2      ASP 731  46.589 -22.311   8.207
    4    HB3  ASP 731           HB3      ASP 731  46.933 -23.767   9.116

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLU 732           H        GLU 732  50.351 -24.057   6.530
    2    HA   GLU 732           HA       GLU 732  50.495 -26.835   7.151
    3    HB2  GLU 732           HB2      GLU 732  52.607 -24.842   6.364
    4    HB3  GLU 732           HB3      GLU 732  52.966 -26.529   6.706
    5    HG2  GLU 732           HG2      GLU 732  51.006 -25.607   4.624
    6    HG3  GLU 732           HG3      GLU 732  52.692 -26.021   4.301

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ARG 733           H        ARG 733  50.858 -24.126   9.112
    2    HA   ARG 733           HA       ARG 733  52.691 -25.433  10.932
    3    HB2  ARG 733           HB2      ARG 733  53.044 -23.074  10.628
    4    HB3  ARG 733           HB3      ARG 733  51.349 -22.724  10.920
    5    HG2  ARG 733           HG2      ARG 733  52.708 -22.077  12.825
    6    HG3  ARG 733           HG3      ARG 733  51.611 -23.388  13.258
    7    HD2  ARG 733           HD2      ARG 733  53.482 -24.982  12.903
    8    HD3  ARG 733           HD3      ARG 733  54.550 -23.598  12.645
    9    HE   ARG 733           HE       ARG 733  53.187 -23.277  15.055
   10   HH11  ARG 733          HH11      ARG 733  55.745 -25.251  13.650
   11   HH12  ARG 733          HH12      ARG 733  56.489 -25.606  15.146
   12   HH21  ARG 733          HH21      ARG 733  54.204 -23.771  17.119
   13   HH22  ARG 733          HH22      ARG 733  55.598 -24.734  17.141

  No H/Q in entry =          13
  In of MODEL   43
    1    H    SER 734           H        SER 734  49.463 -24.107  10.961
    2    HA   SER 734           HA       SER 734  48.918 -25.277  13.564
    3    HB2  SER 734           HB2      SER 734  47.090 -23.632  11.846
    4    HB3  SER 734           HB3      SER 734  47.088 -23.799  13.603
    5    HG   SER 734           HG       SER 734  48.895 -22.403  11.942

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LYS 735           H        LYS 735  48.481 -26.193  10.274
    2    HA   LYS 735           HA       LYS 735  47.130 -27.450   9.126
    3    HB2  LYS 735           HB2      LYS 735  47.318 -29.106  11.635
    4    HB3  LYS 735           HB3      LYS 735  46.630 -29.699  10.128
    5    HG2  LYS 735           HG2      LYS 735  49.476 -28.759  10.525
    6    HG3  LYS 735           HG3      LYS 735  48.939 -30.433  10.384
    7    HD2  LYS 735           HD2      LYS 735  48.004 -29.776   8.106
    8    HD3  LYS 735           HD3      LYS 735  48.883 -28.280   8.290
    9    HE2  LYS 735           HE2      LYS 735  50.991 -29.352   8.397
   10    HE3  LYS 735           HE3      LYS 735  50.252 -30.949   8.507
   11    HZ3  LYS 735           HZ1      LYS 735  49.472 -30.714   6.231
   12    HZ2  LYS 735           HZ2      LYS 735  51.128 -30.518   6.280
   13    HZ1  LYS 735           HZ3      LYS 735  50.148 -29.175   6.075

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ARG 736           H        ARG 736  45.607 -25.858   9.038
    2    HA   ARG 736           HA       ARG 736  42.986 -26.649   9.991
    3    HB2  ARG 736           HB2      ARG 736  42.513 -24.305  10.739
    4    HB3  ARG 736           HB3      ARG 736  43.727 -25.084  11.746
    5    HG2  ARG 736           HG2      ARG 736  45.489 -23.937  10.536
    6    HG3  ARG 736           HG3      ARG 736  44.302 -23.171   9.493
    7    HD2  ARG 736           HD2      ARG 736  43.387 -21.983  11.427
    8    HD3  ARG 736           HD3      ARG 736  44.559 -22.783  12.477
    9    HE   ARG 736           HE       ARG 736  46.106 -21.633  10.569
   10   HH11  ARG 736          HH11      ARG 736  43.643 -20.256  12.754
   11   HH12  ARG 736          HH12      ARG 736  44.413 -18.741  12.801
   12   HH21  ARG 736          HH21      ARG 736  47.097 -19.577  10.672
   13   HH22  ARG 736          HH22      ARG 736  46.371 -18.340  11.612

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ILE 737           H        ILE 737  41.377 -25.765   8.551
    2    HA   ILE 737           HA       ILE 737  42.528 -24.834   6.035
    3    HB   ILE 737           HB       ILE 737  39.650 -25.594   6.590
    4   HG12  ILE 737          HG12      ILE 737  41.169 -27.487   7.193
    5   HG13  ILE 737          HG13      ILE 737  40.112 -27.860   5.846
    6   HG21  ILE 737          HG21      ILE 737  40.213 -24.300   4.551
    7   HG23  ILE 737          HG22      ILE 737  39.549 -25.901   4.194
    8   HG22  ILE 737          HG23      ILE 737  41.279 -25.614   4.045
    9   HD11  ILE 737          HD11      ILE 737  41.976 -27.431   4.315
   10   HD13  ILE 737          HD12      ILE 737  42.325 -28.732   5.457
   11   HD12  ILE 737          HD13      ILE 737  43.029 -27.127   5.698

  No H/Q in entry =          11
  In of MODEL   43
    1    H    LEU 738           H        LEU 738  42.489 -22.673   5.766
    2    HA   LEU 738           HA       LEU 738  40.341 -21.254   7.114
    3    HB2  LEU 738           HB2      LEU 738  41.751 -19.389   7.772
    4    HB3  LEU 738           HB3      LEU 738  42.362 -20.881   8.439
    5    HG   LEU 738           HG       LEU 738  43.570 -19.548   6.016
    6   HD11  LEU 738          HD11      LEU 738  43.691 -18.056   7.961
    7   HD13  LEU 738          HD12      LEU 738  45.275 -18.710   7.546
    8   HD12  LEU 738          HD13      LEU 738  44.382 -19.367   8.919
    9   HD21  LEU 738          HD21      LEU 738  44.499 -21.639   7.936
   10   HD23  LEU 738          HD22      LEU 738  45.486 -20.949   6.630
   11   HD22  LEU 738          HD23      LEU 738  44.027 -21.885   6.258

  No H/Q in entry =          11
  In of MODEL   43
    1    HA   PRO 739           HA       PRO 739  39.442 -19.170   3.352
    2    HB2  PRO 739           HB2      PRO 739  38.446 -16.863   4.429
    3    HB3  PRO 739           HB3      PRO 739  37.537 -18.377   4.384
    4    HG2  PRO 739           HG2      PRO 739  39.098 -17.177   6.637
    5    HG3  PRO 739           HG3      PRO 739  37.509 -17.964   6.670
    6    HD2  PRO 739           HD2      PRO 739  39.793 -19.281   7.398
    7    HD3  PRO 739           HD3      PRO 739  38.431 -20.100   6.580

  No H/Q in entry =           7
  In of MODEL   43
    1    H    LEU 740           H        LEU 740  40.933 -18.328   2.146
    2    HA   LEU 740           HA       LEU 740  42.532 -16.041   3.067
    3    HB2  LEU 740           HB2      LEU 740  43.329 -18.404   1.375
    4    HB3  LEU 740           HB3      LEU 740  44.276 -16.939   1.511
    5    HG   LEU 740           HG       LEU 740  43.643 -18.826   3.781
    6   HD13  LEU 740          HD11      LEU 740  45.982 -19.400   3.660
    7   HD12  LEU 740          HD12      LEU 740  46.209 -18.291   2.312
    8   HD11  LEU 740          HD13      LEU 740  45.199 -19.729   2.110
    9   HD22  LEU 740          HD21      LEU 740  43.877 -16.530   4.569
   10   HD21  LEU 740          HD22      LEU 740  45.367 -16.352   3.652
   11   HD23  LEU 740          HD23      LEU 740  45.304 -17.469   5.017

  No H/Q in entry =          11
  In of MODEL   43
    1    H    THR 741           H        THR 741  43.539 -15.301   0.760
    2    HA   THR 741           HA       THR 741  41.533 -15.471  -1.302
    3    HB   THR 741           HB       THR 741  42.648 -12.822  -1.263
    4    HG1  THR 741           HG1      THR 741  41.392 -13.698   1.143
    5   HG22  THR 741          HG21      THR 741  39.830 -13.781  -0.735
    6   HG21  THR 741          HG22      THR 741  40.554 -13.485  -2.322
    7   HG23  THR 741          HG23      THR 741  40.311 -12.144  -1.204

  No H/Q in entry =           7
  In of MODEL   43
    1    H    VAL 742           H        VAL 742  42.561 -14.992  -3.367
    2    HA   VAL 742           HA       VAL 742  45.014 -16.245  -3.682
    3    HB   VAL 742           HB       VAL 742  43.599 -14.327  -5.542
    4   HG12  VAL 742          HG11      VAL 742  44.900 -15.245  -7.336
    5   HG11  VAL 742          HG12      VAL 742  45.896 -16.143  -6.173
    6   HG13  VAL 742          HG13      VAL 742  45.884 -14.367  -6.173
    7   HG22  VAL 742          HG21      VAL 742  42.347 -16.218  -5.042
    8   HG21  VAL 742          HG22      VAL 742  43.721 -17.292  -5.397
    9   HG23  VAL 742          HG23      VAL 742  42.968 -16.324  -6.690

  No H/Q in entry =           9
  In of MODEL   43
    1    H    CYS 743           H        CYS 743  44.339 -12.797  -3.420
    2    HA   CYS 743           HA       CYS 743  46.940 -11.948  -4.012
    3    HB2  CYS 743           HB2      CYS 743  46.263  -9.781  -3.177
    4    HB3  CYS 743           HB3      CYS 743  44.934 -10.471  -4.054

  No H/Q in entry =           4
  In of MODEL   43
    1    H    LYS 744           H        LYS 744  45.275 -12.509  -0.940
    2    HA   LYS 744           HA       LYS 744  47.441 -11.936   0.721
    3    HB2  LYS 744           HB2      LYS 744  45.110 -13.792   1.200
    4    HB3  LYS 744           HB3      LYS 744  46.285 -13.348   2.427
    5    HG2  LYS 744           HG2      LYS 744  45.611 -10.971   2.120
    6    HG3  LYS 744           HG3      LYS 744  44.351 -11.518   1.012
    7    HD2  LYS 744           HD2      LYS 744  43.357 -12.858   2.797
    8    HD3  LYS 744           HD3      LYS 744  44.627 -12.346   3.905
    9    HE2  LYS 744           HE2      LYS 744  42.567 -10.570   2.589
   10    HE3  LYS 744           HE3      LYS 744  42.580 -11.072   4.270
   11    HZ1  LYS 744           HZ1      LYS 744  44.654  -9.875   4.578
   12    HZ3  LYS 744           HZ2      LYS 744  43.434  -8.853   4.057
   13    HZ2  LYS 744           HZ3      LYS 744  44.630  -9.344   2.968

  No H/Q in entry =          13
  In of MODEL   43
    1    H    MET 745           H        MET 745  46.217 -15.149  -0.189
    2    HA   MET 745           HA       MET 745  48.175 -16.748   0.954
    3    HB2  MET 745           HB2      MET 745  46.662 -18.055   0.274
    4    HB3  MET 745           HB3      MET 745  46.125 -17.070  -1.100
    5    HG2  MET 745           HG2      MET 745  46.894 -19.034  -2.130
    6    HG3  MET 745           HG3      MET 745  48.260 -17.969  -2.232
    7    HE2  MET 745           HE1      MET 745  47.922 -21.629   0.494
    8    HE1  MET 745           HE2      MET 745  46.742 -21.066  -0.692
    9    HE3  MET 745           HE3      MET 745  46.970 -20.179   0.811

  No H/Q in entry =           9
  In of MODEL   43
    1    H    HIS 746           H        HIS 746  48.303 -15.293  -2.334
    2    HA   HIS 746           HA       HIS 746  50.736 -16.573  -2.969
    3    HB2  HIS 746           HB2      HIS 746  49.204 -14.361  -4.053
    4    HB3  HIS 746           HB3      HIS 746  50.911 -14.382  -4.531
    5    HD1  HIS 746           HD1      HIS 746  51.378 -17.256  -5.174
    6    HD2  HIS 746           HD2      HIS 746  47.802 -15.346  -6.006
    7    HE1  HIS 746           HE1      HIS 746  50.370 -18.538  -7.041
    8    HE2  HIS 746           HE2      HIS 746  48.257 -17.273  -7.632

  No H/Q in entry =           8
  In of MODEL   43
    1    H    VAL 747           H        VAL 747  50.147 -13.328  -1.641
    2    HA   VAL 747           HA       VAL 747  52.921 -12.732  -1.531
    3    HB   VAL 747           HB       VAL 747  50.630 -11.534   0.045
    4   HG12  VAL 747          HG11      VAL 747  53.413 -10.507  -0.496
    5   HG11  VAL 747          HG12      VAL 747  52.816 -11.125   1.046
    6   HG13  VAL 747          HG13      VAL 747  52.134  -9.646   0.366
    7   HG22  VAL 747          HG21      VAL 747  50.677  -9.769  -1.616
    8   HG21  VAL 747          HG22      VAL 747  50.363 -11.338  -2.367
    9   HG23  VAL 747          HG23      VAL 747  51.970 -10.611  -2.469

  No H/Q in entry =           9
  In of MODEL   43
    1    H    LEU 748           H        LEU 748  50.590 -13.908   0.709
    2    HA   LEU 748           HA       LEU 748  51.860 -14.405   3.086
    3    HB2  LEU 748           HB2      LEU 748  49.531 -14.698   2.659
    4    HB3  LEU 748           HB3      LEU 748  49.841 -15.733   1.323
    5    HG   LEU 748           HG       LEU 748  48.661 -16.855   2.922
    6   HD11  LEU 748          HD11      LEU 748  51.391 -17.924   2.851
    7   HD13  LEU 748          HD12      LEU 748  49.951 -18.304   1.883
    8   HD12  LEU 748          HD13      LEU 748  50.010 -18.748   3.586
    9   HD22  LEU 748          HD21      LEU 748  48.946 -15.613   4.815
   10   HD21  LEU 748          HD22      LEU 748  50.652 -16.090   5.022
   11   HD23  LEU 748          HD23      LEU 748  49.328 -17.281   5.187

  No H/Q in entry =          11
  In of MODEL   43
    1    H    HIS 749           H        HIS 749  51.839 -16.306   0.128
    2    HA   HIS 749           HA       HIS 749  53.456 -18.453   0.980
    3    HB2  HIS 749           HB2      HIS 749  51.773 -18.258  -0.975
    4    HB3  HIS 749           HB3      HIS 749  53.124 -17.584  -1.872
    5    HD1  HIS 749           HD1      HIS 749  54.612 -19.265  -3.004
    6    HD2  HIS 749           HD2      HIS 749  52.203 -20.885  -0.067
    7    HE1  HIS 749           HE1      HIS 749  54.939 -21.731  -3.185
    8    HE2  HIS 749           HE2      HIS 749  53.727 -22.657  -1.188

  No H/Q in entry =           8
  In of MODEL   43
    1    H    CYS 750           H        CYS 750  54.177 -15.444  -0.852
    2    HA   CYS 750           HA       CYS 750  56.873 -16.323  -1.332
    3    HB2  CYS 750           HB2      CYS 750  57.228 -14.133  -2.428
    4    HB3  CYS 750           HB3      CYS 750  55.813 -14.965  -3.054

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLN 751           H        GLN 751  55.261 -14.551   1.088
    2    HA   GLN 751           HA       GLN 751  57.540 -13.318   2.218
    3    HB2  GLN 751           HB2      GLN 751  54.843 -14.013   3.359
    4    HB3  GLN 751           HB3      GLN 751  56.083 -13.197   4.297
    5    HG2  GLN 751           HG2      GLN 751  54.990 -12.184   1.702
    6    HG3  GLN 751           HG3      GLN 751  54.352 -11.697   3.261
    7   HE21  GLN 751          HE21      GLN 751  55.506 -10.001   1.262
    8   HE22  GLN 751          HE22      GLN 751  56.926  -9.295   1.927

  No H/Q in entry =           8
  In of MODEL   43
    1    H    GLY 752           H        GLY 752  56.639 -16.561   2.054
    2    HA3  GLY 752           HA2      GLY 752  58.222 -18.207   2.747
    3    HA2  GLY 752           HA3      GLY 752  58.640 -17.178   4.106

  No H/Q in entry =           3
  In of MODEL   43
    1    H    ARG 753           H        ARG 753  55.290 -17.699   3.317
    2    HA   ARG 753           HA       ARG 753  55.052 -19.374   5.720
    3    HB2  ARG 753           HB2      ARG 753  52.859 -17.952   4.189
    4    HB3  ARG 753           HB3      ARG 753  52.697 -18.765   5.735
    5    HG2  ARG 753           HG2      ARG 753  54.261 -16.242   5.211
    6    HG3  ARG 753           HG3      ARG 753  52.669 -16.339   5.956
    7    HD2  ARG 753           HD2      ARG 753  53.610 -17.615   7.803
    8    HD3  ARG 753           HD3      ARG 753  55.200 -17.549   7.042
    9    HE   ARG 753           HE       ARG 753  53.923 -15.005   7.557
   10   HH11  ARG 753          HH11      ARG 753  56.194 -17.455   8.749
   11   HH12  ARG 753          HH12      ARG 753  57.011 -16.357   9.761
   12   HH21  ARG 753          HH21      ARG 753  55.116 -13.530   8.951
   13   HH22  ARG 753          HH22      ARG 753  56.419 -14.107   9.866

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ASN 754           H        ASN 754  54.710 -21.491   5.363
    2    HA   ASN 754           HA       ASN 754  54.113 -22.352   2.657
    3    HB2  ASN 754           HB2      ASN 754  54.679 -24.036   5.120
    4    HB3  ASN 754           HB3      ASN 754  54.440 -24.671   3.501
    5   HD21  ASN 754          HD21      ASN 754  56.568 -23.186   5.680
    6   HD22  ASN 754          HD22      ASN 754  57.982 -23.167   4.693

  No H/Q in entry =           6
  In of MODEL   43
    1    H    TYR 755           H        TYR 755  52.175 -22.741   1.989
    2    HA   TYR 755           HA       TYR 755  50.119 -23.642   3.847
    3    HB2  TYR 755           HB2      TYR 755  50.010 -21.219   2.088
    4    HB3  TYR 755           HB3      TYR 755  48.540 -22.128   2.370
    5    HD1  TYR 755           HD1      TYR 755  51.359 -20.949   4.572
    6    HD2  TYR 755           HD2      TYR 755  47.185 -21.044   3.868
    7    HE1  TYR 755           HE1      TYR 755  51.000 -19.647   6.619
    8    HE2  TYR 755           HE2      TYR 755  46.814 -19.717   5.897
    9    HH   TYR 755           HH       TYR 755  48.173 -19.468   8.149

  No H/Q in entry =           9
  In of MODEL   43
    1    H    THR 756           H        THR 756  48.504 -24.844   2.852
    2    HA   THR 756           HA       THR 756  49.187 -25.834   0.154
    3    HB   THR 756           HB       THR 756  48.142 -27.274   2.565
    4    HG1  THR 756           HG1      THR 756  50.157 -27.548   2.970
    5   HG22  THR 756          HG21      THR 756  48.336 -29.318   1.196
    6   HG21  THR 756          HG22      THR 756  48.745 -28.278  -0.198
    7   HG23  THR 756          HG23      THR 756  47.167 -28.138   0.586

  No H/Q in entry =           7
  In of MODEL   43
    1    H    LEU 757           H        LEU 757  47.468 -25.521  -1.233
    2    HA   LEU 757           HA       LEU 757  44.987 -24.686  -0.101
    3    HB2  LEU 757           HB2      LEU 757  45.698 -25.175  -2.965
    4    HB3  LEU 757           HB3      LEU 757  44.141 -24.582  -2.415
    5    HG   LEU 757           HG       LEU 757  45.777 -22.857  -1.205
    6   HD12  LEU 757          HD11      LEU 757  47.473 -22.100  -2.781
    7   HD11  LEU 757          HD12      LEU 757  47.150 -23.517  -3.786
    8   HD13  LEU 757          HD13      LEU 757  47.777 -23.719  -2.148
    9   HD22  LEU 757          HD21      LEU 757  45.112 -21.284  -2.934
   10   HD21  LEU 757          HD22      LEU 757  43.816 -22.374  -2.415
   11   HD23  LEU 757          HD23      LEU 757  44.621 -22.646  -3.966

  No H/Q in entry =          11
  In of MODEL   43
    1    H    THR 758           H        THR 758  43.033 -25.589  -0.218
    2    HA   THR 758           HA       THR 758  42.988 -28.469  -0.701
    3    HB   THR 758           HB       THR 758  41.389 -28.526   1.296
    4    HG1  THR 758           HG1      THR 758  40.956 -26.757   2.245
    5   HG22  THR 758          HG21      THR 758  44.257 -27.705   1.846
    6   HG21  THR 758          HG22      THR 758  43.717 -29.336   1.460
    7   HG23  THR 758          HG23      THR 758  43.204 -28.573   2.962

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLY 759           H        GLY 759  40.375 -28.998  -0.389
    2    HA3  GLY 759           HA2      GLY 759  39.172 -27.571  -2.604
    3    HA2  GLY 759           HA3      GLY 759  38.505 -28.979  -1.783

  No H/Q in entry =           3
  In of MODEL   43
    1    H    ARG 760           H        ARG 760  36.994 -26.693  -2.470
    2    HA   ARG 760           HA       ARG 760  36.797 -24.872  -0.299
    3    HB2  ARG 760           HB2      ARG 760  34.816 -23.986  -1.416
    4    HB3  ARG 760           HB3      ARG 760  36.102 -24.280  -2.574
    5    HG2  ARG 760           HG2      ARG 760  34.233 -25.060  -3.711
    6    HG3  ARG 760           HG3      ARG 760  34.897 -26.522  -2.971
    7    HD2  ARG 760           HD2      ARG 760  33.280 -26.297  -1.119
    8    HD3  ARG 760           HD3      ARG 760  32.583 -24.893  -1.922
    9    HE   ARG 760           HE       ARG 760  32.663 -27.127  -3.624
   10   HH11  ARG 760          HH11      ARG 760  30.901 -25.968  -0.797
   11   HH12  ARG 760          HH12      ARG 760  29.414 -26.684  -1.243
   12   HH21  ARG 760          HH21      ARG 760  30.633 -28.104  -4.253
   13   HH22  ARG 760          HH22      ARG 760  29.249 -27.894  -3.262

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ASP 761           H        ASP 761  35.817 -28.005  -0.543
    2    HA   ASP 761           HA       ASP 761  33.433 -27.897   1.021
    3    HB2  ASP 761           HB2      ASP 761  33.622 -30.355   1.095
    4    HB3  ASP 761           HB3      ASP 761  33.830 -29.732  -0.541

  No H/Q in entry =           4
  In of MODEL   43
    1    H    SER 762           H        SER 762  36.763 -27.813   1.676
    2    HA   SER 762           HA       SER 762  36.525 -28.995   4.323
    3    HB2  SER 762           HB2      SER 762  38.977 -28.590   4.505
    4    HB3  SER 762           HB3      SER 762  38.547 -29.556   3.099
    5    HG   SER 762           HG       SER 762  38.741 -27.585   1.845

  No H/Q in entry =           5
  In of MODEL   43
    1    H    CYS 763           H        CYS 763  36.344 -25.879   2.960
    2    HA   CYS 763           HA       CYS 763  36.572 -24.539   5.566
    3    HB2  CYS 763           HB2      CYS 763  37.185 -22.693   4.028
    4    HB3  CYS 763           HB3      CYS 763  38.346 -24.025   4.134

  No H/Q in entry =           4
  In of MODEL   43
    1    H    THR 764           H        THR 764  35.386 -22.363   5.369
    2    HA   THR 764           HA       THR 764  33.084 -22.428   3.568
    3    HB   THR 764           HB       THR 764  33.234 -21.053   6.251
    4    HG1  THR 764           HG1      THR 764  33.113 -23.608   5.706
    5   HG23  THR 764          HG21      THR 764  31.557 -20.191   4.677
    6   HG22  THR 764          HG22      THR 764  30.763 -21.048   6.004
    7   HG21  THR 764          HG23      THR 764  30.938 -21.821   4.433

  No H/Q in entry =           7
  In of MODEL   43
    1    H    LEU 765           H        LEU 765  33.124 -20.783   2.129
    2    HA   LEU 765           HA       LEU 765  34.820 -18.510   2.692
    3    HB2  LEU 765           HB2      LEU 765  33.637 -19.621   0.203
    4    HB3  LEU 765           HB3      LEU 765  33.967 -17.907   0.219
    5    HG   LEU 765           HG       LEU 765  35.808 -18.784  -0.834
    6   HD11  LEU 765          HD11      LEU 765  36.677 -18.687   2.016
    7   HD13  LEU 765          HD12      LEU 765  36.610 -17.338   0.874
    8   HD12  LEU 765          HD13      LEU 765  37.726 -18.671   0.604
    9   HD22  LEU 765          HD21      LEU 765  36.981 -20.713  -0.189
   10   HD21  LEU 765          HD22      LEU 765  35.252 -21.029  -0.534
   11   HD23  LEU 765          HD23      LEU 765  35.840 -20.971   1.155

  No H/Q in entry =          11
  In of MODEL   43
    1    HA   PRO 766           HA       PRO 766  31.593 -15.687   3.736
    2    HB2  PRO 766           HB2      PRO 766  32.392 -13.544   2.210
    3    HB3  PRO 766           HB3      PRO 766  33.156 -14.010   3.740
    4    HG2  PRO 766           HG2      PRO 766  33.919 -14.794   0.942
    5    HG3  PRO 766           HG3      PRO 766  34.978 -14.086   2.200
    6    HD2  PRO 766           HD2      PRO 766  35.005 -16.624   1.744
    7    HD3  PRO 766           HD3      PRO 766  34.886 -16.126   3.439

  No H/Q in entry =           7
  In of MODEL   43
    1    H    ALA 767           H        ALA 767  30.474 -13.721   2.342
    2    HA   ALA 767           HA       ALA 767  28.753 -13.135   1.083
    3    HB1  ALA 767           HB1      ALA 767  29.820 -15.030  -1.005
    4    HB3  ALA 767           HB2      ALA 767  30.427 -13.404  -0.700
    5    HB2  ALA 767           HB3      ALA 767  28.766 -13.629  -1.263

  No H/Q in entry =           5
  In of MODEL   43
    1    H    SER 768           H        SER 768  26.677 -13.938  -0.131
    2    HA   SER 768           HA       SER 768  25.836 -16.566   0.366
    3    HB2  SER 768           HB2      SER 768  25.790 -15.594   2.694
    4    HB3  SER 768           HB3      SER 768  24.625 -14.402   2.110
    5    HG   SER 768           HG       SER 768  23.328 -15.919   2.809

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA 769           H        ALA 769  24.764 -16.804  -1.340
    2    HA   ALA 769           HA       ALA 769  23.298 -16.724  -3.041
    3    HB2  ALA 769           HB1      ALA 769  21.573 -16.443  -1.301
    4    HB3  ALA 769           HB2      ALA 769  21.143 -15.583  -2.781
    5    HB1  ALA 769           HB3      ALA 769  21.780 -14.697  -1.396

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLU 770           H        GLU 770  22.313 -13.472  -2.693
    2    HA   GLU 770           HA       GLU 770  23.958 -12.864  -5.008
    3    HB2  GLU 770           HB2      GLU 770  22.370 -11.034  -5.457
    4    HB3  GLU 770           HB3      GLU 770  21.567 -12.593  -5.418
    5    HG2  GLU 770           HG2      GLU 770  20.773 -12.123  -3.160
    6    HG3  GLU 770           HG3      GLU 770  21.585 -10.559  -3.211

  No H/Q in entry =           6
  In of MODEL   43
    1    H    LYS 771           H        LYS 771  24.906 -10.659  -5.020
    2    HA   LYS 771           HA       LYS 771  26.089 -10.382  -2.432
    3    HB2  LYS 771           HB2      LYS 771  26.738  -8.776  -4.919
    4    HB3  LYS 771           HB3      LYS 771  27.678  -8.881  -3.454
    5    HG2  LYS 771           HG2      LYS 771  27.262 -11.065  -5.499
    6    HG3  LYS 771           HG3      LYS 771  28.733 -10.166  -5.181
    7    HD2  LYS 771           HD2      LYS 771  29.192 -12.131  -4.069
    8    HD3  LYS 771           HD3      LYS 771  28.469 -11.204  -2.769
    9    HE2  LYS 771           HE2      LYS 771  27.558 -13.479  -2.795
   10    HE3  LYS 771           HE3      LYS 771  26.302 -12.320  -3.193
   11    HZ1  LYS 771           HZ1      LYS 771  26.635 -12.883  -5.564
   12    HZ3  LYS 771           HZ2      LYS 771  26.179 -14.212  -4.646
   13    HZ2  LYS 771           HZ3      LYS 771  27.771 -14.054  -5.118

  No H/Q in entry =          13
  In of MODEL   43
    1    H    ALA 772           H        ALA 772  26.145  -8.383  -1.250
    2    HA   ALA 772           HA       ALA 772  24.092  -6.440  -2.014
    3    HB3  ALA 772           HB1      ALA 772  24.365  -7.668   0.733
    4    HB2  ALA 772           HB2      ALA 772  23.067  -7.993  -0.415
    5    HB1  ALA 772           HB3      ALA 772  23.249  -6.381   0.280

  No H/Q in entry =           5
  In of MODEL   43
    1    H    CYS 773           H        CYS 773  24.343  -4.397  -1.039
    2    HA   CYS 773           HA       CYS 773  26.935  -3.377  -0.957
    3    HB2  CYS 773           HB2      CYS 773  24.899  -2.019  -1.343
    4    HB3  CYS 773           HB3      CYS 773  24.452  -2.229   0.343

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLY 774           H        GLY 774  28.494  -3.460   0.536
    2    HA3  GLY 774           HA2      GLY 774  28.955  -3.077   2.958
    3    HA2  GLY 774           HA3      GLY 774  27.766  -4.352   3.237

  No H/Q in entry =           3
  In of MODEL   43
    1    H    ALA 775           H        ALA 775  28.625  -5.727   0.792
    2    HA   ALA 775           HA       ALA 775  31.394  -6.386   1.199
    3    HB2  ALA 775           HB1      ALA 775  29.211  -8.473   1.487
    4    HB3  ALA 775           HB2      ALA 775  30.296  -7.935   2.769
    5    HB1  ALA 775           HB3      ALA 775  30.938  -8.819   1.384

  No H/Q in entry =           5
  In of MODEL   43
    1    H    CYS 776           H        CYS 776  31.914  -5.881  -0.814
    2    HA   CYS 776           HA       CYS 776  30.321  -7.060  -2.958
    3    HB2  CYS 776           HB2      CYS 776  31.639  -4.326  -3.023
    4    HB3  CYS 776           HB3      CYS 776  30.651  -5.070  -4.281

  No H/Q in entry =           4
  In of MODEL   43
    1    HA   PRO 777           HA       PRO 777  34.374  -8.682  -3.869
    2    HB2  PRO 777           HB2      PRO 777  33.657 -10.241  -5.949
    3    HB3  PRO 777           HB3      PRO 777  33.257 -10.673  -4.283
    4    HG2  PRO 777           HG2      PRO 777  31.535  -9.407  -6.373
    5    HG3  PRO 777           HG3      PRO 777  31.131 -10.692  -5.220
    6    HD2  PRO 777           HD2      PRO 777  30.448  -8.074  -4.852
    7    HD3  PRO 777           HD3      PRO 777  30.729  -9.209  -3.516

  No H/Q in entry =           7
  In of MODEL   43
    1    H    LEU 778           H        LEU 778  35.635  -8.927  -5.960
    2    HA   LEU 778           HA       LEU 778  35.656  -6.368  -7.231
    3    HB2  LEU 778           HB2      LEU 778  37.662  -7.243  -8.464
    4    HB3  LEU 778           HB3      LEU 778  37.807  -7.092  -6.712
    5    HG   LEU 778           HG       LEU 778  37.288  -9.696  -8.140
    6   HD12  LEU 778          HD11      LEU 778  39.686 -10.115  -7.956
    7   HD11  LEU 778          HD12      LEU 778  39.932  -8.451  -7.407
    8   HD13  LEU 778          HD13      LEU 778  39.305  -8.773  -9.031
    9   HD22  LEU 778          HD21      LEU 778  36.842  -9.977  -5.823
   10   HD21  LEU 778          HD22      LEU 778  38.181  -8.972  -5.343
   11   HD23  LEU 778          HD23      LEU 778  38.486 -10.563  -6.041

  No H/Q in entry =          11
  In of MODEL   43
    1    H    TRP 779           H        TRP 779  34.136  -9.150  -7.955
    2    HA   TRP 779           HA       TRP 779  33.744  -8.331 -10.751
    3    HB2  TRP 779           HB2      TRP 779  32.525 -10.665 -10.822
    4    HB3  TRP 779           HB3      TRP 779  34.272 -10.565 -10.972
    5    HD1  TRP 779           HD1      TRP 779  31.539 -11.867  -8.557
    6    HE1  TRP 779           HE1      TRP 779  32.739 -13.328  -6.778
    7    HE3  TRP 779           HE3      TRP 779  36.316 -10.839  -9.794
    8    HZ2  TRP 779           HZ2      TRP 779  35.475 -13.962  -6.043
    9    HZ3  TRP 779           HZ3      TRP 779  38.146 -11.873  -8.547
   10    HH2  TRP 779           HH2      TRP 779  37.726 -13.348  -6.735

  No H/Q in entry =          10
  In of MODEL   43
    1    H    GLY 780           H        GLY 780  32.589  -7.310  -8.170
    2    HA3  GLY 780           HA2      GLY 780  29.802  -7.650  -8.874
    3    HA2  GLY 780           HA3      GLY 780  30.357  -7.698  -7.200

  No H/Q in entry =           3
  In of MODEL   43
    1    H    LYS 781           H        LYS 781  28.854  -5.841  -9.135
    2    HA   LYS 781           HA       LYS 781  30.211  -3.431  -8.194
    3    HB2  LYS 781           HB2      LYS 781  28.498  -3.826 -10.614
    4    HB3  LYS 781           HB3      LYS 781  29.183  -2.273 -10.106
    5    HG2  LYS 781           HG2      LYS 781  30.674  -4.726 -10.860
    6    HG3  LYS 781           HG3      LYS 781  30.393  -3.344 -11.955
    7    HD2  LYS 781           HD2      LYS 781  32.020  -3.395  -9.389
    8    HD3  LYS 781           HD3      LYS 781  32.677  -3.334 -11.021
    9    HE2  LYS 781           HE2      LYS 781  31.533  -1.161 -11.349
   10    HE3  LYS 781           HE3      LYS 781  31.013  -1.233  -9.663
   11    HZ3  LYS 781           HZ1      LYS 781  32.953   0.086  -9.769
   12    HZ2  LYS 781           HZ2      LYS 781  33.765  -1.013 -10.711
   13    HZ1  LYS 781           HZ3      LYS 781  33.443  -1.381  -9.086

  No H/Q in entry =          13
  In of MODEL   43
    1    H    CYS 782           H        CYS 782  29.053  -2.103  -7.188
    2    HA   CYS 782           HA       CYS 782  26.599  -3.200  -6.093
    3    HB2  CYS 782           HB2      CYS 782  28.337  -2.456  -4.569
    4    HB3  CYS 782           HB3      CYS 782  28.192  -0.803  -5.161

  No H/Q in entry =           4
  In of MODEL   43
    1    H    ASP 783           H        ASP 783  24.644  -2.026  -5.894
    2    HA   ASP 783           HA       ASP 783  24.366   0.196  -7.763
    3    HB2  ASP 783           HB2      ASP 783  23.650  -1.916  -8.862
    4    HB3  ASP 783           HB3      ASP 783  22.495  -2.173  -7.558

  No H/Q in entry =           4
  In of MODEL   43
    1    H    ALA 784           H        ALA 784  22.692   1.643  -7.206
    2    HA   ALA 784           HA       ALA 784  22.360   1.878  -4.394
    3    HB3  ALA 784           HB1      ALA 784  21.144   3.540  -6.582
    4    HB1  ALA 784           HB2      ALA 784  22.716   3.825  -5.832
    5    HB2  ALA 784           HB3      ALA 784  21.240   3.964  -4.874

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLU 785           H        GLU 785  20.379   0.541  -6.924
    2    HA   GLU 785           HA       GLU 785  17.967   0.765  -5.406
    3    HB2  GLU 785           HB2      GLU 785  18.704  -0.780  -7.869
    4    HB3  GLU 785           HB3      GLU 785  17.105  -0.845  -7.139
    5    HG2  GLU 785           HG2      GLU 785  16.744   1.458  -7.617
    6    HG3  GLU 785           HG3      GLU 785  18.421   1.665  -8.130

  No H/Q in entry =           6
  In of MODEL   43
    1    H    SER 786           H        SER 786  17.225  -0.605  -4.002
    2    HA   SER 786           HA       SER 786  17.049  -2.217  -2.497
    3    HB2  SER 786           HB2      SER 786  17.305  -4.615  -3.279
    4    HB3  SER 786           HB3      SER 786  16.240  -3.619  -4.260
    5    HG   SER 786           HG       SER 786  18.642  -3.393  -5.309

  No H/Q in entry =           5
  In of MODEL   43
    1    H    SER 787           H        SER 787  19.886  -1.048  -3.114
    2    HA   SER 787           HA       SER 787  21.996  -1.122  -2.223
    3    HB2  SER 787           HB2      SER 787  20.660  -2.772  -0.057
    4    HB3  SER 787           HB3      SER 787  22.151  -1.834   0.098
    5    HG   SER 787           HG       SER 787  20.024  -0.430  -0.880

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LYS 788           H        LYS 788  21.345  -2.946  -4.135
    2    HA   LYS 788           HA       LYS 788  22.223  -5.619  -3.430
    3    HB2  LYS 788           HB2      LYS 788  20.271  -5.198  -4.794
    4    HB3  LYS 788           HB3      LYS 788  21.252  -4.322  -5.955
    5    HG2  LYS 788           HG2      LYS 788  22.522  -6.531  -6.248
    6    HG3  LYS 788           HG3      LYS 788  21.153  -7.274  -5.412
    7    HD2  LYS 788           HD2      LYS 788  19.627  -6.330  -7.076
    8    HD3  LYS 788           HD3      LYS 788  20.991  -5.589  -7.910
    9    HE2  LYS 788           HE2      LYS 788  20.481  -7.550  -9.100
   10    HE3  LYS 788           HE3      LYS 788  21.933  -7.899  -8.169
   11    HZ3  LYS 788           HZ1      LYS 788  20.428  -9.721  -8.036
   12    HZ2  LYS 788           HZ2      LYS 788  19.169  -8.730  -7.521
   13    HZ1  LYS 788           HZ3      LYS 788  20.446  -9.027  -6.489

  No H/Q in entry =          13
  In of MODEL   43
    1    H    CYS 789           H        CYS 789  23.985  -6.609  -4.557
    2    HA   CYS 789           HA       CYS 789  25.668  -4.848  -6.127
    3    HB2  CYS 789           HB2      CYS 789  26.794  -5.191  -3.985
    4    HB3  CYS 789           HB3      CYS 789  26.531  -6.922  -4.075

  No H/Q in entry =           4
  In of MODEL   43
    1    H    VAL 790           H        VAL 790  26.008  -5.618  -8.067
    2    HA   VAL 790           HA       VAL 790  24.970  -8.323  -8.579
    3    HB   VAL 790           HB       VAL 790  23.585  -6.501  -9.530
    4   HG11  VAL 790          HG11      VAL 790  25.984  -5.824 -11.212
    5   HG13  VAL 790          HG12      VAL 790  25.237  -4.818  -9.972
    6   HG12  VAL 790          HG13      VAL 790  24.358  -5.186 -11.457
    7   HG22  VAL 790          HG21      VAL 790  23.517  -8.659 -10.625
    8   HG21  VAL 790          HG22      VAL 790  24.917  -8.239 -11.606
    9   HG23  VAL 790          HG23      VAL 790  23.392  -7.383 -11.836

  No H/Q in entry =           9
  In of MODEL   43
    1    H    CYS 791           H        CYS 791  26.069  -9.594 -10.156
    2    HA   CYS 791           HA       CYS 791  28.878  -8.859 -10.276
    3    HB2  CYS 791           HB2      CYS 791  27.511 -11.512 -10.507
    4    HB3  CYS 791           HB3      CYS 791  29.218 -11.266 -10.841

  No H/Q in entry =           4
  In of MODEL   43
    1    H    ARG 792           H        ARG 792  29.951  -8.607 -11.943
    2    HA   ARG 792           HA       ARG 792  28.518  -8.127 -14.414
    3    HB2  ARG 792           HB2      ARG 792  31.220  -7.310 -13.392
    4    HB3  ARG 792           HB3      ARG 792  30.744  -7.057 -15.069
    5    HG2  ARG 792           HG2      ARG 792  29.330  -5.952 -12.649
    6    HG3  ARG 792           HG3      ARG 792  30.454  -5.060 -13.676
    7    HD2  ARG 792           HD2      ARG 792  28.966  -5.331 -15.582
    8    HD3  ARG 792           HD3      ARG 792  27.872  -6.314 -14.614
    9    HE   ARG 792           HE       ARG 792  28.439  -3.587 -13.785
   10   HH11  ARG 792          HH11      ARG 792  26.161  -5.879 -15.246
   11   HH12  ARG 792          HH12      ARG 792  24.783  -4.982 -14.865
   12   HH21  ARG 792          HH21      ARG 792  26.570  -2.329 -13.280
   13   HH22  ARG 792          HH22      ARG 792  25.015  -2.883 -13.710

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLU 793           H        GLU 793  30.070  -8.422 -16.381
    2    HA   GLU 793           HA       GLU 793  30.540 -11.259 -16.512
    3    HB2  GLU 793           HB2      GLU 793  30.610  -9.104 -18.621
    4    HB3  GLU 793           HB3      GLU 793  30.747 -10.830 -18.925
    5    HG2  GLU 793           HG2      GLU 793  28.509 -11.171 -17.998
    6    HG3  GLU 793           HG3      GLU 793  28.366  -9.437 -17.730

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ALA 794           H        ALA 794  32.564 -11.823 -17.959
    2    HA   ALA 794           HA       ALA 794  34.816 -11.141 -16.366
    3    HB2  ALA 794           HB1      ALA 794  34.455 -13.349 -17.445
    4    HB3  ALA 794           HB2      ALA 794  36.039 -12.658 -17.749
    5    HB1  ALA 794           HB3      ALA 794  34.794 -12.598 -19.007

  No H/Q in entry =           5
  In of MODEL   43
    1    H    SER 795           H        SER 795  33.647 -10.157 -19.496
    2    HA   SER 795           HA       SER 795  35.979  -8.775 -20.232
    3    HB2  SER 795           HB2      SER 795  33.160  -8.478 -21.267
    4    HB3  SER 795           HB3      SER 795  34.637  -7.983 -22.098
    5    HG   SER 795           HG       SER 795  34.692  -9.895 -22.854

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLU 796           H        GLU 796  33.894  -8.070 -17.790
    2    HA   GLU 796           HA       GLU 796  33.939  -5.153 -18.089
    3    HB2  GLU 796           HB2      GLU 796  32.593  -6.981 -16.105
    4    HB3  GLU 796           HB3      GLU 796  32.530  -5.227 -16.015
    5    HG2  GLU 796           HG2      GLU 796  31.489  -6.895 -18.289
    6    HG3  GLU 796           HG3      GLU 796  30.509  -6.200 -16.999

  No H/Q in entry =           6
  In of MODEL   43
    1    H    CYS 797           H        CYS 797  36.190  -7.083 -17.422
    2    HA   CYS 797           HA       CYS 797  36.999  -6.768 -14.763
    3    HB2  CYS 797           HB2      CYS 797  37.931  -8.437 -16.309
    4    HB3  CYS 797           HB3      CYS 797  38.721  -7.140 -17.209

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLU 798           H        GLU 798  36.956  -4.809 -13.980
    2    HA   GLU 798           HA       GLU 798  38.673  -2.730 -15.201
    3    HB2  GLU 798           HB2      GLU 798  37.245  -1.073 -14.038
    4    HB3  GLU 798           HB3      GLU 798  36.370  -2.033 -15.223
    5    HG2  GLU 798           HG2      GLU 798  35.362  -3.364 -13.507
    6    HG3  GLU 798           HG3      GLU 798  36.381  -2.633 -12.273

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU 799           H        GLU 799  38.106  -4.624 -12.408
    2    HA   GLU 799           HA       GLU 799  39.044  -2.791 -10.449
    3    HB2  GLU 799           HB2      GLU 799  37.440  -4.490  -9.892
    4    HB3  GLU 799           HB3      GLU 799  38.581  -5.754 -10.329
    5    HG2  GLU 799           HG2      GLU 799  38.558  -5.617  -7.962
    6    HG3  GLU 799           HG3      GLU 799  40.066  -4.943  -8.556

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLU 800           H        GLU 800  40.680  -5.271 -12.364
    2    HA   GLU 800           HA       GLU 800  42.608  -6.209 -12.296
    3    HB2  GLU 800           HB2      GLU 800  43.221  -3.437 -11.589
    4    HB3  GLU 800           HB3      GLU 800  44.520  -4.622 -11.442
    5    HG2  GLU 800           HG2      GLU 800  42.814  -4.557 -13.843
    6    HG3  GLU 800           HG3      GLU 800  44.117  -3.401 -13.664

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLY 801           H        GLY 801  42.009  -7.673 -11.040
    2    HA3  GLY 801           HA2      GLY 801  43.163  -7.910  -8.344
    3    HA2  GLY 801           HA3      GLY 801  42.249  -9.137  -9.217

  No H/Q in entry =           3
  In of MODEL   43
    1    H    PHE 802           H        PHE 802  43.603 -10.753  -9.070
    2    HA   PHE 802           HA       PHE 802  46.306 -10.546 -10.156
    3    HB2  PHE 802           HB2      PHE 802  44.803 -12.621  -8.603
    4    HB3  PHE 802           HB3      PHE 802  46.237 -13.081  -9.501
    5    HD1  PHE 802           HD1      PHE 802  47.527 -13.725  -7.646
    6    HD2  PHE 802           HD2      PHE 802  45.847  -9.825  -7.783
    7    HE1  PHE 802           HE1      PHE 802  48.960 -13.065  -5.813
    8    HE2  PHE 802           HE2      PHE 802  47.291  -9.136  -5.938
    9    HZ   PHE 802           HZ       PHE 802  48.865 -10.754  -4.930

  No H/Q in entry =           9
  In of MODEL   43
    1    H    SER 803           H        SER 803  46.797 -12.879 -11.280
    2    HA   SER 803           HA       SER 803  44.869 -13.256 -13.404
    3    HB2  SER 803           HB2      SER 803  47.885 -13.464 -13.643
    4    HB3  SER 803           HB3      SER 803  46.670 -13.476 -14.928
    5    HG   SER 803           HG       SER 803  47.388 -11.492 -14.997

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ILE 804           H        ILE 804  44.366 -15.491 -13.548
    2    HA   ILE 804           HA       ILE 804  46.048 -17.350 -12.014
    3    HB   ILE 804           HB       ILE 804  44.216 -18.335 -10.818
    4   HG12  ILE 804          HG12      ILE 804  42.447 -18.120 -12.575
    5   HG13  ILE 804          HG13      ILE 804  41.873 -17.671 -10.977
    6   HG23  ILE 804          HG21      ILE 804  43.402 -16.487  -9.397
    7   HG22  ILE 804          HG22      ILE 804  43.995 -15.347 -10.609
    8   HG21  ILE 804          HG23      ILE 804  45.136 -16.373  -9.739
    9   HD12  ILE 804          HD11      ILE 804  42.614 -15.793 -13.220
   10   HD11  ILE 804          HD12      ILE 804  42.106 -15.301 -11.607
   11   HD13  ILE 804          HD13      ILE 804  40.991 -16.178 -12.654

  No H/Q in entry =          11
  In of MODEL   43
    1    H    CYS 805           H        CYS 805  45.416 -19.661 -12.414
    2    HA   CYS 805           HA       CYS 805  44.816 -20.054 -15.231
    3    HB2  CYS 805           HB2      CYS 805  46.865 -21.062 -14.357
    4    HB3  CYS 805           HB3      CYS 805  45.933 -21.903 -13.124

  No H/Q in entry =           4
  In of MODEL   43
    1    H    VAL 806           H        VAL 806  42.654 -20.484 -15.609
    2    HA   VAL 806           HA       VAL 806  41.325 -22.232 -13.698
    3    HB   VAL 806           HB       VAL 806  40.527 -19.954 -13.343
    4   HG13  VAL 806          HG11      VAL 806  41.020 -19.010 -15.460
    5   HG12  VAL 806          HG12      VAL 806  39.311 -18.757 -15.085
    6   HG11  VAL 806          HG13      VAL 806  39.794 -20.008 -16.232
    7   HG21  VAL 806          HG21      VAL 806  38.881 -21.762 -13.058
    8   HG23  VAL 806          HG22      VAL 806  38.454 -21.634 -14.752
    9   HG22  VAL 806          HG23      VAL 806  38.110 -20.292 -13.657

  No H/Q in entry =           9
  In of MODEL   43
    1    H    GLU 807           H        GLU 807  40.062 -23.797 -14.507
    2    HA   GLU 807           HA       GLU 807  40.383 -24.446 -17.291
    3    HB2  GLU 807           HB2      GLU 807  40.680 -26.128 -15.516
    4    HB3  GLU 807           HB3      GLU 807  39.039 -25.836 -14.989
    5    HG2  GLU 807           HG2      GLU 807  38.305 -26.581 -17.277
    6    HG3  GLU 807           HG3      GLU 807  39.966 -27.110 -17.528

  No H/Q in entry =           6
  In of MODEL   43
    1    H    VAL 808           H        VAL 808  39.003 -23.424 -18.653
    2    HA   VAL 808           HA       VAL 808  36.203 -23.414 -18.033
    3    HB   VAL 808           HB       VAL 808  35.967 -21.466 -19.130
    4   HG12  VAL 808          HG11      VAL 808  38.394 -21.026 -17.432
    5   HG11  VAL 808          HG12      VAL 808  36.715 -21.054 -16.896
    6   HG13  VAL 808          HG13      VAL 808  37.284 -19.747 -17.937
    7   HG21  VAL 808          HG21      VAL 808  37.390 -21.749 -20.991
    8   HG23  VAL 808          HG22      VAL 808  38.842 -21.427 -20.030
    9   HG22  VAL 808          HG23      VAL 808  37.668 -20.130 -20.340

  No H/Q in entry =           9
  In of MODEL   43
    1    H    ASN 809           H        ASN 809  34.999 -24.031 -19.874
    2    HA   ASN 809           HA       ASN 809  34.535 -25.006 -21.811
    3    HB2  ASN 809           HB2      ASN 809  37.036 -23.577 -22.602
    4    HB3  ASN 809           HB3      ASN 809  36.323 -24.702 -23.741
    5   HD21  ASN 809          HD21      ASN 809  35.873 -21.727 -21.990
    6   HD22  ASN 809          HD22      ASN 809  34.576 -21.109 -22.950

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLY 810           H        GLY 810  36.518 -26.200 -19.767
    2    HA3  GLY 810           HA2      GLY 810  37.177 -28.442 -19.517
    3    HA2  GLY 810           HA3      GLY 810  37.143 -28.609 -21.271

  No H/Q in entry =           3
  In of MODEL   43
    1    H    LYS 811           H        LYS 811  38.727 -25.803 -20.861
    2    HA   LYS 811           HA       LYS 811  41.367 -27.139 -20.921
    3    HB2  LYS 811           HB2      LYS 811  40.466 -24.591 -22.246
    4    HB3  LYS 811           HB3      LYS 811  42.072 -25.294 -22.323
    5    HG2  LYS 811           HG2      LYS 811  41.235 -27.182 -23.559
    6    HG3  LYS 811           HG3      LYS 811  39.576 -26.599 -23.383
    7    HD2  LYS 811           HD2      LYS 811  40.451 -26.049 -25.583
    8    HD3  LYS 811           HD3      LYS 811  40.143 -24.589 -24.645
    9    HE2  LYS 811           HE2      LYS 811  42.528 -24.438 -24.087
   10    HE3  LYS 811           HE3      LYS 811  42.853 -25.898 -25.016
   11    HZ2  LYS 811           HZ1      LYS 811  41.945 -23.253 -26.018
   12    HZ1  LYS 811           HZ2      LYS 811  41.953 -24.646 -26.970
   13    HZ3  LYS 811           HZ3      LYS 811  43.387 -24.048 -26.370

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLU 812           H        GLU 812  43.105 -25.977 -19.958
    2    HA   GLU 812           HA       GLU 812  42.250 -24.092 -17.899
    3    HB2  GLU 812           HB2      GLU 812  44.850 -25.572 -18.319
    4    HB3  GLU 812           HB3      GLU 812  44.601 -24.376 -17.053
    5    HG2  GLU 812           HG2      GLU 812  42.861 -25.734 -16.062
    6    HG3  GLU 812           HG3      GLU 812  43.009 -26.914 -17.363

  No H/Q in entry =           6
  In of MODEL   43
    1    H    GLN 813           H        GLN 813  42.467 -22.060 -18.095
    2    HA   GLN 813           HA       GLN 813  44.360 -20.921 -20.026
    3    HB2  GLN 813           HB2      GLN 813  42.245 -21.057 -21.161
    4    HB3  GLN 813           HB3      GLN 813  41.398 -20.402 -19.772
    5    HG2  GLN 813           HG2      GLN 813  42.563 -18.277 -20.106
    6    HG3  GLN 813           HG3      GLN 813  43.341 -18.901 -21.547
    7   HE21  GLN 813          HE21      GLN 813  41.508 -16.669 -21.225
    8   HE22  GLN 813          HE22      GLN 813  40.153 -16.979 -22.235

  No H/Q in entry =           8
  In of MODEL   43
    1    H    THR 814           H        THR 814  45.117 -18.913 -19.403
    2    HA   THR 814           HA       THR 814  44.595 -18.140 -16.636
    3    HB   THR 814           HB       THR 814  46.365 -16.903 -18.665
    4    HG1  THR 814           HG1      THR 814  47.015 -19.004 -18.295
    5   HG23  THR 814          HG21      THR 814  47.592 -15.990 -16.682
    6   HG22  THR 814          HG22      THR 814  46.371 -16.728 -15.649
    7   HG21  THR 814          HG23      THR 814  45.914 -15.446 -16.770

  No H/Q in entry =           7
  In of MODEL   43
    1    H    MET 815           H        MET 815  43.249 -16.654 -16.211
    2    HA   MET 815           HA       MET 815  42.861 -14.491 -18.096
    3    HB2  MET 815           HB2      MET 815  40.432 -14.428 -17.323
    4    HB3  MET 815           HB3      MET 815  40.845 -15.684 -18.475
    5    HG2  MET 815           HG2      MET 815  41.157 -17.176 -16.641
    6    HG3  MET 815           HG3      MET 815  40.499 -16.006 -15.516
    7    HE1  MET 815           HE1      MET 815  39.693 -17.172 -19.201
    8    HE3  MET 815           HE2      MET 815  38.297 -18.213 -18.907
    9    HE2  MET 815           HE3      MET 815  39.863 -18.610 -18.195

  No H/Q in entry =           9
  In of MODEL   43
    1    H    SER 816           H        SER 816  41.476 -12.787 -16.804
    2    HA   SER 816           HA       SER 816  43.157 -12.016 -14.617
    3    HB2  SER 816           HB2      SER 816  40.585 -10.876 -15.635
    4    HB3  SER 816           HB3      SER 816  41.828  -9.996 -14.719
    5    HG   SER 816           HG       SER 816  41.790 -10.913 -17.371

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLU 817           H        GLU 817  42.375 -11.623 -12.541
    2    HA   GLU 817           HA       GLU 817  40.836 -13.659 -11.418
    3    HB2  GLU 817           HB2      GLU 817  42.623 -11.917 -10.466
    4    HB3  GLU 817           HB3      GLU 817  41.126 -11.079 -10.123
    5    HG2  GLU 817           HG2      GLU 817  40.325 -12.640  -8.721
    6    HG3  GLU 817           HG3      GLU 817  41.438 -13.875  -9.330

  No H/Q in entry =           6
  In of MODEL   43
    1    H    CYS 818           H        CYS 818  39.976 -10.528 -12.639
    2    HA   CYS 818           HA       CYS 818  37.507 -10.387 -11.168
    3    HB2  CYS 818           HB2      CYS 818  38.330  -8.759 -13.586
    4    HB3  CYS 818           HB3      CYS 818  37.060  -8.363 -12.432

  No H/Q in entry =           4
  In of MODEL   43
    1    H    GLU 819           H        GLU 819  38.750 -11.391 -14.173
    2    HA   GLU 819           HA       GLU 819  36.411 -11.800 -15.622
    3    HB2  GLU 819           HB2      GLU 819  39.183 -12.646 -15.680
    4    HB3  GLU 819           HB3      GLU 819  38.169 -13.564 -16.711
    5    HG2  GLU 819           HG2      GLU 819  37.515 -11.310 -17.700
    6    HG3  GLU 819           HG3      GLU 819  38.865 -10.645 -16.776

  No H/Q in entry =           6
  In of MODEL   43
    1    H    ALA 820           H        ALA 820  38.603 -14.244 -14.294
    2    HA   ALA 820           HA       ALA 820  36.963 -16.425 -14.548
    3    HB3  ALA 820           HB1      ALA 820  39.006 -16.004 -12.392
    4    HB1  ALA 820           HB2      ALA 820  39.327 -16.590 -14.030
    5    HB2  ALA 820           HB3      ALA 820  38.368 -17.562 -12.914

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLY 821           H        GLY 821  37.235 -14.180 -11.846
    2    HA3  GLY 821           HA2      GLY 821  35.658 -15.585 -10.002
    3    HA2  GLY 821           HA3      GLY 821  36.027 -13.867  -9.951

  No H/Q in entry =           3
  In of MODEL   43
    1    H    ALA 822           H        ALA 822  34.863 -13.130 -12.435
    2    HA   ALA 822           HA       ALA 822  32.220 -12.700 -11.619
    3    HB1  ALA 822           HB1      ALA 822  33.388 -12.442 -14.394
    4    HB2  ALA 822           HB2      ALA 822  33.427 -11.202 -13.137
    5    HB3  ALA 822           HB3      ALA 822  31.884 -11.721 -13.806

  No H/Q in entry =           5
  In of MODEL   43
    1    H    LEU 823           H        LEU 823  33.646 -14.962 -13.914
    2    HA   LEU 823           HA       LEU 823  31.299 -16.051 -14.926
    3    HB2  LEU 823           HB2      LEU 823  33.987 -17.322 -14.531
    4    HB3  LEU 823           HB3      LEU 823  32.681 -18.253 -15.191
    5    HG   LEU 823           HG       LEU 823  33.706 -17.654 -17.096
    6   HD13  LEU 823          HD11      LEU 823  32.665 -15.823 -18.262
    7   HD12  LEU 823          HD12      LEU 823  32.014 -15.226 -16.740
    8   HD11  LEU 823          HD13      LEU 823  31.512 -16.803 -17.355
    9   HD23  LEU 823          HD21      LEU 823  34.937 -15.561 -17.523
   10   HD22  LEU 823          HD22      LEU 823  35.554 -16.468 -16.149
   11   HD21  LEU 823          HD23      LEU 823  34.563 -15.037 -15.883

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ARG 824           H        ARG 824  32.896 -16.817 -11.885
    2    HA   ARG 824           HA       ARG 824  31.508 -19.116 -11.152
    3    HB2  ARG 824           HB2      ARG 824  32.596 -16.900  -9.451
    4    HB3  ARG 824           HB3      ARG 824  32.109 -18.486  -8.877
    5    HG2  ARG 824           HG2      ARG 824  33.888 -19.531 -10.049
    6    HG3  ARG 824           HG3      ARG 824  34.315 -18.013 -10.867
    7    HD2  ARG 824           HD2      ARG 824  35.768 -18.549  -8.982
    8    HD3  ARG 824           HD3      ARG 824  34.885 -17.035  -8.781
    9    HE   ARG 824           HE       ARG 824  33.734 -19.443  -7.665
   10   HH11  ARG 824          HH11      ARG 824  35.169 -16.281  -7.013
   11   HH12  ARG 824          HH12      ARG 824  35.117 -16.461  -5.315
   12   HH21  ARG 824          HH21      ARG 824  33.601 -19.603  -5.301
   13   HH22  ARG 824          HH22      ARG 824  34.288 -18.339  -4.339

  No H/Q in entry =          13
  In of MODEL   43
    1    H    CYS 825           H        CYS 825  30.623 -15.678 -10.788
    2    HA   CYS 825           HA       CYS 825  28.458 -16.449  -8.986
    3    HB2  CYS 825           HB2      CYS 825  29.874 -14.166  -8.756
    4    HB3  CYS 825           HB3      CYS 825  28.844 -13.718 -10.077

  No H/Q in entry =           4
  In of MODEL   43
    1    H    ARG 826           H        ARG 826  29.168 -15.553 -12.189
    2    HA   ARG 826           HA       ARG 826  26.670 -14.810 -13.095
    3    HB2  ARG 826           HB2      ARG 826  28.747 -14.282 -14.223
    4    HB3  ARG 826           HB3      ARG 826  29.054 -15.997 -14.480
    5    HG2  ARG 826           HG2      ARG 826  27.015 -16.146 -15.701
    6    HG3  ARG 826           HG3      ARG 826  26.833 -14.386 -15.479
    7    HD2  ARG 826           HD2      ARG 826  28.755 -13.927 -16.808
    8    HD3  ARG 826           HD3      ARG 826  29.227 -15.632 -16.828
    9    HE   ARG 826           HE       ARG 826  27.057 -15.955 -18.035
   10   HH11  ARG 826          HH11      ARG 826  29.049 -13.083 -18.428
   11   HH12  ARG 826          HH12      ARG 826  28.416 -12.639 -19.937
   12   HH21  ARG 826          HH21      ARG 826  26.249 -15.447 -20.153
   13   HH22  ARG 826          HH22      ARG 826  26.808 -14.066 -20.974

  No H/Q in entry =          13
  In of MODEL   43
    1    H    GLY 827           H        GLY 827  28.438 -17.910 -13.255
    2    HA3  GLY 827           HA2      GLY 827  26.844 -19.863 -12.782
    3    HA2  GLY 827           HA3      GLY 827  25.878 -19.118 -14.052

  No H/Q in entry =           3
  In of MODEL   43
    1    H    GLN 828           H        GLN 828  29.007 -18.666 -14.900
    2    HA   GLN 828           HA       GLN 828  28.919 -20.721 -16.890
    3    HB2  GLN 828           HB2      GLN 828  29.917 -18.532 -17.365
    4    HB3  GLN 828           HB3      GLN 828  31.076 -18.765 -16.075
    5    HG2  GLN 828           HG2      GLN 828  32.158 -19.146 -18.228
    6    HG3  GLN 828           HG3      GLN 828  32.048 -20.645 -17.322
    7   HE21  GLN 828          HE21      GLN 828  30.696 -18.859 -19.978
    8   HE22  GLN 828          HE22      GLN 828  29.999 -20.221 -20.774

  No H/Q in entry =           8
  In of MODEL   43
    1    H    SER 829           H        SER 829  30.039 -22.625 -16.849
    2    HA   SER 829           HA       SER 829  30.886 -23.519 -14.250
    3    HB2  SER 829           HB2      SER 829  30.873 -24.979 -16.901
    4    HB3  SER 829           HB3      SER 829  31.019 -25.713 -15.299
    5    HG   SER 829           HG       SER 829  28.823 -24.143 -16.148

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ILE 830           H        ILE 830  32.846 -22.949 -13.596
    2    HA   ILE 830           HA       ILE 830  35.124 -23.409 -15.363
    3    HB   ILE 830           HB       ILE 830  36.277 -21.391 -14.730
    4   HG12  ILE 830          HG12      ILE 830  35.444 -21.172 -12.368
    5   HG13  ILE 830          HG13      ILE 830  35.438 -19.638 -13.187
    6   HG21  ILE 830          HG21      ILE 830  34.742 -21.127 -16.598
    7   HG23  ILE 830          HG22      ILE 830  34.933 -19.618 -15.707
    8   HG22  ILE 830          HG23      ILE 830  33.482 -20.594 -15.486
    9   HD13  ILE 830          HD11      ILE 830  33.449 -19.844 -11.898
   10   HD12  ILE 830          HD12      ILE 830  33.073 -21.391 -12.649
   11   HD11  ILE 830          HD13      ILE 830  33.022 -19.911 -13.607

  No H/Q in entry =          11
  In of MODEL   43
    1    H    SER 831           H        SER 831  37.003 -23.973 -14.258
    2    HA   SER 831           HA       SER 831  36.641 -24.589 -11.415
    3    HB2  SER 831           HB2      SER 831  37.898 -26.185 -13.609
    4    HB3  SER 831           HB3      SER 831  38.081 -26.546 -11.903
    5    HG   SER 831           HG       SER 831  36.407 -27.769 -12.715

  No H/Q in entry =           5
  In of MODEL   43
    1    H    VAL 832           H        VAL 832  38.032 -23.235 -10.357
    2    HA   VAL 832           HA       VAL 832  40.402 -22.265 -11.676
    3    HB   VAL 832           HB       VAL 832  39.584 -21.993  -8.771
    4   HG11  VAL 832          HG11      VAL 832  41.984 -21.645  -9.103
    5   HG13  VAL 832          HG12      VAL 832  41.193 -20.119  -8.699
    6   HG12  VAL 832          HG13      VAL 832  41.650 -20.464 -10.368
    7   HG23  VAL 832          HG21      VAL 832  39.215 -20.061 -11.060
    8   HG22  VAL 832          HG22      VAL 832  38.843 -19.721  -9.369
    9   HG21  VAL 832          HG23      VAL 832  37.941 -20.963 -10.241

  No H/Q in entry =           9
  In of MODEL   43
    1    H    THR 833           H        THR 833  41.864 -23.781 -12.094
    2    HA   THR 833           HA       THR 833  42.268 -25.973 -10.362
    3    HB   THR 833           HB       THR 833  44.092 -26.491 -12.041
    4    HG1  THR 833           HG1      THR 833  44.216 -25.199 -13.853
    5   HG23  THR 833          HG21      THR 833  42.516 -27.065 -13.832
    6   HG22  THR 833          HG22      THR 833  41.338 -25.944 -13.156
    7   HG21  THR 833          HG23      THR 833  41.795 -27.384 -12.251

  No H/Q in entry =           7
  In of MODEL   43
    1    H    SER 834           H        SER 834  43.991 -23.033 -11.214
    2    HA   SER 834           HA       SER 834  45.595 -23.394  -8.823
    3    HB2  SER 834           HB2      SER 834  46.676 -22.858 -11.577
    4    HB3  SER 834           HB3      SER 834  47.624 -22.674 -10.110
    5    HG   SER 834           HG       SER 834  46.950 -24.890 -11.491

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ILE 835           H        ILE 835  46.166 -21.561  -7.828
    2    HA   ILE 835           HA       ILE 835  44.795 -19.147  -8.600
    3    HB   ILE 835           HB       ILE 835  45.647 -18.209  -6.499
    4   HG12  ILE 835          HG12      ILE 835  47.234 -20.788  -6.253
    5   HG13  ILE 835          HG13      ILE 835  47.881 -19.159  -6.495
    6   HG23  ILE 835          HG21      ILE 835  43.649 -19.581  -6.359
    7   HG22  ILE 835          HG22      ILE 835  44.640 -19.828  -4.910
    8   HG21  ILE 835          HG23      ILE 835  44.638 -21.032  -6.196
    9   HD12  ILE 835          HD11      ILE 835  46.402 -20.125  -4.106
   10   HD11  ILE 835          HD12      ILE 835  47.078 -18.511  -4.351
   11   HD13  ILE 835          HD13      ILE 835  48.146 -19.913  -4.250

  No H/Q in entry =          11
  In of MODEL   43
    1    H    ARG 836           H        ARG 836  47.627 -20.660  -9.267
    2    HA   ARG 836           HA       ARG 836  49.291 -18.361  -9.818
    3    HB2  ARG 836           HB2      ARG 836  49.572 -21.301 -10.351
    4    HB3  ARG 836           HB3      ARG 836  50.740 -20.105 -10.890
    5    HG2  ARG 836           HG2      ARG 836  51.214 -19.482  -8.645
    6    HG3  ARG 836           HG3      ARG 836  49.942 -20.549  -8.035
    7    HD2  ARG 836           HD2      ARG 836  52.403 -21.378  -9.551
    8    HD3  ARG 836           HD3      ARG 836  52.124 -21.470  -7.799
    9    HE   ARG 836           HE       ARG 836  50.304 -23.024  -8.277
   10   HH11  ARG 836          HH11      ARG 836  52.925 -22.758 -10.639
   11   HH12  ARG 836          HH12      ARG 836  52.573 -24.210 -11.443
   12   HH21  ARG 836          HH21      ARG 836  49.835 -25.082  -9.345
   13   HH22  ARG 836          HH22      ARG 836  50.754 -25.574 -10.681

  No H/Q in entry =          13
  In of MODEL   43
    1    HA   PRO 837           HA       PRO 837  47.607 -18.161 -14.010
    2    HB2  PRO 837           HB2      PRO 837  49.531 -16.634 -15.161
    3    HB3  PRO 837           HB3      PRO 837  48.330 -15.948 -14.064
    4    HG2  PRO 837           HG2      PRO 837  51.174 -16.695 -13.536
    5    HG3  PRO 837           HG3      PRO 837  50.257 -15.291 -12.956
    6    HD2  PRO 837           HD2      PRO 837  50.746 -17.516 -11.445
    7    HD3  PRO 837           HD3      PRO 837  49.337 -16.461 -11.215

  No H/Q in entry =           7
  In of MODEL   43
    1    H    CYS 838           H        CYS 838  47.962 -19.362 -15.938
    2    HA   CYS 838           HA       CYS 838  50.308 -21.017 -15.790
    3    HB2  CYS 838           HB2      CYS 838  49.192 -22.460 -17.543
    4    HB3  CYS 838           HB3      CYS 838  48.269 -22.358 -16.057

  No H/Q in entry =           4
  In of MODEL   43
    1    H    ALA 839           H        ALA 839  50.913 -21.640 -18.398
    2    HA   ALA 839           HA       ALA 839  51.694 -19.075 -19.522
    3    HB2  ALA 839           HB1      ALA 839  52.312 -21.891 -20.431
    4    HB1  ALA 839           HB2      ALA 839  53.340 -20.899 -19.397
    5    HB3  ALA 839           HB3      ALA 839  53.039 -20.416 -21.067

  No H/Q in entry =           5
  In of MODEL   43
    1    H    ALA 840           H        ALA 840  49.086 -21.008 -19.689
    2    HA   ALA 840           HA       ALA 840  48.497 -20.753 -22.474
    3    HB3  ALA 840           HB1      ALA 840  46.838 -21.634 -20.136
    4    HB2  ALA 840           HB2      ALA 840  47.668 -22.688 -21.284
    5    HB1  ALA 840           HB3      ALA 840  46.304 -21.680 -21.814

  No H/Q in entry =           5
  In of MODEL   43
    1    H    GLU 841           H        GLU 841  48.651 -18.577 -22.745
    2    HA   GLU 841           HA       GLU 841  46.737 -16.842 -21.460
    3    HB2  GLU 841           HB2      GLU 841  48.806 -16.373 -23.609
    4    HB3  GLU 841           HB3      GLU 841  47.743 -15.100 -23.020
    5    HG2  GLU 841           HG2      GLU 841  49.650 -16.634 -21.272
    6    HG3  GLU 841           HG3      GLU 841  50.058 -15.122 -22.084

  No H/Q in entry =           6
  In of MODEL   43
    1    H    THR 842           H        THR 842  47.079 -18.757 -24.180
    2    HA   THR 842           HA       THR 842  45.295 -17.454 -25.962
    3    HB   THR 842           HB       THR 842  45.610 -19.828 -27.058
    4    HG1  THR 842           HG1      THR 842  46.630 -20.967 -25.561
    5   HG21  THR 842          HG21      THR 842  47.859 -17.816 -26.768
    6   HG23  THR 842          HG22      THR 842  46.542 -17.719 -27.939
    7   HG22  THR 842          HG23      THR 842  47.724 -19.024 -28.046

  No H/Q in entry =           7
  In of MODEL   43
    1    H    GLN 843           H        GLN 843  43.306 -18.251 -26.644
    2    HA   GLN 843           HA       GLN 843  41.755 -19.557 -24.564
    3    HB2  GLN 843           HB2      GLN 843  40.890 -18.181 -27.113
    4    HB3  GLN 843           HB3      GLN 843  39.824 -18.771 -25.847
    5    HG2  GLN 843           HG2      GLN 843  40.719 -17.160 -24.289
    6    HG3  GLN 843           HG3      GLN 843  41.892 -16.619 -25.490
    7   HE21  GLN 843          HE21      GLN 843  38.572 -16.547 -24.506
    8   HE22  GLN 843          HE22      GLN 843  38.093 -15.296 -25.601

  No H/Q in entry =           8
  In of MODEL   44
    1    H1   GLY 689           H3       GLY 689  78.720  -4.149 -11.719
    2    H2   GLY 689           H2       GLY 689  78.524  -4.204 -10.050
    3    H3   GLY 689           H1       GLY 689  79.559  -3.066 -10.722
    4    HA2  GLY 689           HA2      GLY 689  80.781  -4.911  -9.742
    5    HA3  GLY 689           HA3      GLY 689  81.023  -4.815 -11.485

  No H/Q in entry =           5
  In of MODEL   44
    1    H    SER 690           H        SER 690  80.911  -7.112  -9.364
    2    HA   SER 690           HA       SER 690  79.604  -8.913 -11.177
    3    HB2  SER 690           HB2      SER 690  81.043  -9.470  -8.577
    4    HB3  SER 690           HB3      SER 690  80.593 -10.654  -9.803
    5    HG   SER 690           HG       SER 690  81.866  -8.974 -11.172

  No H/Q in entry =           5
  In of MODEL   44
    1    H    HIS 691           H        HIS 691  77.535  -9.299 -11.028
    2    HA   HIS 691           HA       HIS 691  76.339  -9.796  -8.466
    3    HB2  HIS 691           HB2      HIS 691  74.262  -8.432  -9.091
    4    HB3  HIS 691           HB3      HIS 691  75.679  -7.510  -8.621
    5    HD1  HIS 691           HD1      HIS 691  73.304  -8.028 -11.442
    6    HD2  HIS 691           HD2      HIS 691  76.883  -6.052 -10.729
    7    HE1  HIS 691           HE1      HIS 691  73.575  -6.424 -13.317
    8    HE2  HIS 691           HE2      HIS 691  75.895  -5.520 -13.019

  No H/Q in entry =           8
  In of MODEL   44
    1    H    MET 692           H        MET 692  74.513 -11.141  -8.548
    2    HA   MET 692           HA       MET 692  74.954 -13.030 -10.625
    3    HB2  MET 692           HB2      MET 692  74.625 -13.725  -8.282
    4    HB3  MET 692           HB3      MET 692  72.954 -13.194  -8.375
    5    HG2  MET 692           HG2      MET 692  72.421 -14.875  -9.966
    6    HG3  MET 692           HG3      MET 692  74.120 -15.298 -10.174
    7    HE1  MET 692           HE1      MET 692  73.511 -17.863  -9.841
    8    HE3  MET 692           HE2      MET 692  71.814 -17.434  -9.628
    9    HE2  MET 692           HE3      MET 692  72.614 -18.483  -8.455

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ASN 693           H        ASN 693  72.061 -11.122  -9.743
    2    HA   ASN 693           HA       ASN 693  70.829 -12.030 -12.213
    3    HB2  ASN 693           HB2      ASN 693  69.828 -10.057 -10.135
    4    HB3  ASN 693           HB3      ASN 693  68.929 -10.494 -11.578
    5   HD21  ASN 693          HD21      ASN 693  67.960 -12.542 -11.670
    6   HD22  ASN 693          HD22      ASN 693  67.757 -13.507 -10.256

  No H/Q in entry =           6
  In of MODEL   44
    1    HA   PRO 694           HA       PRO 694  72.593  -8.616 -14.440
    2    HB2  PRO 694           HB2      PRO 694  70.255  -8.720 -16.233
    3    HB3  PRO 694           HB3      PRO 694  71.958  -9.007 -16.600
    4    HG2  PRO 694           HG2      PRO 694  70.190 -11.018 -16.552
    5    HG3  PRO 694           HG3      PRO 694  71.856 -11.227 -15.987
    6    HD2  PRO 694           HD2      PRO 694  69.358 -10.808 -14.394
    7    HD3  PRO 694           HD3      PRO 694  70.704 -11.943 -14.129

  No H/Q in entry =           7
  In of MODEL   44
    1    H    LEU 695           H        LEU 695  72.221  -6.399 -14.879
    2    HA   LEU 695           HA       LEU 695  70.052  -5.305 -13.285
    3    HB2  LEU 695           HB2      LEU 695  71.132  -3.181 -13.348
    4    HB3  LEU 695           HB3      LEU 695  72.379  -4.356 -13.038
    5    HG   LEU 695           HG       LEU 695  71.884  -2.989 -15.698
    6   HD13  LEU 695          HD11      LEU 695  72.654  -1.417 -14.046
    7   HD12  LEU 695          HD12      LEU 695  73.951  -1.765 -15.193
    8   HD11  LEU 695          HD13      LEU 695  73.970  -2.497 -13.590
    9   HD22  LEU 695          HD21      LEU 695  72.945  -5.169 -15.989
   10   HD21  LEU 695          HD22      LEU 695  74.172  -4.741 -14.795
   11   HD23  LEU 695          HD23      LEU 695  74.089  -3.871 -16.325

  No H/Q in entry =          11
  In of MODEL   44
    1    H    THR 696           H        THR 696  68.883  -3.396 -14.240
    2    HA   THR 696           HA       THR 696  68.639  -3.494 -17.100
    3    HB   THR 696           HB       THR 696  67.005  -5.163 -16.431
    4    HG1  THR 696           HG1      THR 696  65.262  -3.028 -16.823
    5   HG21  THR 696          HG21      THR 696  65.863  -3.075 -14.577
    6   HG23  THR 696          HG22      THR 696  66.695  -4.552 -14.098
    7   HG22  THR 696          HG23      THR 696  65.132  -4.641 -14.919

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLN 697           H        GLN 697  68.137  -1.555 -17.908
    2    HA   GLN 697           HA       GLN 697  68.099   0.649 -16.012
    3    HB2  GLN 697           HB2      GLN 697  68.356   0.680 -19.032
    4    HB3  GLN 697           HB3      GLN 697  68.418   2.104 -18.008
    5    HG2  GLN 697           HG2      GLN 697  70.660   1.589 -18.556
    6    HG3  GLN 697           HG3      GLN 697  70.429   1.103 -16.884
    7   HE21  GLN 697          HE21      GLN 697  69.388  -0.700 -19.738
    8   HE22  GLN 697          HE22      GLN 697  70.405  -2.056 -19.505

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ALA 698           H        ALA 698  66.193  -0.873 -18.389
    2    HA   ALA 698           HA       ALA 698  63.883   0.910 -18.060
    3    HB3  ALA 698           HB1      ALA 698  62.771  -0.663 -19.543
    4    HB1  ALA 698           HB2      ALA 698  64.137  -1.770 -19.441
    5    HB2  ALA 698           HB3      ALA 698  64.321  -0.213 -20.254

  No H/Q in entry =           5
  In of MODEL   44
    1    H    VAL 699           H        VAL 699  61.982   0.298 -17.213
    2    HA   VAL 699           HA       VAL 699  62.349  -0.660 -14.692
    3    HB   VAL 699           HB       VAL 699  59.954  -0.470 -14.510
    4   HG11  VAL 699          HG11      VAL 699  61.292   1.843 -15.894
    5   HG13  VAL 699          HG12      VAL 699  61.311   1.490 -14.166
    6   HG12  VAL 699          HG13      VAL 699  59.805   1.967 -14.952
    7   HG23  VAL 699          HG21      VAL 699  58.599   0.430 -16.399
    8   HG22  VAL 699          HG22      VAL 699  59.201  -1.200 -16.695
    9   HG21  VAL 699          HG23      VAL 699  59.988   0.177 -17.459

  No H/Q in entry =           9
  In of MODEL   44
    1    HA   PRO 700           HA       PRO 700  61.896  -4.987 -15.558
    2    HB2  PRO 700           HB2      PRO 700  62.140  -5.756 -12.902
    3    HB3  PRO 700           HB3      PRO 700  63.470  -5.586 -14.043
    4    HG2  PRO 700           HG2      PRO 700  62.756  -3.900 -11.777
    5    HG3  PRO 700           HG3      PRO 700  64.239  -3.915 -12.732
    6    HD2  PRO 700           HD2      PRO 700  62.097  -2.022 -12.851
    7    HD3  PRO 700           HD3      PRO 700  63.572  -2.075 -13.830

  No H/Q in entry =           7
  In of MODEL   44
    1    H    LYS 701           H        LYS 701  60.115  -6.117 -15.675
    2    HA   LYS 701           HA       LYS 701  57.839  -5.220 -14.131
    3    HB2  LYS 701           HB2      LYS 701  57.959  -7.264 -16.366
    4    HB3  LYS 701           HB3      LYS 701  56.490  -6.653 -15.621
    5    HG2  LYS 701           HG2      LYS 701  58.472  -5.066 -17.260
    6    HG3  LYS 701           HG3      LYS 701  56.861  -5.568 -17.763
    7    HD2  LYS 701           HD2      LYS 701  57.437  -3.692 -15.450
    8    HD3  LYS 701           HD3      LYS 701  57.017  -3.176 -17.074
    9    HE2  LYS 701           HE2      LYS 701  55.247  -4.936 -15.368
   10    HE3  LYS 701           HE3      LYS 701  55.115  -3.182 -15.435
   11    HZ1  LYS 701           HZ1      LYS 701  54.677  -3.347 -17.799
   12    HZ3  LYS 701           HZ2      LYS 701  53.536  -4.206 -16.937
   13    HZ2  LYS 701           HZ3      LYS 701  54.753  -5.026 -17.753

  No H/Q in entry =          13
  In of MODEL   44
    1    H    CYS 702           H        CYS 702  57.028  -6.276 -12.510
    2    HA   CYS 702           HA       CYS 702  58.511  -8.624 -11.598
    3    HB2  CYS 702           HB2      CYS 702  56.653  -6.817 -10.047
    4    HB3  CYS 702           HB3      CYS 702  57.815  -7.974  -9.411

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLN 703           H        GLN 703  57.057 -10.101 -10.210
    2    HA   GLN 703           HA       GLN 703  54.858 -10.947 -11.794
    3    HB2  GLN 703           HB2      GLN 703  55.916 -11.836  -9.120
    4    HB3  GLN 703           HB3      GLN 703  54.557 -12.599  -9.927
    5    HG2  GLN 703           HG2      GLN 703  57.333 -12.388 -11.082
    6    HG3  GLN 703           HG3      GLN 703  56.712 -13.789 -10.213
    7   HE21  GLN 703          HE21      GLN 703  56.942 -15.138 -11.960
    8   HE22  GLN 703          HE22      GLN 703  55.927 -15.069 -13.354

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ARG 704           H        ARG 704  52.832 -11.524 -10.553
    2    HA   ARG 704           HA       ARG 704  51.573  -9.037 -10.133
    3    HB2  ARG 704           HB2      ARG 704  50.583 -11.867  -9.865
    4    HB3  ARG 704           HB3      ARG 704  49.538 -10.456  -9.744
    5    HG2  ARG 704           HG2      ARG 704  49.942  -9.832 -11.962
    6    HG3  ARG 704           HG3      ARG 704  51.296 -10.959 -12.115
    7    HD2  ARG 704           HD2      ARG 704  49.711 -12.825 -11.950
    8    HD3  ARG 704           HD3      ARG 704  48.382 -11.671 -11.810
    9    HE   ARG 704           HE       ARG 704  48.632 -11.091 -14.050
   10   HH11  ARG 704          HH11      ARG 704  51.070 -13.543 -13.196
   11   HH12  ARG 704          HH12      ARG 704  51.393 -13.947 -14.816
   12   HH21  ARG 704          HH21      ARG 704  49.105 -11.685 -16.238
   13   HH22  ARG 704          HH22      ARG 704  50.317 -12.840 -16.562

  No H/Q in entry =          13
  In of MODEL   44
    1    H    TRP 705           H        TRP 705  52.959 -11.281  -7.930
    2    HA   TRP 705           HA       TRP 705  51.683 -10.012  -5.618
    3    HB2  TRP 705           HB2      TRP 705  52.651 -11.935  -4.381
    4    HB3  TRP 705           HB3      TRP 705  51.558 -12.385  -5.696
    5    HD1  TRP 705           HD1      TRP 705  55.271 -12.492  -4.747
    6    HE1  TRP 705           HE1      TRP 705  56.456 -14.157  -6.287
    7    HE3  TRP 705           HE3      TRP 705  51.429 -13.511  -7.938
    8    HZ2  TRP 705           HZ2      TRP 705  55.849 -15.716  -8.556
    9    HZ3  TRP 705           HZ3      TRP 705  51.811 -15.092  -9.763
   10    HH2  TRP 705           HH2      TRP 705  53.974 -16.183 -10.066

  No H/Q in entry =          10
  In of MODEL   44
    1    H    GLU 706           H        GLU 706  54.010  -9.126  -7.463
    2    HA   GLU 706           HA       GLU 706  55.895  -8.570  -5.310
    3    HB2  GLU 706           HB2      GLU 706  56.397  -8.981  -8.253
    4    HB3  GLU 706           HB3      GLU 706  57.609  -8.359  -7.130
    5    HG2  GLU 706           HG2      GLU 706  57.456 -10.506  -5.918
    6    HG3  GLU 706           HG3      GLU 706  56.319 -11.080  -7.140

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LYS 707           H        LYS 707  57.157  -6.533  -5.823
    2    HA   LYS 707           HA       LYS 707  55.641  -4.599  -7.342
    3    HB2  LYS 707           HB2      LYS 707  55.763  -2.896  -5.563
    4    HB3  LYS 707           HB3      LYS 707  54.803  -4.276  -5.054
    5    HG2  LYS 707           HG2      LYS 707  56.511  -5.041  -3.601
    6    HG3  LYS 707           HG3      LYS 707  57.698  -3.955  -4.317
    7    HD2  LYS 707           HD2      LYS 707  56.991  -3.094  -2.155
    8    HD3  LYS 707           HD3      LYS 707  56.445  -2.034  -3.451
    9    HE2  LYS 707           HE2      LYS 707  54.215  -3.063  -3.318
   10    HE3  LYS 707           HE3      LYS 707  54.776  -4.070  -1.986
   11    HZ2  LYS 707           HZ1      LYS 707  54.593  -1.105  -1.966
   12    HZ1  LYS 707           HZ2      LYS 707  55.188  -2.054  -0.700
   13    HZ3  LYS 707           HZ3      LYS 707  53.578  -2.197  -1.175

  No H/Q in entry =          13
  In of MODEL   44
    1    H    LEU 708           H        LEU 708  56.892  -2.782  -7.919
    2    HA   LEU 708           HA       LEU 708  59.734  -3.402  -8.075
    3    HB2  LEU 708           HB2      LEU 708  58.600  -2.993 -10.168
    4    HB3  LEU 708           HB3      LEU 708  57.990  -1.461  -9.585
    5    HG   LEU 708           HG       LEU 708  60.289  -0.568  -9.545
    6   HD11  LEU 708          HD11      LEU 708  61.027  -3.211 -10.758
    7   HD13  LEU 708          HD12      LEU 708  61.502  -2.617  -9.166
    8   HD12  LEU 708          HD13      LEU 708  62.087  -1.809 -10.620
    9   HD22  LEU 708          HD21      LEU 708  60.583  -0.415 -11.963
   10   HD21  LEU 708          HD22      LEU 708  58.891  -0.236 -11.515
   11   HD23  LEU 708          HD23      LEU 708  59.467  -1.763 -12.188

  No H/Q in entry =          11
  In of MODEL   44
    1    H    GLN 709           H        GLN 709  61.028  -2.475  -6.565
    2    HA   GLN 709           HA       GLN 709  60.782   0.365  -6.179
    3    HB2  GLN 709           HB2      GLN 709  60.754   0.350  -3.783
    4    HB3  GLN 709           HB3      GLN 709  59.430  -0.680  -4.301
    5    HG2  GLN 709           HG2      GLN 709  60.845  -2.652  -3.883
    6    HG3  GLN 709           HG3      GLN 709  62.122  -1.582  -3.339
    7   HE21  GLN 709          HE21      GLN 709  62.178  -2.439  -1.327
    8   HE22  GLN 709          HE22      GLN 709  60.955  -2.220  -0.151

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ASN 710           H        ASN 710  62.729   1.276  -5.576
    2    HA   ASN 710           HA       ASN 710  64.995   1.525  -5.393
    3    HB2  ASN 710           HB2      ASN 710  64.361  -0.093  -3.392
    4    HB3  ASN 710           HB3      ASN 710  65.195  -1.297  -4.346
    5   HD21  ASN 710          HD21      ASN 710  65.911  -0.338  -1.773
    6   HD22  ASN 710          HD22      ASN 710  67.494   0.363  -1.884

  No H/Q in entry =           6
  In of MODEL   44
    1    H    SER 711           H        SER 711  63.761   0.356  -7.769
    2    HA   SER 711           HA       SER 711  64.324  -0.344  -9.831
    3    HB2  SER 711           HB2      SER 711  66.293   1.142  -9.499
    4    HB3  SER 711           HB3      SER 711  67.190  -0.213  -8.822
    5    HG   SER 711           HG       SER 711  66.831  -1.269 -10.855

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ARG 712           H        ARG 712  63.937  -2.289  -7.544
    2    HA   ARG 712           HA       ARG 712  64.906  -4.623  -8.990
    3    HB2  ARG 712           HB2      ARG 712  65.432  -5.762  -6.855
    4    HB3  ARG 712           HB3      ARG 712  66.484  -4.393  -7.177
    5    HG2  ARG 712           HG2      ARG 712  65.239  -3.034  -5.635
    6    HG3  ARG 712           HG3      ARG 712  64.106  -4.350  -5.344
    7    HD2  ARG 712           HD2      ARG 712  65.909  -5.700  -4.404
    8    HD3  ARG 712           HD3      ARG 712  67.077  -4.442  -4.791
    9    HE   ARG 712           HE       ARG 712  64.862  -3.954  -2.915
   10   HH11  ARG 712          HH11      ARG 712  68.347  -3.995  -3.593
   11   HH12  ARG 712          HH12      ARG 712  68.749  -3.218  -2.136
   12   HH21  ARG 712          HH21      ARG 712  65.458  -2.895  -0.963
   13   HH22  ARG 712          HH22      ARG 712  67.097  -2.600  -0.595

  No H/Q in entry =          13
  In of MODEL   44
    1    H    CYS 713           H        CYS 713  63.763  -6.605  -8.220
    2    HA   CYS 713           HA       CYS 713  60.931  -5.940  -8.017
    3    HB2  CYS 713           HB2      CYS 713  62.253  -8.579  -8.671
    4    HB3  CYS 713           HB3      CYS 713  60.576  -8.118  -8.952

  No H/Q in entry =           4
  In of MODEL   44
    1    H    VAL 714           H        VAL 714  60.119  -6.097  -6.006
    2    HA   VAL 714           HA       VAL 714  61.203  -8.178  -4.237
    3    HB   VAL 714           HB       VAL 714  60.722  -6.726  -2.297
    4   HG13  VAL 714          HG11      VAL 714  62.978  -6.703  -3.159
    5   HG12  VAL 714          HG12      VAL 714  62.534  -5.077  -2.617
    6   HG11  VAL 714          HG13      VAL 714  62.538  -5.466  -4.335
    7   HG23  VAL 714          HG21      VAL 714  60.245  -4.336  -2.625
    8   HG22  VAL 714          HG22      VAL 714  58.957  -5.372  -3.237
    9   HG21  VAL 714          HG23      VAL 714  60.090  -4.624  -4.360

  No H/Q in entry =           9
  In of MODEL   44
    1    H    CYS 715           H        CYS 715  59.416  -8.474  -2.371
    2    HA   CYS 715           HA       CYS 715  57.057  -9.158  -3.907
    3    HB2  CYS 715           HB2      CYS 715  56.417 -10.391  -1.801
    4    HB3  CYS 715           HB3      CYS 715  57.920 -10.920  -2.543

  No H/Q in entry =           4
  In of MODEL   44
    1    H    LYS 716           H        LYS 716  54.869  -8.668  -3.070
    2    HA   LYS 716           HA       LYS 716  54.648  -5.993  -2.037
    3    HB2  LYS 716           HB2      LYS 716  52.495  -8.120  -2.353
    4    HB3  LYS 716           HB3      LYS 716  52.206  -6.418  -2.047
    5    HG2  LYS 716           HG2      LYS 716  52.902  -5.806  -4.226
    6    HG3  LYS 716           HG3      LYS 716  53.607  -7.394  -4.521
    7    HD2  LYS 716           HD2      LYS 716  51.573  -7.415  -5.713
    8    HD3  LYS 716           HD3      LYS 716  51.253  -8.329  -4.251
    9    HE2  LYS 716           HE2      LYS 716  49.361  -6.962  -4.575
   10    HE3  LYS 716           HE3      LYS 716  50.286  -6.177  -3.298
   11    HZ1  LYS 716           HZ1      LYS 716  50.401  -5.427  -6.159
   12    HZ3  LYS 716           HZ2      LYS 716  51.107  -4.568  -4.887
   13    HZ2  LYS 716           HZ3      LYS 716  49.433  -4.655  -5.043

  No H/Q in entry =          13
  In of MODEL   44
    1    H    MET 717           H        MET 717  53.223  -5.646  -0.007
    2    HA   MET 717           HA       MET 717  54.160  -7.490   2.038
    3    HB2  MET 717           HB2      MET 717  52.816  -4.792   2.233
    4    HB3  MET 717           HB3      MET 717  53.361  -5.734   3.609
    5    HG2  MET 717           HG2      MET 717  55.101  -4.602   1.429
    6    HG3  MET 717           HG3      MET 717  54.918  -3.950   3.057
    7    HE2  MET 717           HE1      MET 717  54.918  -6.557   4.898
    8    HE1  MET 717           HE2      MET 717  55.883  -5.122   5.245
    9    HE3  MET 717           HE3      MET 717  56.641  -6.712   5.248

  No H/Q in entry =           9
  In of MODEL   44
    1    HA   PRO 718           HA       PRO 718  50.355  -9.654   2.155
    2    HB2  PRO 718           HB2      PRO 718  50.175 -10.366   4.791
    3    HB3  PRO 718           HB3      PRO 718  51.267 -11.134   3.633
    4    HG2  PRO 718           HG2      PRO 718  51.840  -8.984   5.635
    5    HG3  PRO 718           HG3      PRO 718  52.799 -10.419   5.234
    6    HD2  PRO 718           HD2      PRO 718  53.430  -7.988   4.283
    7    HD3  PRO 718           HD3      PRO 718  53.666  -9.455   3.312

  No H/Q in entry =           7
  In of MODEL   44
    1    H    TYR 719           H        TYR 719  50.585  -6.726   3.708
    2    HA   TYR 719           HA       TYR 719  47.799  -6.825   4.579
    3    HB2  TYR 719           HB2      TYR 719  48.262  -4.758   5.858
    4    HB3  TYR 719           HB3      TYR 719  49.274  -6.104   6.348
    5    HD1  TYR 719           HD1      TYR 719  49.197  -2.799   4.806
    6    HD2  TYR 719           HD2      TYR 719  51.681  -6.071   5.887
    7    HE1  TYR 719           HE1      TYR 719  51.181  -1.358   4.580
    8    HE2  TYR 719           HE2      TYR 719  53.667  -4.635   5.681
    9    HH   TYR 719           HH       TYR 719  53.474  -1.323   5.530

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLU 720           H        GLU 720  49.537  -6.032   1.949
    2    HA   GLU 720           HA       GLU 720  47.972  -3.684   1.199
    3    HB2  GLU 720           HB2      GLU 720  50.128  -5.248  -0.197
    4    HB3  GLU 720           HB3      GLU 720  49.363  -3.818  -0.890
    5    HG2  GLU 720           HG2      GLU 720  50.246  -2.511   1.001
    6    HG3  GLU 720           HG3      GLU 720  51.043  -3.964   1.602

  No H/Q in entry =           6
  In of MODEL   44
    1    H    CYS 721           H        CYS 721  47.488  -6.803   1.404
    2    HA   CYS 721           HA       CYS 721  46.437  -7.451  -1.195
    3    HB2  CYS 721           HB2      CYS 721  46.309  -8.944   1.409
    4    HB3  CYS 721           HB3      CYS 721  46.016  -9.601  -0.198

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLY 722           H        GLY 722  44.376  -7.067  -1.758
    2    HA3  GLY 722           HA2      GLY 722  42.311  -7.044   0.306
    3    HA2  GLY 722           HA3      GLY 722  42.443  -5.667  -0.782

  No H/Q in entry =           3
  In of MODEL   44
    1    HA   PRO 723           HA       PRO 723  39.757  -7.702  -3.647
    2    HB2  PRO 723           HB2      PRO 723  40.796  -6.713  -6.002
    3    HB3  PRO 723           HB3      PRO 723  39.681  -5.825  -4.956
    4    HG2  PRO 723           HG2      PRO 723  42.655  -5.637  -5.167
    5    HG3  PRO 723           HG3      PRO 723  41.463  -4.342  -4.967
    6    HD2  PRO 723           HD2      PRO 723  42.930  -5.233  -2.904
    7    HD3  PRO 723           HD3      PRO 723  41.244  -4.724  -2.697

  No H/Q in entry =           7
  In of MODEL   44
    1    H    SER 724           H        SER 724  39.906  -9.785  -4.008
    2    HA   SER 724           HA       SER 724  41.498 -11.102  -5.984
    3    HB2  SER 724           HB2      SER 724  42.210 -11.382  -3.079
    4    HB3  SER 724           HB3      SER 724  42.555 -12.642  -4.273
    5    HG   SER 724           HG       SER 724  43.310 -10.174  -5.022

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU 725           H        LEU 725  40.913 -13.255  -6.154
    2    HA   LEU 725           HA       LEU 725  38.279 -13.995  -5.350
    3    HB2  LEU 725           HB2      LEU 725  40.606 -15.463  -6.535
    4    HB3  LEU 725           HB3      LEU 725  39.132 -16.307  -6.115
    5    HG   LEU 725           HG       LEU 725  39.181 -13.987  -8.055
    6   HD12  LEU 725          HD11      LEU 725  39.380 -16.949  -8.632
    7   HD11  LEU 725          HD12      LEU 725  40.680 -15.777  -8.855
    8   HD13  LEU 725          HD13      LEU 725  39.215 -15.667  -9.831
    9   HD21  LEU 725          HD21      LEU 725  37.009 -14.590  -7.107
   10   HD23  LEU 725          HD22      LEU 725  37.247 -16.260  -7.625
   11   HD22  LEU 725          HD23      LEU 725  37.101 -14.974  -8.824

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ASP 726           H        ASP 726  37.665 -14.840  -3.471
    2    HA   ASP 726           HA       ASP 726  39.620 -15.532  -1.482
    3    HB2  ASP 726           HB2      ASP 726  36.595 -15.620  -1.413
    4    HB3  ASP 726           HB3      ASP 726  37.591 -16.191  -0.081

  No H/Q in entry =           4
  In of MODEL   44
    1    H    VAL 727           H        VAL 727  40.243 -17.454  -0.832
    2    HA   VAL 727           HA       VAL 727  39.109 -19.800  -2.159
    3    HB   VAL 727           HB       VAL 727  41.430 -20.668  -2.601
    4   HG11  VAL 727          HG11      VAL 727  40.650 -18.150  -4.070
    5   HG13  VAL 727          HG12      VAL 727  40.076 -19.782  -4.418
    6   HG12  VAL 727          HG13      VAL 727  41.768 -19.375  -4.666
    7   HG23  VAL 727          HG21      VAL 727  42.236 -17.800  -2.084
    8   HG22  VAL 727          HG22      VAL 727  43.288 -19.058  -2.732
    9   HG21  VAL 727          HG23      VAL 727  42.664 -19.188  -1.088

  No H/Q in entry =           9
  In of MODEL   44
    1    H    CYS 728           H        CYS 728  39.875 -21.828  -1.193
    2    HA   CYS 728           HA       CYS 728  40.161 -21.508   1.702
    3    HB2  CYS 728           HB2      CYS 728  39.594 -24.038   0.143
    4    HB3  CYS 728           HB3      CYS 728  39.365 -23.760   1.856

  No H/Q in entry =           4
  In of MODEL   44
    1    H    ALA 729           H        ALA 729  42.082 -22.027   2.668
    2    HA   ALA 729           HA       ALA 729  43.928 -23.703   1.171
    3    HB2  ALA 729           HB1      ALA 729  45.772 -22.201   1.681
    4    HB1  ALA 729           HB2      ALA 729  44.652 -21.081   2.457
    5    HB3  ALA 729           HB3      ALA 729  44.545 -21.376   0.721

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLN 730           H        GLN 730  45.504 -24.619   2.485
    2    HA   GLN 730           HA       GLN 730  44.685 -24.923   5.268
    3    HB2  GLN 730           HB2      GLN 730  44.653 -26.972   3.870
    4    HB3  GLN 730           HB3      GLN 730  46.359 -26.740   3.542
    5    HG2  GLN 730           HG2      GLN 730  46.930 -27.086   5.821
    6    HG3  GLN 730           HG3      GLN 730  45.245 -27.123   6.313
    7   HE21  GLN 730          HE21      GLN 730  45.343 -29.205   7.158
    8   HE22  GLN 730          HE22      GLN 730  45.544 -30.583   6.137

  No H/Q in entry =           8
  In of MODEL   44
    1    H    ASP 731           H        ASP 731  45.988 -24.383   6.772
    2    HA   ASP 731           HA       ASP 731  48.407 -22.920   6.232
    3    HB2  ASP 731           HB2      ASP 731  46.845 -22.253   8.021
    4    HB3  ASP 731           HB3      ASP 731  47.126 -23.783   8.840

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLU 732           H        GLU 732  50.503 -23.724   6.442
    2    HA   GLU 732           HA       GLU 732  50.659 -26.566   6.732
    3    HB2  GLU 732           HB2      GLU 732  52.690 -24.528   5.956
    4    HB3  GLU 732           HB3      GLU 732  53.141 -26.201   6.270
    5    HG2  GLU 732           HG2      GLU 732  51.165 -25.236   4.216
    6    HG3  GLU 732           HG3      GLU 732  52.789 -25.848   3.903

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ARG 733           H        ARG 733  51.127 -23.996   8.966
    2    HA   ARG 733           HA       ARG 733  52.978 -25.478  10.574
    3    HB2  ARG 733           HB2      ARG 733  51.365 -22.978  11.065
    4    HB3  ARG 733           HB3      ARG 733  52.553 -23.641  12.167
    5    HG2  ARG 733           HG2      ARG 733  53.125 -22.666   9.379
    6    HG3  ARG 733           HG3      ARG 733  53.403 -21.739  10.857
    7    HD2  ARG 733           HD2      ARG 733  54.976 -23.472  11.612
    8    HD3  ARG 733           HD3      ARG 733  54.701 -24.354  10.109
    9    HE   ARG 733           HE       ARG 733  55.475 -21.690   9.617
   10   HH11  ARG 733          HH11      ARG 733  56.807 -24.800  10.605
   11   HH12  ARG 733          HH12      ARG 733  58.349 -24.512   9.924
   12   HH21  ARG 733          HH21      ARG 733  57.559 -21.294   8.679
   13   HH22  ARG 733          HH22      ARG 733  58.786 -22.475   8.770

  No H/Q in entry =          13
  In of MODEL   44
    1    H    SER 734           H        SER 734  49.646 -24.491  10.608
    2    HA   SER 734           HA       SER 734  49.043 -25.931  13.064
    3    HB2  SER 734           HB2      SER 734  47.117 -24.456  11.316
    4    HB3  SER 734           HB3      SER 734  47.084 -24.677  13.065
    5    HG   SER 734           HG       SER 734  48.889 -23.096  11.544

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LYS 735           H        LYS 735  48.594 -26.231   9.585
    2    HA   LYS 735           HA       LYS 735  47.597 -27.601   8.223
    3    HB2  LYS 735           HB2      LYS 735  47.560 -29.533  10.548
    4    HB3  LYS 735           HB3      LYS 735  47.204 -29.958   8.879
    5    HG2  LYS 735           HG2      LYS 735  49.834 -28.932   9.947
    6    HG3  LYS 735           HG3      LYS 735  49.479 -30.582   9.440
    7    HD2  LYS 735           HD2      LYS 735  49.461 -28.139   7.656
    8    HD3  LYS 735           HD3      LYS 735  50.754 -29.314   7.734
    9    HE2  LYS 735           HE2      LYS 735  49.071 -31.060   7.018
   10    HE3  LYS 735           HE3      LYS 735  47.911 -29.759   6.799
   11    HZ1  LYS 735           HZ1      LYS 735  49.535 -28.791   5.110
   12    HZ3  LYS 735           HZ2      LYS 735  48.862 -30.258   4.704
   13    HZ2  LYS 735           HZ3      LYS 735  50.415 -30.211   5.281

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ARG 736           H        ARG 736  45.982 -25.790   9.907
    2    HA   ARG 736           HA       ARG 736  43.384 -27.108   9.737
    3    HB2  ARG 736           HB2      ARG 736  42.446 -25.161  10.763
    4    HB3  ARG 736           HB3      ARG 736  43.846 -25.652  11.691
    5    HG2  ARG 736           HG2      ARG 736  45.066 -23.824  11.077
    6    HG3  ARG 736           HG3      ARG 736  44.156 -23.592   9.580
    7    HD2  ARG 736           HD2      ARG 736  43.094 -23.123  12.363
    8    HD3  ARG 736           HD3      ARG 736  43.682 -21.904  11.221
    9    HE   ARG 736           HE       ARG 736  41.549 -23.598  10.235
   10   HH11  ARG 736          HH11      ARG 736  42.300 -20.506  11.806
   11   HH12  ARG 736          HH12      ARG 736  40.838 -19.775  11.302
   12   HH21  ARG 736          HH21      ARG 736  39.604 -22.531   9.518
   13   HH22  ARG 736          HH22      ARG 736  39.289 -20.932  10.034

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ILE 737           H        ILE 737  41.632 -25.947   8.569
    2    HA   ILE 737           HA       ILE 737  42.704 -24.897   6.052
    3    HB   ILE 737           HB       ILE 737  39.829 -25.607   6.637
    4   HG12  ILE 737          HG12      ILE 737  41.297 -27.615   7.015
    5   HG13  ILE 737          HG13      ILE 737  40.176 -27.827   5.684
    6   HG22  ILE 737          HG21      ILE 737  41.395 -25.421   4.059
    7   HG21  ILE 737          HG22      ILE 737  40.376 -24.153   4.714
    8   HG23  ILE 737          HG23      ILE 737  39.656 -25.673   4.198
    9   HD12  ILE 737          HD11      ILE 737  43.114 -27.199   5.495
   10   HD11  ILE 737          HD12      ILE 737  42.005 -27.311   4.131
   11   HD13  ILE 737          HD13      ILE 737  42.331 -28.739   5.113

  No H/Q in entry =          11
  In of MODEL   44
    1    H    LEU 738           H        LEU 738  42.459 -22.787   5.645
    2    HA   LEU 738           HA       LEU 738  40.450 -21.326   7.125
    3    HB2  LEU 738           HB2      LEU 738  41.941 -19.435   7.606
    4    HB3  LEU 738           HB3      LEU 738  42.508 -20.890   8.382
    5    HG   LEU 738           HG       LEU 738  43.697 -19.793   5.826
    6   HD13  LEU 738          HD11      LEU 738  45.485 -18.923   7.250
    7   HD12  LEU 738          HD12      LEU 738  44.606 -19.446   8.687
    8   HD11  LEU 738          HD13      LEU 738  43.942 -18.174   7.661
    9   HD21  LEU 738          HD21      LEU 738  43.998 -22.134   6.303
   10   HD23  LEU 738          HD22      LEU 738  44.681 -21.729   7.879
   11   HD22  LEU 738          HD23      LEU 738  45.530 -21.260   6.382

  No H/Q in entry =          11
  In of MODEL   44
    1    HA   PRO 739           HA       PRO 739  39.640 -19.450   3.222
    2    HB2  PRO 739           HB2      PRO 739  38.459 -17.170   4.090
    3    HB3  PRO 739           HB3      PRO 739  37.658 -18.741   4.216
    4    HG2  PRO 739           HG2      PRO 739  39.130 -17.203   6.322
    5    HG3  PRO 739           HG3      PRO 739  37.593 -18.080   6.448
    6    HD2  PRO 739           HD2      PRO 739  39.997 -19.172   7.272
    7    HD3  PRO 739           HD3      PRO 739  38.639 -20.135   6.639

  No H/Q in entry =           7
  In of MODEL   44
    1    H    LEU 740           H        LEU 740  41.082 -18.489   2.000
    2    HA   LEU 740           HA       LEU 740  42.491 -16.120   2.975
    3    HB2  LEU 740           HB2      LEU 740  43.592 -18.391   1.327
    4    HB3  LEU 740           HB3      LEU 740  44.348 -16.818   1.378
    5    HG   LEU 740           HG       LEU 740  44.039 -18.730   3.695
    6   HD11  LEU 740          HD11      LEU 740  46.438 -17.768   2.147
    7   HD13  LEU 740          HD12      LEU 740  45.720 -19.371   2.061
    8   HD12  LEU 740          HD13      LEU 740  46.483 -18.827   3.561
    9   HD22  LEU 740          HD21      LEU 740  43.858 -16.429   4.491
   10   HD21  LEU 740          HD22      LEU 740  45.283 -15.980   3.566
   11   HD23  LEU 740          HD23      LEU 740  45.433 -17.093   4.928

  No H/Q in entry =          11
  In of MODEL   44
    1    H    THR 741           H        THR 741  43.582 -15.269   0.722
    2    HA   THR 741           HA       THR 741  41.522 -15.290  -1.316
    3    HB   THR 741           HB       THR 741  42.740 -12.646  -0.461
    4    HG1  THR 741           HG1      THR 741  40.319 -13.670   0.675
    5   HG23  THR 741          HG21      THR 741  40.702 -11.742  -1.309
    6   HG22  THR 741          HG22      THR 741  39.954 -13.327  -1.311
    7   HG21  THR 741          HG23      THR 741  41.221 -12.975  -2.473

  No H/Q in entry =           7
  In of MODEL   44
    1    H    VAL 742           H        VAL 742  42.513 -14.876  -3.407
    2    HA   VAL 742           HA       VAL 742  44.974 -15.989  -3.622
    3    HB   VAL 742           HB       VAL 742  43.693 -16.231  -5.585
    4   HG13  VAL 742          HG11      VAL 742  43.029 -14.634  -7.055
    5   HG12  VAL 742          HG12      VAL 742  43.644 -13.307  -6.043
    6   HG11  VAL 742          HG13      VAL 742  42.293 -14.339  -5.482
    7   HG22  VAL 742          HG21      VAL 742  45.064 -15.568  -7.396
    8   HG21  VAL 742          HG22      VAL 742  46.118 -16.007  -6.026
    9   HG23  VAL 742          HG23      VAL 742  45.789 -14.310  -6.413

  No H/Q in entry =           9
  In of MODEL   44
    1    H    CYS 743           H        CYS 743  44.689 -12.429  -3.853
    2    HA   CYS 743           HA       CYS 743  47.371 -11.927  -4.272
    3    HB2  CYS 743           HB2      CYS 743  45.608 -10.153  -4.142
    4    HB3  CYS 743           HB3      CYS 743  45.590 -10.351  -2.399

  No H/Q in entry =           4
  In of MODEL   44
    1    H    LYS 744           H        LYS 744  45.677 -12.531  -1.239
    2    HA   LYS 744           HA       LYS 744  47.759 -11.964   0.553
    3    HB2  LYS 744           HB2      LYS 744  45.419 -13.845   0.896
    4    HB3  LYS 744           HB3      LYS 744  46.422 -13.203   2.193
    5    HG2  LYS 744           HG2      LYS 744  45.695 -10.959   1.694
    6    HG3  LYS 744           HG3      LYS 744  44.774 -11.530   0.310
    7    HD2  LYS 744           HD2      LYS 744  43.276 -11.096   2.122
    8    HD3  LYS 744           HD3      LYS 744  43.355 -12.835   1.873
    9    HE2  LYS 744           HE2      LYS 744  44.835 -13.064   3.778
   10    HE3  LYS 744           HE3      LYS 744  44.881 -11.311   3.977
   11    HZ3  LYS 744           HZ1      LYS 744  43.286 -12.295   5.518
   12    HZ2  LYS 744           HZ2      LYS 744  42.471 -13.020   4.241
   13    HZ1  LYS 744           HZ3      LYS 744  42.462 -11.378   4.375

  No H/Q in entry =          13
  In of MODEL   44
    1    H    MET 745           H        MET 745  46.551 -15.071  -0.617
    2    HA   MET 745           HA       MET 745  48.440 -16.765   0.518
    3    HB2  MET 745           HB2      MET 745  46.819 -17.921  -0.341
    4    HB3  MET 745           HB3      MET 745  46.542 -16.898  -1.750
    5    HG2  MET 745           HG2      MET 745  47.312 -18.889  -2.708
    6    HG3  MET 745           HG3      MET 745  48.757 -17.932  -2.588
    7    HE2  MET 745           HE1      MET 745  47.742 -21.491   0.140
    8    HE1  MET 745           HE2      MET 745  46.756 -20.890  -1.201
    9    HE3  MET 745           HE3      MET 745  46.888 -19.957   0.283

  No H/Q in entry =           9
  In of MODEL   44
    1    H    HIS 746           H        HIS 746  48.582 -15.029  -2.562
    2    HA   HIS 746           HA       HIS 746  51.012 -16.241  -3.403
    3    HB2  HIS 746           HB2      HIS 746  49.392 -13.979  -4.298
    4    HB3  HIS 746           HB3      HIS 746  51.102 -13.958  -4.770
    5    HD1  HIS 746           HD1      HIS 746  51.655 -16.639  -5.788
    6    HD2  HIS 746           HD2      HIS 746  47.934 -14.889  -6.248
    7    HE1  HIS 746           HE1      HIS 746  50.672 -17.726  -7.781
    8    HE2  HIS 746           HE2      HIS 746  48.278 -16.867  -7.829

  No H/Q in entry =           8
  In of MODEL   44
    1    H    VAL 747           H        VAL 747  50.326 -13.048  -2.060
    2    HA   VAL 747           HA       VAL 747  52.969 -12.177  -2.008
    3    HB   VAL 747           HB       VAL 747  50.482 -11.314  -0.536
    4   HG11  VAL 747          HG11      VAL 747  52.417 -10.748   0.883
    5   HG13  VAL 747          HG12      VAL 747  51.690  -9.311   0.193
    6   HG12  VAL 747          HG13      VAL 747  53.182  -9.955  -0.490
    7   HG22  VAL 747          HG21      VAL 747  50.524 -10.926  -2.913
    8   HG21  VAL 747          HG22      VAL 747  52.093 -10.163  -2.792
    9   HG23  VAL 747          HG23      VAL 747  50.679  -9.384  -2.062

  No H/Q in entry =           9
  In of MODEL   44
    1    H    LEU 748           H        LEU 748  50.971 -13.615   0.497
    2    HA   LEU 748           HA       LEU 748  52.918 -13.634   2.482
    3    HB2  LEU 748           HB2      LEU 748  50.933 -13.923   3.495
    4    HB3  LEU 748           HB3      LEU 748  50.203 -14.569   2.062
    5    HG   LEU 748           HG       LEU 748  51.776 -16.265   4.011
    6   HD11  LEU 748          HD11      LEU 748  49.863 -15.150   5.121
    7   HD13  LEU 748          HD12      LEU 748  49.585 -16.880   4.922
    8   HD12  LEU 748          HD13      LEU 748  48.802 -15.737   3.839
    9   HD22  LEU 748          HD21      LEU 748  50.539 -18.086   2.977
   10   HD21  LEU 748          HD22      LEU 748  51.400 -17.206   1.722
   11   HD23  LEU 748          HD23      LEU 748  49.667 -16.964   1.947

  No H/Q in entry =          11
  In of MODEL   44
    1    H    HIS 749           H        HIS 749  52.244 -15.905  -0.097
    2    HA   HIS 749           HA       HIS 749  53.942 -17.982   0.839
    3    HB2  HIS 749           HB2      HIS 749  52.162 -18.123  -1.022
    4    HB3  HIS 749           HB3      HIS 749  53.376 -17.405  -2.071
    5    HD1  HIS 749           HD1      HIS 749  55.691 -18.919  -2.279
    6    HD2  HIS 749           HD2      HIS 749  52.272 -20.785  -0.838
    7    HE1  HIS 749           HE1      HIS 749  56.160 -21.347  -2.424
    8    HE2  HIS 749           HE2      HIS 749  53.986 -22.445  -1.878

  No H/Q in entry =           8
  In of MODEL   44
    1    H    CYS 750           H        CYS 750  54.424 -15.094  -1.075
    2    HA   CYS 750           HA       CYS 750  57.104 -15.792  -1.845
    3    HB2  CYS 750           HB2      CYS 750  55.628 -14.354  -3.259
    4    HB3  CYS 750           HB3      CYS 750  55.710 -13.100  -2.037

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLN 751           H        GLN 751  55.547 -13.921   0.665
    2    HA   GLN 751           HA       GLN 751  57.775 -12.744   1.864
    3    HB2  GLN 751           HB2      GLN 751  55.197 -13.792   3.026
    4    HB3  GLN 751           HB3      GLN 751  56.392 -12.956   4.000
    5    HG2  GLN 751           HG2      GLN 751  55.119 -11.759   1.562
    6    HG3  GLN 751           HG3      GLN 751  54.466 -11.562   3.183
    7   HE21  GLN 751          HE21      GLN 751  55.457  -9.467   1.391
    8   HE22  GLN 751          HE22      GLN 751  56.769  -8.739   2.216

  No H/Q in entry =           8
  In of MODEL   44
    1    H    GLY 752           H        GLY 752  56.559 -16.005   1.927
    2    HA3  GLY 752           HA2      GLY 752  58.382 -17.672   2.169
    3    HA2  GLY 752           HA3      GLY 752  58.848 -16.783   3.609

  No H/Q in entry =           3
  In of MODEL   44
    1    H    ARG 753           H        ARG 753  55.451 -17.330   2.874
    2    HA   ARG 753           HA       ARG 753  55.402 -19.185   5.162
    3    HB2  ARG 753           HB2      ARG 753  52.984 -17.796   4.035
    4    HB3  ARG 753           HB3      ARG 753  53.196 -18.475   5.638
    5    HG2  ARG 753           HG2      ARG 753  54.444 -15.933   4.588
    6    HG3  ARG 753           HG3      ARG 753  53.140 -16.058   5.760
    7    HD2  ARG 753           HD2      ARG 753  54.586 -16.945   7.403
    8    HD3  ARG 753           HD3      ARG 753  55.871 -17.225   6.219
    9    HE   ARG 753           HE       ARG 753  54.973 -14.489   6.629
   10   HH11  ARG 753          HH11      ARG 753  57.440 -16.929   7.420
   11   HH12  ARG 753          HH12      ARG 753  58.657 -15.790   7.698
   12   HH21  ARG 753          HH21      ARG 753  56.630 -12.954   7.004
   13   HH22  ARG 753          HH22      ARG 753  58.210 -13.452   7.421

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ASN 754           H        ASN 754  54.539 -21.187   4.852
    2    HA   ASN 754           HA       ASN 754  54.000 -21.935   2.074
    3    HB2  ASN 754           HB2      ASN 754  54.553 -23.702   4.473
    4    HB3  ASN 754           HB3      ASN 754  54.334 -24.259   2.825
    5   HD21  ASN 754          HD21      ASN 754  56.532 -24.598   4.649
    6   HD22  ASN 754          HD22      ASN 754  57.932 -23.958   3.881

  No H/Q in entry =           6
  In of MODEL   44
    1    H    TYR 755           H        TYR 755  52.036 -22.520   1.443
    2    HA   TYR 755           HA       TYR 755  50.104 -23.448   3.380
    3    HB2  TYR 755           HB2      TYR 755  49.725 -21.062   1.582
    4    HB3  TYR 755           HB3      TYR 755  48.362 -22.054   2.089
    5    HD1  TYR 755           HD1      TYR 755  47.365 -21.710   4.173
    6    HD2  TYR 755           HD2      TYR 755  51.142 -19.971   3.380
    7    HE1  TYR 755           HE1      TYR 755  47.226 -20.441   6.273
    8    HE2  TYR 755           HE2      TYR 755  51.005 -18.695   5.458
    9    HH   TYR 755           HH       TYR 755  48.846 -19.523   7.834

  No H/Q in entry =           9
  In of MODEL   44
    1    H    THR 756           H        THR 756  48.520 -24.702   2.484
    2    HA   THR 756           HA       THR 756  49.150 -25.674  -0.196
    3    HB   THR 756           HB       THR 756  47.980 -27.087   2.194
    4    HG1  THR 756           HG1      THR 756  49.984 -27.451   2.585
    5   HG21  THR 756          HG21      THR 756  48.577 -28.167  -0.562
    6   HG23  THR 756          HG22      THR 756  46.978 -27.921   0.146
    7   HG22  THR 756          HG23      THR 756  48.062 -29.135   0.829

  No H/Q in entry =           7
  In of MODEL   44
    1    H    LEU 757           H        LEU 757  47.420 -25.689  -1.679
    2    HA   LEU 757           HA       LEU 757  45.018 -24.516  -0.619
    3    HB2  LEU 757           HB2      LEU 757  45.792 -25.070  -3.449
    4    HB3  LEU 757           HB3      LEU 757  44.218 -24.452  -2.978
    5    HG   LEU 757           HG       LEU 757  45.844 -22.736  -1.714
    6   HD12  LEU 757          HD11      LEU 757  47.266 -23.411  -4.264
    7   HD11  LEU 757          HD12      LEU 757  47.860 -23.628  -2.615
    8   HD13  LEU 757          HD13      LEU 757  47.587 -22.002  -3.247
    9   HD23  LEU 757          HD21      LEU 757  44.765 -22.510  -4.506
   10   HD22  LEU 757          HD22      LEU 757  45.235 -21.162  -3.446
   11   HD21  LEU 757          HD23      LEU 757  43.911 -22.239  -2.985

  No H/Q in entry =          11
  In of MODEL   44
    1    H    THR 758           H        THR 758  43.055 -25.290  -0.634
    2    HA   THR 758           HA       THR 758  42.832 -28.171  -1.037
    3    HB   THR 758           HB       THR 758  41.167 -28.010   0.899
    4    HG1  THR 758           HG1      THR 758  40.895 -26.149   1.825
    5   HG22  THR 758          HG21      THR 758  44.064 -27.316   1.485
    6   HG21  THR 758          HG22      THR 758  43.463 -28.928   1.130
    7   HG23  THR 758          HG23      THR 758  42.943 -28.109   2.596

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLY 759           H        GLY 759  40.109 -28.396  -0.650
    2    HA3  GLY 759           HA2      GLY 759  39.092 -27.090  -3.057
    3    HA2  GLY 759           HA3      GLY 759  38.338 -28.431  -2.199

  No H/Q in entry =           3
  In of MODEL   44
    1    H    ARG 760           H        ARG 760  36.617 -26.562  -2.857
    2    HA   ARG 760           HA       ARG 760  36.493 -24.297  -1.093
    3    HB2  ARG 760           HB2      ARG 760  34.433 -23.735  -2.191
    4    HB3  ARG 760           HB3      ARG 760  35.449 -24.446  -3.430
    5    HG2  ARG 760           HG2      ARG 760  33.477 -25.521  -3.906
    6    HG3  ARG 760           HG3      ARG 760  34.135 -26.649  -2.723
    7    HD2  ARG 760           HD2      ARG 760  32.853 -25.284  -0.972
    8    HD3  ARG 760           HD3      ARG 760  32.000 -24.558  -2.331
    9    HE   ARG 760           HE       ARG 760  32.035 -27.476  -1.960
   10   HH11  ARG 760          HH11      ARG 760  30.130 -24.484  -2.316
   11   HH12  ARG 760          HH12      ARG 760  28.645 -25.285  -2.190
   12   HH21  ARG 760          HH21      ARG 760  30.022 -28.529  -1.796
   13   HH22  ARG 760          HH22      ARG 760  28.567 -27.652  -1.867

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ASP 761           H        ASP 761  35.678 -27.533  -0.829
    2    HA   ASP 761           HA       ASP 761  33.428 -27.282   0.933
    3    HB2  ASP 761           HB2      ASP 761  35.115 -29.673   0.212
    4    HB3  ASP 761           HB3      ASP 761  33.587 -29.739   1.085

  No H/Q in entry =           4
  In of MODEL   44
    1    H    SER 762           H        SER 762  36.754 -27.090   1.331
    2    HA   SER 762           HA       SER 762  36.910 -28.478   3.794
    3    HB2  SER 762           HB2      SER 762  39.235 -27.581   3.921
    4    HB3  SER 762           HB3      SER 762  38.883 -28.491   2.469
    5    HG   SER 762           HG       SER 762  38.674 -26.505   1.325

  No H/Q in entry =           5
  In of MODEL   44
    1    H    CYS 763           H        CYS 763  36.591 -24.972   3.096
    2    HA   CYS 763           HA       CYS 763  36.105 -24.718   5.958
    3    HB2  CYS 763           HB2      CYS 763  37.375 -22.629   6.118
    4    HB3  CYS 763           HB3      CYS 763  38.401 -23.937   5.540

  No H/Q in entry =           4
  In of MODEL   44
    1    H    THR 764           H        THR 764  35.398 -22.092   6.196
    2    HA   THR 764           HA       THR 764  32.975 -22.010   4.578
    3    HB   THR 764           HB       THR 764  33.719 -20.345   7.001
    4    HG1  THR 764           HG1      THR 764  33.596 -22.780   7.102
    5   HG21  THR 764          HG21      THR 764  31.054 -21.046   5.741
    6   HG23  THR 764          HG22      THR 764  31.854 -19.478   5.647
    7   HG22  THR 764          HG23      THR 764  31.268 -20.080   7.199

  No H/Q in entry =           7
  In of MODEL   44
    1    H    LEU 765           H        LEU 765  33.171 -20.804   2.776
    2    HA   LEU 765           HA       LEU 765  35.210 -18.753   2.707
    3    HB2  LEU 765           HB2      LEU 765  34.511 -20.606   0.892
    4    HB3  LEU 765           HB3      LEU 765  33.421 -19.303   0.442
    5    HG   LEU 765           HG       LEU 765  35.359 -17.809   0.089
    6   HD13  LEU 765          HD11      LEU 765  36.918 -18.799   1.633
    7   HD12  LEU 765          HD12      LEU 765  37.603 -18.792   0.007
    8   HD11  LEU 765          HD13      LEU 765  36.941 -20.280   0.685
    9   HD21  LEU 765          HD21      LEU 765  35.476 -20.415  -1.431
   10   HD23  LEU 765          HD22      LEU 765  36.144 -18.875  -1.965
   11   HD22  LEU 765          HD23      LEU 765  34.400 -19.064  -1.788

  No H/Q in entry =          11
  In of MODEL   44
    1    HA   PRO 766           HA       PRO 766  32.355 -15.416   3.577
    2    HB2  PRO 766           HB2      PRO 766  33.587 -13.511   1.952
    3    HB3  PRO 766           HB3      PRO 766  33.979 -13.848   3.633
    4    HG2  PRO 766           HG2      PRO 766  35.349 -14.735   1.157
    5    HG3  PRO 766           HG3      PRO 766  36.029 -14.368   2.750
    6    HD2  PRO 766           HD2      PRO 766  35.723 -16.881   1.829
    7    HD3  PRO 766           HD3      PRO 766  35.590 -16.516   3.548

  No H/Q in entry =           7
  In of MODEL   44
    1    H    ALA 767           H        ALA 767  33.176 -16.306   0.374
    2    HA   ALA 767           HA       ALA 767  30.508 -15.501  -0.488
    3    HB2  ALA 767           HB1      ALA 767  32.168 -13.968  -1.493
    4    HB3  ALA 767           HB2      ALA 767  31.306 -14.964  -2.679
    5    HB1  ALA 767           HB3      ALA 767  32.963 -15.374  -2.223

  No H/Q in entry =           5
  In of MODEL   44
    1    H    SER 768           H        SER 768  29.776 -17.333  -0.006
    2    HA   SER 768           HA       SER 768  30.663 -19.594  -1.628
    3    HB2  SER 768           HB2      SER 768  28.976 -19.520   0.882
    4    HB3  SER 768           HB3      SER 768  29.394 -20.967  -0.030
    5    HG   SER 768           HG       SER 768  31.152 -19.248   1.417

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA 769           H        ALA 769  28.480 -17.136  -1.488
    2    HA   ALA 769           HA       ALA 769  26.762 -18.332  -3.443
    3    HB3  ALA 769           HB1      ALA 769  25.617 -18.945  -1.357
    4    HB1  ALA 769           HB2      ALA 769  24.697 -17.717  -2.226
    5    HB2  ALA 769           HB3      ALA 769  25.670 -17.263  -0.827

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLU 770           H        GLU 770  24.948 -16.390  -3.712
    2    HA   GLU 770           HA       GLU 770  26.454 -14.198  -4.784
    3    HB2  GLU 770           HB2      GLU 770  24.263 -13.397  -5.518
    4    HB3  GLU 770           HB3      GLU 770  24.407 -15.122  -5.851
    5    HG2  GLU 770           HG2      GLU 770  23.199 -15.566  -3.741
    6    HG3  GLU 770           HG3      GLU 770  22.973 -13.843  -3.560

  No H/Q in entry =           6
  In of MODEL   44
    1    H    LYS 771           H        LYS 771  25.823 -11.878  -4.275
    2    HA   LYS 771           HA       LYS 771  25.576 -11.803  -1.381
    3    HB2  LYS 771           HB2      LYS 771  26.938  -9.615  -2.970
    4    HB3  LYS 771           HB3      LYS 771  26.928  -9.819  -1.237
    5    HG2  LYS 771           HG2      LYS 771  28.615 -11.143  -3.309
    6    HG3  LYS 771           HG3      LYS 771  29.059 -10.493  -1.737
    7    HD2  LYS 771           HD2      LYS 771  27.549 -13.033  -2.234
    8    HD3  LYS 771           HD3      LYS 771  29.276 -12.972  -1.878
    9    HE2  LYS 771           HE2      LYS 771  26.992 -12.143  -0.121
   10    HE3  LYS 771           HE3      LYS 771  27.832 -13.672  -0.053
   11    HZ2  LYS 771           HZ1      LYS 771  29.037 -10.999   0.555
   12    HZ1  LYS 771           HZ2      LYS 771  29.911 -12.434   0.530
   13    HZ3  LYS 771           HZ3      LYS 771  28.696 -12.201   1.672

  No H/Q in entry =          13
  In of MODEL   44
    1    H    ALA 772           H        ALA 772  24.560  -9.913  -0.503
    2    HA   ALA 772           HA       ALA 772  22.321  -9.125  -2.154
    3    HB3  ALA 772           HB1      ALA 772  21.857  -9.900   0.140
    4    HB1  ALA 772           HB2      ALA 772  21.323  -8.243  -0.113
    5    HB2  ALA 772           HB3      ALA 772  22.808  -8.557   0.780

  No H/Q in entry =           5
  In of MODEL   44
    1    H    CYS 773           H        CYS 773  21.649  -6.671  -1.716
    2    HA   CYS 773           HA       CYS 773  23.750  -5.154  -2.865
    3    HB2  CYS 773           HB2      CYS 773  21.287  -4.783  -3.275
    4    HB3  CYS 773           HB3      CYS 773  21.178  -4.098  -1.658

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLY 774           H        GLY 774  24.857  -3.319  -1.961
    2    HA3  GLY 774           HA2      GLY 774  25.546  -1.959  -0.173
    3    HA2  GLY 774           HA3      GLY 774  24.765  -3.075   0.941

  No H/Q in entry =           3
  In of MODEL   44
    1    H    ALA 775           H        ALA 775  26.276  -5.050  -1.092
    2    HA   ALA 775           HA       ALA 775  28.950  -4.863   0.012
    3    HB2  ALA 775           HB1      ALA 775  27.189  -7.314   0.266
    4    HB3  ALA 775           HB2      ALA 775  27.774  -6.320   1.603
    5    HB1  ALA 775           HB3      ALA 775  28.910  -7.258   0.638

  No H/Q in entry =           5
  In of MODEL   44
    1    H    CYS 776           H        CYS 776  30.245  -5.080  -1.728
    2    HA   CYS 776           HA       CYS 776  29.290  -6.819  -3.847
    3    HB2  CYS 776           HB2      CYS 776  30.104  -5.119  -5.515
    4    HB3  CYS 776           HB3      CYS 776  28.650  -4.692  -4.627

  No H/Q in entry =           4
  In of MODEL   44
    1    HA   PRO 777           HA       PRO 777  33.638  -8.037  -3.944
    2    HB2  PRO 777           HB2      PRO 777  32.962  -9.412  -6.442
    3    HB3  PRO 777           HB3      PRO 777  33.464 -10.125  -4.910
    4    HG2  PRO 777           HG2      PRO 777  30.958 -10.397  -5.900
    5    HG3  PRO 777           HG3      PRO 777  31.308 -10.367  -4.163
    6    HD2  PRO 777           HD2      PRO 777  30.229  -8.202  -5.919
    7    HD3  PRO 777           HD3      PRO 777  29.798  -8.653  -4.253

  No H/Q in entry =           7
  In of MODEL   44
    1    H    LEU 778           H        LEU 778  35.329  -7.823  -5.757
    2    HA   LEU 778           HA       LEU 778  34.868  -5.322  -6.988
    3    HB2  LEU 778           HB2      LEU 778  37.217  -5.415  -7.870
    4    HB3  LEU 778           HB3      LEU 778  37.050  -5.540  -6.145
    5    HG   LEU 778           HG       LEU 778  38.862  -6.896  -6.889
    6   HD13  LEU 778          HD11      LEU 778  38.397  -9.050  -5.992
    7   HD12  LEU 778          HD12      LEU 778  36.674  -8.783  -6.136
    8   HD11  LEU 778          HD13      LEU 778  37.625  -7.801  -5.011
    9   HD21  LEU 778          HD21      LEU 778  36.917  -8.246  -8.710
   10   HD23  LEU 778          HD22      LEU 778  38.533  -8.856  -8.362
   11   HD22  LEU 778          HD23      LEU 778  38.334  -7.297  -9.170

  No H/Q in entry =          11
  In of MODEL   44
    1    H    TRP 779           H        TRP 779  34.179  -8.339  -8.111
    2    HA   TRP 779           HA       TRP 779  34.007  -7.415 -10.895
    3    HB2  TRP 779           HB2      TRP 779  33.379  -9.846 -11.346
    4    HB3  TRP 779           HB3      TRP 779  35.028  -9.566 -10.803
    5    HD1  TRP 779           HD1      TRP 779  31.647 -10.954  -9.469
    6    HE1  TRP 779           HE1      TRP 779  32.144 -12.462  -7.499
    7    HE3  TRP 779           HE3      TRP 779  36.689 -10.180  -9.091
    8    HZ2  TRP 779           HZ2      TRP 779  34.391 -13.245  -5.945
    9    HZ3  TRP 779           HZ3      TRP 779  37.920 -11.349  -7.331
   10    HH2  TRP 779           HH2      TRP 779  36.784 -12.848  -5.795

  No H/Q in entry =          10
  In of MODEL   44
    1    H    GLY 780           H        GLY 780  32.303  -7.023  -8.311
    2    HA3  GLY 780           HA2      GLY 780  29.734  -7.444  -9.645
    3    HA2  GLY 780           HA3      GLY 780  29.939  -7.652  -7.902

  No H/Q in entry =           3
  In of MODEL   44
    1    H    LYS 781           H        LYS 781  28.107  -5.857  -8.575
    2    HA   LYS 781           HA       LYS 781  29.378  -3.374  -7.770
    3    HB2  LYS 781           HB2      LYS 781  29.105  -3.748 -10.405
    4    HB3  LYS 781           HB3      LYS 781  27.453  -3.282 -10.048
    5    HG2  LYS 781           HG2      LYS 781  28.604  -1.332 -10.738
    6    HG3  LYS 781           HG3      LYS 781  28.376  -1.197  -8.990
    7    HD2  LYS 781           HD2      LYS 781  30.658  -1.931  -8.597
    8    HD3  LYS 781           HD3      LYS 781  30.896  -2.195 -10.324
    9    HE2  LYS 781           HE2      LYS 781  30.520   0.199 -10.710
   10    HE3  LYS 781           HE3      LYS 781  30.353   0.432  -8.968
   11    HZ2  LYS 781           HZ1      LYS 781  32.773  -0.567 -10.369
   12    HZ1  LYS 781           HZ2      LYS 781  32.642  -0.337  -8.702
   13    HZ3  LYS 781           HZ3      LYS 781  32.563   0.988  -9.750

  No H/Q in entry =          13
  In of MODEL   44
    1    H    CYS 782           H        CYS 782  27.883  -2.189  -6.538
    2    HA   CYS 782           HA       CYS 782  25.291  -3.456  -6.218
    3    HB2  CYS 782           HB2      CYS 782  26.581  -1.197  -4.669
    4    HB3  CYS 782           HB3      CYS 782  24.983  -1.887  -4.352

  No H/Q in entry =           4
  In of MODEL   44
    1    H    ASP 783           H        ASP 783  23.398  -2.447  -6.826
    2    HA   ASP 783           HA       ASP 783  23.444   0.207  -7.881
    3    HB2  ASP 783           HB2      ASP 783  24.384  -1.356  -9.723
    4    HB3  ASP 783           HB3      ASP 783  22.781  -2.077  -9.765

  No H/Q in entry =           4
  In of MODEL   44
    1    H    ALA 784           H        ALA 784  21.092   0.382  -8.969
    2    HA   ALA 784           HA       ALA 784  19.319  -0.523  -6.844
    3    HB3  ALA 784           HB1      ALA 784  17.785   1.160  -7.728
    4    HB2  ALA 784           HB2      ALA 784  18.893   1.475  -9.064
    5    HB1  ALA 784           HB3      ALA 784  19.372   1.860  -7.412

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLU 785           H        GLU 785  20.281  -2.312  -8.909
    2    HA   GLU 785           HA       GLU 785  18.261  -2.875 -10.840
    3    HB2  GLU 785           HB2      GLU 785  20.713  -3.642 -10.876
    4    HB3  GLU 785           HB3      GLU 785  20.279  -4.818  -9.661
    5    HG2  GLU 785           HG2      GLU 785  19.104  -4.725 -12.448
    6    HG3  GLU 785           HG3      GLU 785  20.466  -5.725 -11.979

  No H/Q in entry =           6
  In of MODEL   44
    1    H    SER 786           H        SER 786  19.137  -4.382  -7.737
    2    HA   SER 786           HA       SER 786  16.408  -4.909  -7.133
    3    HB2  SER 786           HB2      SER 786  16.915  -7.401  -6.866
    4    HB3  SER 786           HB3      SER 786  16.776  -6.819  -8.526
    5    HG   SER 786           HG       SER 786  18.792  -7.243  -8.862

  No H/Q in entry =           5
  In of MODEL   44
    1    H    SER 787           H        SER 787  16.779  -6.666  -5.026
    2    HA   SER 787           HA       SER 787  18.123  -5.054  -3.108
    3    HB2  SER 787           HB2      SER 787  17.300  -6.977  -1.625
    4    HB3  SER 787           HB3      SER 787  16.075  -6.007  -2.449
    5    HG   SER 787           HG       SER 787  17.078  -8.553  -3.225

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LYS 788           H        LYS 788  19.343  -7.111  -5.265
    2    HA   LYS 788           HA       LYS 788  21.285  -8.204  -3.426
    3    HB2  LYS 788           HB2      LYS 788  21.778  -9.979  -5.007
    4    HB3  LYS 788           HB3      LYS 788  20.072  -9.957  -4.625
    5    HG2  LYS 788           HG2      LYS 788  19.625  -8.841  -6.772
    6    HG3  LYS 788           HG3      LYS 788  21.349  -8.929  -7.147
    7    HD2  LYS 788           HD2      LYS 788  21.255 -11.375  -6.952
    8    HD3  LYS 788           HD3      LYS 788  19.528 -11.267  -6.612
    9    HE2  LYS 788           HE2      LYS 788  19.196 -10.214  -8.809
   10    HE3  LYS 788           HE3      LYS 788  20.913 -10.429  -9.150
   11    HZ2  LYS 788           HZ1      LYS 788  18.967 -12.611  -8.617
   12    HZ1  LYS 788           HZ2      LYS 788  20.605 -12.825  -8.901
   13    HZ3  LYS 788           HZ3      LYS 788  19.621 -12.232 -10.132

  No H/Q in entry =          13
  In of MODEL   44
    1    H    CYS 789           H        CYS 789  23.397  -8.678  -4.754
    2    HA   CYS 789           HA       CYS 789  24.206  -6.049  -5.727
    3    HB2  CYS 789           HB2      CYS 789  25.562  -7.033  -3.922
    4    HB3  CYS 789           HB3      CYS 789  25.734  -8.521  -4.839

  No H/Q in entry =           4
  In of MODEL   44
    1    H    VAL 790           H        VAL 790  25.083  -5.934  -7.827
    2    HA   VAL 790           HA       VAL 790  24.109  -8.182  -9.410
    3    HB   VAL 790           HB       VAL 790  22.956  -6.034  -9.854
    4   HG13  VAL 790          HG11      VAL 790  24.065  -4.188 -11.010
    5   HG12  VAL 790          HG12      VAL 790  25.614  -5.001 -10.787
    6   HG11  VAL 790          HG13      VAL 790  24.702  -4.446  -9.384
    7   HG23  VAL 790          HG21      VAL 790  23.177  -5.993 -12.308
    8   HG22  VAL 790          HG22      VAL 790  23.043  -7.623 -11.659
    9   HG21  VAL 790          HG23      VAL 790  24.611  -7.010 -12.178

  No H/Q in entry =           9
  In of MODEL   44
    1    H    CYS 791           H        CYS 791  25.319  -9.107 -10.858
    2    HA   CYS 791           HA       CYS 791  28.173  -8.706 -10.475
    3    HB2  CYS 791           HB2      CYS 791  26.687 -10.989 -11.766
    4    HB3  CYS 791           HB3      CYS 791  28.373 -10.972 -11.254

  No H/Q in entry =           4
  In of MODEL   44
    1    H    ARG 792           H        ARG 792  29.456  -8.103 -12.121
    2    HA   ARG 792           HA       ARG 792  28.116  -7.420 -14.587
    3    HB2  ARG 792           HB2      ARG 792  30.635  -6.447 -13.295
    4    HB3  ARG 792           HB3      ARG 792  30.322  -6.206 -15.008
    5    HG2  ARG 792           HG2      ARG 792  28.476  -5.268 -12.820
    6    HG3  ARG 792           HG3      ARG 792  29.721  -4.265 -13.565
    7    HD2  ARG 792           HD2      ARG 792  27.670  -3.747 -14.675
    8    HD3  ARG 792           HD3      ARG 792  28.615  -4.720 -15.795
    9    HE   ARG 792           HE       ARG 792  26.374  -5.740 -14.185
   10   HH11  ARG 792          HH11      ARG 792  28.301  -5.947 -17.196
   11   HH12  ARG 792          HH12      ARG 792  27.143  -6.843 -18.043
   12   HH21  ARG 792          HH21      ARG 792  24.768  -7.034 -15.407
   13   HH22  ARG 792          HH22      ARG 792  25.124  -7.506 -16.987

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLU 793           H        GLU 793  29.901  -7.450 -16.462
    2    HA   GLU 793           HA       GLU 793  30.488 -10.281 -16.688
    3    HB2  GLU 793           HB2      GLU 793  30.391  -8.031 -18.686
    4    HB3  GLU 793           HB3      GLU 793  30.770  -9.699 -19.085
    5    HG2  GLU 793           HG2      GLU 793  28.576 -10.416 -18.445
    6    HG3  GLU 793           HG3      GLU 793  28.197  -8.815 -17.812

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ALA 794           H        ALA 794  32.509 -10.602 -18.129
    2    HA   ALA 794           HA       ALA 794  34.758  -9.928 -16.588
    3    HB1  ALA 794           HB1      ALA 794  34.658 -10.981 -19.411
    4    HB2  ALA 794           HB2      ALA 794  34.591 -11.961 -17.950
    5    HB3  ALA 794           HB3      ALA 794  36.047 -11.040 -18.328

  No H/Q in entry =           5
  In of MODEL   44
    1    H    SER 795           H        SER 795  33.212  -8.350 -19.201
    2    HA   SER 795           HA       SER 795  35.405  -6.844 -20.071
    3    HB2  SER 795           HB2      SER 795  32.456  -6.386 -20.484
    4    HB3  SER 795           HB3      SER 795  33.771  -5.679 -21.430
    5    HG   SER 795           HG       SER 795  32.586  -7.887 -21.942

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLU 796           H        GLU 796  33.374  -6.540 -17.312
    2    HA   GLU 796           HA       GLU 796  33.982  -3.685 -17.062
    3    HB2  GLU 796           HB2      GLU 796  32.060  -5.414 -15.513
    4    HB3  GLU 796           HB3      GLU 796  32.425  -3.757 -15.079
    5    HG2  GLU 796           HG2      GLU 796  30.390  -3.653 -16.231
    6    HG3  GLU 796           HG3      GLU 796  31.597  -3.123 -17.388

  No H/Q in entry =           6
  In of MODEL   44
    1    H    CYS 797           H        CYS 797  35.943  -5.619 -16.816
    2    HA   CYS 797           HA       CYS 797  36.634  -6.105 -14.109
    3    HB2  CYS 797           HB2      CYS 797  37.393  -7.430 -15.937
    4    HB3  CYS 797           HB3      CYS 797  38.249  -6.056 -16.660

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLU 798           H        GLU 798  36.612  -4.289 -12.942
    2    HA   GLU 798           HA       GLU 798  37.982  -1.848 -13.851
    3    HB2  GLU 798           HB2      GLU 798  36.243  -2.254 -11.421
    4    HB3  GLU 798           HB3      GLU 798  36.852  -0.715 -12.007
    5    HG2  GLU 798           HG2      GLU 798  35.554  -1.024 -14.081
    6    HG3  GLU 798           HG3      GLU 798  34.904  -2.523 -13.420

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU 799           H        GLU 799  39.086  -4.398 -12.542
    2    HA   GLU 799           HA       GLU 799  41.071  -3.049 -10.912
    3    HB2  GLU 799           HB2      GLU 799  39.477  -4.065  -9.307
    4    HB3  GLU 799           HB3      GLU 799  39.531  -5.580 -10.179
    5    HG2  GLU 799           HG2      GLU 799  40.784  -5.572  -8.029
    6    HG3  GLU 799           HG3      GLU 799  41.756  -6.016  -9.428

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLU 800           H        GLU 800  43.056  -4.544 -10.896
    2    HA   GLU 800           HA       GLU 800  43.260  -5.554 -13.580
    3    HB2  GLU 800           HB2      GLU 800  45.641  -5.953 -13.053
    4    HB3  GLU 800           HB3      GLU 800  45.151  -4.295 -12.750
    5    HG2  GLU 800           HG2      GLU 800  44.997  -4.830 -10.348
    6    HG3  GLU 800           HG3      GLU 800  45.571  -6.456 -10.702

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLY 801           H        GLY 801  43.348  -6.879 -10.288
    2    HA3  GLY 801           HA2      GLY 801  42.805  -8.940  -9.565
    3    HA2  GLY 801           HA3      GLY 801  42.294  -9.278 -11.208

  No H/Q in entry =           3
  In of MODEL   44
    1    H    PHE 802           H        PHE 802  43.704 -10.990  -9.353
    2    HA   PHE 802           HA       PHE 802  46.232 -11.344 -10.647
    3    HB2  PHE 802           HB2      PHE 802  44.755 -12.837  -8.513
    4    HB3  PHE 802           HB3      PHE 802  46.152 -13.552  -9.316
    5    HD1  PHE 802           HD1      PHE 802  45.026 -10.695  -7.278
    6    HD2  PHE 802           HD2      PHE 802  48.319 -12.889  -8.811
    7    HE1  PHE 802           HE1      PHE 802  46.545  -9.438  -5.832
    8    HE2  PHE 802           HE2      PHE 802  49.820 -11.680  -7.367
    9    HZ   PHE 802           HZ       PHE 802  48.952  -9.926  -5.857

  No H/Q in entry =           9
  In of MODEL   44
    1    H    SER 803           H        SER 803  46.714 -12.788 -12.140
    2    HA   SER 803           HA       SER 803  44.499 -13.949 -13.574
    3    HB2  SER 803           HB2      SER 803  47.460 -14.144 -14.153
    4    HB3  SER 803           HB3      SER 803  46.109 -14.438 -15.267
    5    HG   SER 803           HG       SER 803  45.648 -12.096 -14.366

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ILE 804           H        ILE 804  43.880 -15.931 -13.244
    2    HA   ILE 804           HA       ILE 804  45.645 -17.683 -11.722
    3    HB   ILE 804           HB       ILE 804  43.809 -18.556 -10.407
    4   HG12  ILE 804          HG12      ILE 804  41.946 -18.306 -12.053
    5   HG13  ILE 804          HG13      ILE 804  41.523 -17.737 -10.449
    6   HG23  ILE 804          HG21      ILE 804  44.921 -16.635  -9.489
    7   HG22  ILE 804          HG22      ILE 804  43.207 -16.586  -9.058
    8   HG21  ILE 804          HG23      ILE 804  43.825 -15.558 -10.353
    9   HD11  ILE 804          HD11      ILE 804  41.874 -15.411 -11.243
   10   HD13  ILE 804          HD12      ILE 804  40.585 -16.274 -12.065
   11   HD12  ILE 804          HD13      ILE 804  42.130 -16.048 -12.874

  No H/Q in entry =          11
  In of MODEL   44
    1    H    CYS 805           H        CYS 805  44.807 -20.042 -11.845
    2    HA   CYS 805           HA       CYS 805  44.388 -20.522 -14.696
    3    HB2  CYS 805           HB2      CYS 805  46.475 -21.427 -13.685
    4    HB3  CYS 805           HB3      CYS 805  45.494 -22.377 -12.567

  No H/Q in entry =           4
  In of MODEL   44
    1    H    VAL 806           H        VAL 806  42.377 -21.075 -15.251
    2    HA   VAL 806           HA       VAL 806  40.831 -22.634 -13.310
    3    HB   VAL 806           HB       VAL 806  39.744 -20.367 -14.990
    4   HG12  VAL 806          HG11      VAL 806  37.705 -20.651 -13.674
    5   HG11  VAL 806          HG12      VAL 806  38.380 -22.137 -12.979
    6   HG13  VAL 806          HG13      VAL 806  38.068 -22.030 -14.709
    7   HG22  VAL 806          HG21      VAL 806  41.034 -19.452 -13.260
    8   HG21  VAL 806          HG22      VAL 806  40.311 -20.506 -12.051
    9   HG23  VAL 806          HG23      VAL 806  39.339 -19.236 -12.817

  No H/Q in entry =           9
  In of MODEL   44
    1    H    GLU 807           H        GLU 807  39.888 -24.331 -14.141
    2    HA   GLU 807           HA       GLU 807  40.263 -24.889 -16.930
    3    HB2  GLU 807           HB2      GLU 807  40.621 -26.612 -15.141
    4    HB3  GLU 807           HB3      GLU 807  38.895 -26.555 -14.812
    5    HG2  GLU 807           HG2      GLU 807  38.420 -27.269 -17.052
    6    HG3  GLU 807           HG3      GLU 807  40.160 -27.295 -17.415

  No H/Q in entry =           6
  In of MODEL   44
    1    H    VAL 808           H        VAL 808  38.914 -24.502 -18.390
    2    HA   VAL 808           HA       VAL 808  36.063 -24.397 -17.922
    3    HB   VAL 808           HB       VAL 808  36.908 -22.063 -17.669
    4   HG11  VAL 808          HG11      VAL 808  38.880 -22.133 -19.026
    5   HG13  VAL 808          HG12      VAL 808  37.826 -20.826 -19.563
    6   HG12  VAL 808          HG13      VAL 808  37.907 -22.332 -20.483
    7   HG23  VAL 808          HG21      VAL 808  35.446 -20.976 -19.310
    8   HG22  VAL 808          HG22      VAL 808  34.675 -22.352 -18.517
    9   HG21  VAL 808          HG23      VAL 808  35.298 -22.512 -20.167

  No H/Q in entry =           9
  In of MODEL   44
    1    H    ASN 809           H        ASN 809  35.007 -25.167 -19.816
    2    HA   ASN 809           HA       ASN 809  34.757 -26.117 -21.884
    3    HB2  ASN 809           HB2      ASN 809  37.013 -24.269 -22.350
    4    HB3  ASN 809           HB3      ASN 809  36.681 -25.443 -23.630
    5   HD21  ASN 809          HD21      ASN 809  35.884 -22.499 -22.152
    6   HD22  ASN 809          HD22      ASN 809  34.522 -22.079 -23.129

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLY 810           H        GLY 810  36.819 -27.147 -19.775
    2    HA3  GLY 810           HA2      GLY 810  37.576 -29.385 -19.714
    3    HA2  GLY 810           HA3      GLY 810  37.724 -29.329 -21.474

  No H/Q in entry =           3
  In of MODEL   44
    1    H    LYS 811           H        LYS 811  38.998 -26.508 -20.671
    2    HA   LYS 811           HA       LYS 811  41.670 -27.670 -20.339
    3    HB2  LYS 811           HB2      LYS 811  42.509 -25.914 -21.851
    4    HB3  LYS 811           HB3      LYS 811  41.434 -27.061 -22.632
    5    HG2  LYS 811           HG2      LYS 811  39.589 -25.408 -22.393
    6    HG3  LYS 811           HG3      LYS 811  40.768 -24.256 -21.769
    7    HD2  LYS 811           HD2      LYS 811  40.876 -25.598 -24.450
    8    HD3  LYS 811           HD3      LYS 811  40.314 -23.949 -24.169
    9    HE2  LYS 811           HE2      LYS 811  42.560 -23.382 -23.261
   10    HE3  LYS 811           HE3      LYS 811  43.083 -25.022 -23.627
   11    HZ1  LYS 811           HZ1      LYS 811  42.137 -23.071 -25.645
   12    HZ3  LYS 811           HZ2      LYS 811  42.741 -24.608 -25.969
   13    HZ2  LYS 811           HZ3      LYS 811  43.739 -23.421 -25.326

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLU 812           H        GLU 812  43.202 -26.432 -19.263
    2    HA   GLU 812           HA       GLU 812  42.106 -24.627 -17.305
    3    HB2  GLU 812           HB2      GLU 812  44.896 -25.662 -17.748
    4    HB3  GLU 812           HB3      GLU 812  44.428 -24.604 -16.426
    5    HG2  GLU 812           HG2      GLU 812  42.927 -26.302 -15.574
    6    HG3  GLU 812           HG3      GLU 812  43.341 -27.360 -16.923

  No H/Q in entry =           6
  In of MODEL   44
    1    H    GLN 813           H        GLN 813  41.595 -22.759 -18.166
    2    HA   GLN 813           HA       GLN 813  43.562 -21.435 -19.854
    3    HB2  GLN 813           HB2      GLN 813  41.325 -21.590 -20.760
    4    HB3  GLN 813           HB3      GLN 813  40.642 -20.821 -19.326
    5    HG2  GLN 813           HG2      GLN 813  41.855 -18.819 -19.835
    6    HG3  GLN 813           HG3      GLN 813  42.542 -19.554 -21.288
    7   HE21  GLN 813          HE21      GLN 813  39.790 -18.060 -19.880
    8   HE22  GLN 813          HE22      GLN 813  38.823 -17.994 -21.305

  No H/Q in entry =           8
  In of MODEL   44
    1    H    THR 814           H        THR 814  44.323 -19.450 -19.323
    2    HA   THR 814           HA       THR 814  44.282 -18.826 -16.484
    3    HB   THR 814           HB       THR 814  45.706 -17.559 -18.741
    4    HG1  THR 814           HG1      THR 814  45.872 -19.944 -17.887
    5   HG21  THR 814          HG21      THR 814  45.680 -16.213 -16.702
    6   HG23  THR 814          HG22      THR 814  47.314 -16.823 -16.975
    7   HG22  THR 814          HG23      THR 814  46.279 -17.580 -15.765

  No H/Q in entry =           7
  In of MODEL   44
    1    H    MET 815           H        MET 815  42.954 -17.344 -15.809
    2    HA   MET 815           HA       MET 815  41.960 -15.410 -17.721
    3    HB2  MET 815           HB2      MET 815  39.695 -15.701 -16.642
    4    HB3  MET 815           HB3      MET 815  40.242 -16.996 -17.694
    5    HG2  MET 815           HG2      MET 815  40.953 -18.244 -15.804
    6    HG3  MET 815           HG3      MET 815  40.366 -17.001 -14.702
    7    HE2  MET 815           HE1      MET 815  37.643 -19.573 -17.399
    8    HE1  MET 815           HE2      MET 815  39.399 -19.738 -17.245
    9    HE3  MET 815           HE3      MET 815  38.713 -18.317 -18.031

  No H/Q in entry =           9
  In of MODEL   44
    1    H    SER 816           H        SER 816  40.769 -13.699 -16.582
    2    HA   SER 816           HA       SER 816  42.532 -12.688 -14.548
    3    HB2  SER 816           HB2      SER 816  40.088 -11.444 -15.811
    4    HB3  SER 816           HB3      SER 816  41.343 -10.616 -14.890
    5    HG   SER 816           HG       SER 816  42.234 -10.362 -16.747

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLU 817           H        GLU 817  41.892 -11.969 -12.578
    2    HA   GLU 817           HA       GLU 817  40.391 -13.498 -10.902
    3    HB2  GLU 817           HB2      GLU 817  42.125 -11.800 -10.409
    4    HB3  GLU 817           HB3      GLU 817  40.916 -10.584 -10.761
    5    HG2  GLU 817           HG2      GLU 817  39.674 -11.105  -8.876
    6    HG3  GLU 817           HG3      GLU 817  40.638 -12.578  -8.562

  No H/Q in entry =           6
  In of MODEL   44
    1    H    CYS 818           H        CYS 818  39.440 -10.305 -12.223
    2    HA   CYS 818           HA       CYS 818  36.852 -10.286 -11.197
    3    HB2  CYS 818           HB2      CYS 818  37.818  -8.948 -13.727
    4    HB3  CYS 818           HB3      CYS 818  36.366  -8.527 -12.826

  No H/Q in entry =           4
  In of MODEL   44
    1    H    GLU 819           H        GLU 819  38.142 -11.538 -14.171
    2    HA   GLU 819           HA       GLU 819  35.789 -12.082 -15.585
    3    HB2  GLU 819           HB2      GLU 819  38.049 -11.935 -16.523
    4    HB3  GLU 819           HB3      GLU 819  38.510 -13.362 -15.630
    5    HG2  GLU 819           HG2      GLU 819  37.204 -14.727 -17.034
    6    HG3  GLU 819           HG3      GLU 819  36.428 -13.323 -17.782

  No H/Q in entry =           6
  In of MODEL   44
    1    H    ALA 820           H        ALA 820  37.934 -14.264 -13.789
    2    HA   ALA 820           HA       ALA 820  36.319 -16.521 -13.945
    3    HB1  ALA 820           HB1      ALA 820  38.683 -16.615 -13.390
    4    HB2  ALA 820           HB2      ALA 820  37.719 -17.454 -12.172
    5    HB3  ALA 820           HB3      ALA 820  38.357 -15.842 -11.840

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLY 821           H        GLY 821  36.416 -13.922 -11.598
    2    HA3  GLY 821           HA2      GLY 821  34.700 -15.119  -9.682
    3    HA2  GLY 821           HA3      GLY 821  35.085 -13.409  -9.808

  No H/Q in entry =           3
  In of MODEL   44
    1    H    ALA 822           H        ALA 822  34.139 -12.708 -12.238
    2    HA   ALA 822           HA       ALA 822  31.408 -12.355 -11.784
    3    HB2  ALA 822           HB1      ALA 822  32.784 -10.831 -13.137
    4    HB3  ALA 822           HB2      ALA 822  31.325 -11.357 -13.969
    5    HB1  ALA 822           HB3      ALA 822  32.887 -12.065 -14.399

  No H/Q in entry =           5
  In of MODEL   44
    1    H    LEU 823           H        LEU 823  33.155 -14.604 -13.810
    2    HA   LEU 823           HA       LEU 823  30.978 -15.794 -15.109
    3    HB2  LEU 823           HB2      LEU 823  33.661 -16.907 -14.320
    4    HB3  LEU 823           HB3      LEU 823  32.526 -17.794 -15.312
    5    HG   LEU 823           HG       LEU 823  33.753 -15.140 -16.045
    6   HD13  LEU 823          HD11      LEU 823  35.062 -16.403 -17.656
    7   HD12  LEU 823          HD12      LEU 823  34.394 -17.915 -17.028
    8   HD11  LEU 823          HD13      LEU 823  35.420 -16.900 -16.007
    9   HD21  LEU 823          HD21      LEU 823  31.974 -17.049 -17.560
   10   HD23  LEU 823          HD22      LEU 823  32.842 -15.700 -18.287
   11   HD22  LEU 823          HD23      LEU 823  31.598 -15.392 -17.079

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ARG 824           H        ARG 824  32.425 -16.445 -11.997
    2    HA   ARG 824           HA       ARG 824  30.906 -18.805 -11.475
    3    HB2  ARG 824           HB2      ARG 824  33.116 -17.906 -10.458
    4    HB3  ARG 824           HB3      ARG 824  32.057 -17.026  -9.379
    5    HG2  ARG 824           HG2      ARG 824  31.233 -18.960  -8.379
    6    HG3  ARG 824           HG3      ARG 824  31.802 -20.004  -9.681
    7    HD2  ARG 824           HD2      ARG 824  33.439 -18.542  -7.626
    8    HD3  ARG 824           HD3      ARG 824  33.361 -20.298  -7.897
    9    HE   ARG 824           HE       ARG 824  34.214 -19.296 -10.235
   10   HH11  ARG 824          HH11      ARG 824  35.483 -19.362  -6.980
   11   HH12  ARG 824          HH12      ARG 824  36.975 -18.686  -7.332
   12   HH21  ARG 824          HH21      ARG 824  36.257 -18.286 -10.820
   13   HH22  ARG 824          HH22      ARG 824  37.456 -18.057  -9.622

  No H/Q in entry =          13
  In of MODEL   44
    1    H    CYS 825           H        CYS 825  30.648 -15.417 -10.772
    2    HA   CYS 825           HA       CYS 825  28.418 -15.459  -9.123
    3    HB2  CYS 825           HB2      CYS 825  29.711 -13.428 -10.837
    4    HB3  CYS 825           HB3      CYS 825  28.225 -13.040  -9.998

  No H/Q in entry =           4
  In of MODEL   44
    1    H    ARG 826           H        ARG 826  28.652 -15.101 -12.680
    2    HA   ARG 826           HA       ARG 826  25.849 -14.797 -12.976
    3    HB2  ARG 826           HB2      ARG 826  26.216 -15.342 -15.392
    4    HB3  ARG 826           HB3      ARG 826  27.155 -13.956 -14.807
    5    HG2  ARG 826           HG2      ARG 826  29.107 -15.272 -14.859
    6    HG3  ARG 826           HG3      ARG 826  28.187 -16.744 -15.193
    7    HD2  ARG 826           HD2      ARG 826  28.324 -14.326 -17.007
    8    HD3  ARG 826           HD3      ARG 826  29.234 -15.822 -17.230
    9    HE   ARG 826           HE       ARG 826  26.543 -16.467 -16.973
   10   HH11  ARG 826          HH11      ARG 826  28.604 -14.869 -19.417
   11   HH12  ARG 826          HH12      ARG 826  27.572 -15.345 -20.690
   12   HH21  ARG 826          HH21      ARG 826  25.200 -17.055 -18.782
   13   HH22  ARG 826          HH22      ARG 826  25.685 -16.572 -20.343

  No H/Q in entry =          13
  In of MODEL   44
    1    H    GLY 827           H        GLY 827  27.899 -17.537 -12.822
    2    HA3  GLY 827           HA2      GLY 827  26.769 -19.625 -12.110
    3    HA2  GLY 827           HA3      GLY 827  25.500 -19.222 -13.259

  No H/Q in entry =           3
  In of MODEL   44
    1    H    GLN 828           H        GLN 828  28.610 -18.561 -14.359
    2    HA   GLN 828           HA       GLN 828  28.576 -20.613 -16.341
    3    HB2  GLN 828           HB2      GLN 828  29.674 -18.444 -16.708
    4    HB3  GLN 828           HB3      GLN 828  30.814 -18.805 -15.422
    5    HG2  GLN 828           HG2      GLN 828  31.800 -19.134 -17.655
    6    HG3  GLN 828           HG3      GLN 828  31.737 -20.627 -16.715
    7   HE21  GLN 828          HE21      GLN 828  30.335 -18.882 -19.369
    8   HE22  GLN 828          HE22      GLN 828  29.578 -20.245 -20.099

  No H/Q in entry =           8
  In of MODEL   44
    1    H    SER 829           H        SER 829  29.889 -22.483 -16.459
    2    HA   SER 829           HA       SER 829  30.596 -23.567 -13.862
    3    HB2  SER 829           HB2      SER 829  30.537 -24.873 -16.594
    4    HB3  SER 829           HB3      SER 829  30.794 -25.710 -15.062
    5    HG   SER 829           HG       SER 829  28.486 -24.141 -15.559

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ILE 830           H        ILE 830  32.541 -23.108 -13.135
    2    HA   ILE 830           HA       ILE 830  34.841 -23.381 -14.897
    3    HB   ILE 830           HB       ILE 830  35.966 -21.472 -13.982
    4   HG12  ILE 830          HG12      ILE 830  34.893 -21.405 -11.693
    5   HG13  ILE 830          HG13      ILE 830  34.991 -19.812 -12.382
    6   HG23  ILE 830          HG21      ILE 830  34.747 -21.025 -15.969
    7   HG22  ILE 830          HG22      ILE 830  34.654 -19.597 -14.932
    8   HG21  ILE 830          HG23      ILE 830  33.280 -20.699 -15.047
    9   HD12  ILE 830          HD11      ILE 830  32.560 -21.560 -12.198
   10   HD11  ILE 830          HD12      ILE 830  32.623 -20.016 -13.048
   11   HD13  ILE 830          HD13      ILE 830  32.913 -20.075 -11.312

  No H/Q in entry =          11
  In of MODEL   44
    1    H    SER 831           H        SER 831  36.711 -24.087 -13.844
    2    HA   SER 831           HA       SER 831  36.359 -24.835 -11.057
    3    HB2  SER 831           HB2      SER 831  37.401 -26.417 -13.372
    4    HB3  SER 831           HB3      SER 831  37.627 -26.911 -11.706
    5    HG   SER 831           HG       SER 831  35.215 -26.598 -11.629

  No H/Q in entry =           5
  In of MODEL   44
    1    H    VAL 832           H        VAL 832  37.705 -23.380 -10.141
    2    HA   VAL 832           HA       VAL 832  40.138 -22.470 -11.285
    3    HB   VAL 832           HB       VAL 832  39.235 -22.393  -8.395
    4   HG13  VAL 832          HG11      VAL 832  40.839 -20.529  -8.142
    5   HG12  VAL 832          HG12      VAL 832  41.370 -20.768  -9.805
    6   HG11  VAL 832          HG13      VAL 832  41.655 -22.025  -8.600
    7   HG22  VAL 832          HG21      VAL 832  38.525 -20.112  -8.855
    8   HG21  VAL 832          HG22      VAL 832  37.672 -21.266  -9.879
    9   HG23  VAL 832          HG23      VAL 832  38.982 -20.297 -10.544

  No H/Q in entry =           9
  In of MODEL   44
    1    H    THR 833           H        THR 833  41.761 -23.849 -11.677
    2    HA   THR 833           HA       THR 833  42.069 -26.132 -10.013
    3    HB   THR 833           HB       THR 833  43.948 -26.678 -11.604
    4    HG1  THR 833           HG1      THR 833  44.219 -25.397 -13.402
    5   HG21  THR 833          HG21      THR 833  41.256 -26.069 -12.854
    6   HG23  THR 833          HG22      THR 833  41.697 -27.562 -12.027
    7   HG22  THR 833          HG23      THR 833  42.472 -27.132 -13.549

  No H/Q in entry =           7
  In of MODEL   44
    1    H    SER 834           H        SER 834  43.671 -23.060 -10.539
    2    HA   SER 834           HA       SER 834  45.070 -23.343  -8.032
    3    HB2  SER 834           HB2      SER 834  46.610 -23.002 -10.612
    4    HB3  SER 834           HB3      SER 834  47.302 -22.907  -9.000
    5    HG   SER 834           HG       SER 834  45.878 -25.142  -9.248

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ILE 835           H        ILE 835  45.942 -21.324  -7.272
    2    HA   ILE 835           HA       ILE 835  44.575 -18.964  -8.352
    3    HB   ILE 835           HB       ILE 835  45.411 -17.851  -6.287
    4   HG12  ILE 835          HG12      ILE 835  46.020 -19.402  -4.367
    5   HG13  ILE 835          HG13      ILE 835  46.384 -20.624  -5.566
    6   HG23  ILE 835          HG21      ILE 835  43.210 -18.684  -6.382
    7   HG22  ILE 835          HG22      ILE 835  43.903 -19.019  -4.777
    8   HG21  ILE 835          HG23      ILE 835  43.782 -20.309  -5.982
    9   HD11  ILE 835          HD11      ILE 835  48.113 -19.147  -6.484
   10   HD13  ILE 835          HD12      ILE 835  48.356 -19.549  -4.773
   11   HD12  ILE 835          HD13      ILE 835  47.714 -17.969  -5.225

  No H/Q in entry =          11
  In of MODEL   44
    1    H    ARG 836           H        ARG 836  47.304 -20.461  -9.011
    2    HA   ARG 836           HA       ARG 836  48.626 -17.973  -9.751
    3    HB2  ARG 836           HB2      ARG 836  50.671 -19.387 -10.194
    4    HB3  ARG 836           HB3      ARG 836  50.129 -19.461  -8.535
    5    HG2  ARG 836           HG2      ARG 836  50.756 -21.642  -9.066
    6    HG3  ARG 836           HG3      ARG 836  48.996 -21.635  -9.155
    7    HD2  ARG 836           HD2      ARG 836  49.163 -21.390 -11.596
    8    HD3  ARG 836           HD3      ARG 836  50.914 -21.510 -11.466
    9    HE   ARG 836           HE       ARG 836  50.032 -23.708 -10.194
   10   HH11  ARG 836          HH11      ARG 836  49.502 -22.369 -13.436
   11   HH12  ARG 836          HH12      ARG 836  49.192 -23.912 -14.130
   12   HH21  ARG 836          HH21      ARG 836  49.591 -25.810 -11.221
   13   HH22  ARG 836          HH22      ARG 836  49.268 -25.826 -12.893

  No H/Q in entry =          13
  In of MODEL   44
    1    HA   PRO 837           HA       PRO 837  47.199 -18.550 -13.839
    2    HB2  PRO 837           HB2      PRO 837  49.148 -17.448 -15.354
    3    HB3  PRO 837           HB3      PRO 837  48.082 -16.483 -14.325
    4    HG2  PRO 837           HG2      PRO 837  50.871 -17.416 -13.818
    5    HG3  PRO 837           HG3      PRO 837  50.140 -15.829 -13.495
    6    HD2  PRO 837           HD2      PRO 837  50.504 -17.715 -11.575
    7    HD3  PRO 837           HD3      PRO 837  49.179 -16.537 -11.534

  No H/Q in entry =           7
  In of MODEL   44
    1    H    CYS 838           H        CYS 838  47.652 -19.533 -15.962
    2    HA   CYS 838           HA       CYS 838  49.594 -21.704 -15.769
    3    HB2  CYS 838           HB2      CYS 838  47.212 -22.401 -16.042
    4    HB3  CYS 838           HB3      CYS 838  47.106 -21.406 -17.486

  No H/Q in entry =           4
  In of MODEL   44
    1    H    ALA 839           H        ALA 839  50.347 -22.219 -18.260
    2    HA   ALA 839           HA       ALA 839  51.321 -19.716 -19.321
    3    HB1  ALA 839           HB1      ALA 839  52.805 -21.653 -19.160
    4    HB3  ALA 839           HB2      ALA 839  52.640 -21.108 -20.831
    5    HB2  ALA 839           HB3      ALA 839  51.770 -22.539 -20.279

  No H/Q in entry =           5
  In of MODEL   44
    1    H    ALA 840           H        ALA 840  48.465 -20.849 -19.506
    2    HA   ALA 840           HA       ALA 840  47.774 -21.180 -22.213
    3    HB2  ALA 840           HB1      ALA 840  46.244 -21.780 -20.380
    4    HB3  ALA 840           HB2      ALA 840  45.470 -20.681 -21.518
    5    HB1  ALA 840           HB3      ALA 840  46.070 -20.075 -19.977

  No H/Q in entry =           5
  In of MODEL   44
    1    H    GLU 841           H        GLU 841  47.919 -18.428 -20.134
    2    HA   GLU 841           HA       GLU 841  47.529 -16.194 -20.436
    3    HB2  GLU 841           HB2      GLU 841  49.751 -16.668 -22.437
    4    HB3  GLU 841           HB3      GLU 841  49.381 -15.128 -21.669
    5    HG2  GLU 841           HG2      GLU 841  49.809 -16.228 -19.454
    6    HG3  GLU 841           HG3      GLU 841  50.381 -17.635 -20.337

  No H/Q in entry =           6
  In of MODEL   44
    1    H    THR 842           H        THR 842  45.514 -15.963 -21.126
    2    HA   THR 842           HA       THR 842  44.681 -16.421 -23.766
    3    HB   THR 842           HB       THR 842  43.264 -14.862 -21.605
    4    HG1  THR 842           HG1      THR 842  42.903 -16.717 -20.631
    5   HG22  THR 842          HG21      THR 842  42.251 -16.609 -23.870
    6   HG21  THR 842          HG22      THR 842  42.216 -14.848 -23.856
    7   HG23  THR 842          HG23      THR 842  41.248 -15.757 -22.696

  No H/Q in entry =           7
  In of MODEL   44
    1    H    GLN 843           H        GLN 843  44.643 -15.099 -25.442
    2    HA   GLN 843           HA       GLN 843  44.560 -12.243 -25.074
    3    HB2  GLN 843           HB2      GLN 843  46.990 -12.897 -25.379
    4    HB3  GLN 843           HB3      GLN 843  46.544 -13.573 -26.939
    5    HG2  GLN 843           HG2      GLN 843  47.482 -11.380 -27.250
    6    HG3  GLN 843           HG3      GLN 843  45.771 -11.366 -27.670
    7   HE21  GLN 843          HE21      GLN 843  47.010 -11.344 -24.379
    8   HE22  GLN 843          HE22      GLN 843  46.483  -9.757 -23.997

  No H/Q in entry =           8
  In of MODEL   45
    1    H1   GLY 689           H3       GLY 689  52.806   2.057 -26.105
    2    H2   GLY 689           H2       GLY 689  52.745   0.529 -26.827
    3    H3   GLY 689           H1       GLY 689  52.438   1.931 -27.726
    4    HA2  GLY 689           HA2      GLY 689  50.767   0.865 -25.548
    5    HA3  GLY 689           HA3      GLY 689  50.355   0.910 -27.258

  No H/Q in entry =           5
  In of MODEL   45
    1    H    SER 690           H        SER 690  49.425   2.747 -28.085
    2    HA   SER 690           HA       SER 690  49.695   5.191 -26.597
    3    HB2  SER 690           HB2      SER 690  48.211   4.624 -29.176
    4    HB3  SER 690           HB3      SER 690  48.547   6.219 -28.502
    5    HG   SER 690           HG       SER 690  50.588   6.067 -29.045

  No H/Q in entry =           5
  In of MODEL   45
    1    H    HIS 691           H        HIS 691  48.606   4.819 -24.728
    2    HA   HIS 691           HA       HIS 691  46.928   5.021 -23.270
    3    HB2  HIS 691           HB2      HIS 691  45.364   5.887 -25.693
    4    HB3  HIS 691           HB3      HIS 691  44.642   5.821 -24.092
    5    HD1  HIS 691           HD1      HIS 691  44.647   8.508 -25.304
    6    HD2  HIS 691           HD2      HIS 691  47.915   7.109 -23.170
    7    HE1  HIS 691           HE1      HIS 691  45.896  10.556 -24.540
    8    HE2  HIS 691           HE2      HIS 691  47.775   9.678 -23.135

  No H/Q in entry =           8
  In of MODEL   45
    1    H    MET 692           H        MET 692  47.232   2.521 -25.048
    2    HA   MET 692           HA       MET 692  44.715   1.208 -24.336
    3    HB2  MET 692           HB2      MET 692  45.770   0.699 -26.533
    4    HB3  MET 692           HB3      MET 692  47.181   0.083 -25.694
    5    HG2  MET 692           HG2      MET 692  45.726  -1.719 -26.509
    6    HG3  MET 692           HG3      MET 692  45.889  -1.733 -24.756
    7    HE3  MET 692           HE1      MET 692  42.125  -0.138 -26.924
    8    HE2  MET 692           HE2      MET 692  43.530  -0.774 -27.776
    9    HE1  MET 692           HE3      MET 692  43.654   0.737 -26.877

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ASN 693           H        ASN 693  47.956   1.565 -23.286
    2    HA   ASN 693           HA       ASN 693  47.402   0.434 -20.776
    3    HB2  ASN 693           HB2      ASN 693  49.267  -1.192 -20.772
    4    HB3  ASN 693           HB3      ASN 693  48.079  -1.636 -21.980
    5   HD21  ASN 693          HD21      ASN 693  50.825  -2.426 -21.742
    6   HD22  ASN 693          HD22      ASN 693  51.636  -1.950 -23.181

  No H/Q in entry =           6
  In of MODEL   45
    1    HA   PRO 694           HA       PRO 694  50.193   3.744 -20.107
    2    HB2  PRO 694           HB2      PRO 694  50.834   3.408 -17.513
    3    HB3  PRO 694           HB3      PRO 694  49.218   3.898 -18.025
    4    HG2  PRO 694           HG2      PRO 694  50.194   1.236 -17.118
    5    HG3  PRO 694           HG3      PRO 694  48.623   2.003 -16.850
    6    HD2  PRO 694           HD2      PRO 694  49.161   0.053 -18.770
    7    HD3  PRO 694           HD3      PRO 694  47.770   1.152 -18.781

  No H/Q in entry =           7
  In of MODEL   45
    1    H    LEU 695           H        LEU 695  52.135   3.789 -21.027
    2    HA   LEU 695           HA       LEU 695  54.125   1.814 -20.241
    3    HB2  LEU 695           HB2      LEU 695  54.126   3.817 -22.504
    4    HB3  LEU 695           HB3      LEU 695  55.574   2.962 -22.030
    5    HG   LEU 695           HG       LEU 695  54.659   1.914 -23.966
    6   HD12  LEU 695          HD11      LEU 695  54.114   0.191 -21.567
    7   HD11  LEU 695          HD12      LEU 695  55.669   0.432 -22.364
    8   HD13  LEU 695          HD13      LEU 695  54.351  -0.366 -23.222
    9   HD22  LEU 695          HD21      LEU 695  52.359   2.640 -23.817
   10   HD21  LEU 695          HD22      LEU 695  52.101   1.598 -22.417
   11   HD23  LEU 695          HD23      LEU 695  52.435   0.888 -23.998

  No H/Q in entry =          11
  In of MODEL   45
    1    H    THR 696           H        THR 696  54.710   2.388 -18.286
    2    HA   THR 696           HA       THR 696  55.401   5.105 -17.733
    3    HB   THR 696           HB       THR 696  54.289   3.720 -16.007
    4    HG1  THR 696           HG1      THR 696  55.216   4.873 -14.632
    5   HG22  THR 696          HG21      THR 696  55.549   1.997 -14.780
    6   HG21  THR 696          HG22      THR 696  56.879   2.163 -15.928
    7   HG23  THR 696          HG23      THR 696  55.318   1.551 -16.472

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLN 697           H        GLN 697  57.422   5.899 -17.363
    2    HA   GLN 697           HA       GLN 697  59.514   4.882 -18.939
    3    HB2  GLN 697           HB2      GLN 697  59.499   6.989 -16.853
    4    HB3  GLN 697           HB3      GLN 697  60.857   6.657 -17.920
    5    HG2  GLN 697           HG2      GLN 697  59.267   7.014 -19.846
    6    HG3  GLN 697           HG3      GLN 697  58.127   7.655 -18.660
    7   HE21  GLN 697          HE21      GLN 697  60.267   8.707 -17.029
    8   HE22  GLN 697          HE22      GLN 697  60.879  10.066 -17.863

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ALA 698           H        ALA 698  59.045   4.979 -15.527
    2    HA   ALA 698           HA       ALA 698  61.321   3.188 -15.200
    3    HB1  ALA 698           HB1      ALA 698  61.211   5.099 -13.655
    4    HB2  ALA 698           HB2      ALA 698  61.095   3.563 -12.792
    5    HB3  ALA 698           HB3      ALA 698  59.650   4.532 -13.072

  No H/Q in entry =           5
  In of MODEL   45
    1    H    VAL 699           H        VAL 699  60.377   1.484 -16.192
    2    HA   VAL 699           HA       VAL 699  57.976   0.367 -15.098
    3    HB   VAL 699           HB       VAL 699  58.263   0.238 -17.513
    4   HG13  VAL 699          HG11      VAL 699  60.658   0.166 -17.713
    5   HG12  VAL 699          HG12      VAL 699  59.941  -1.186 -18.590
    6   HG11  VAL 699          HG13      VAL 699  60.696  -1.455 -17.020
    7   HG23  VAL 699          HG21      VAL 699  57.830  -2.156 -17.894
    8   HG22  VAL 699          HG22      VAL 699  56.942  -1.519 -16.509
    9   HG21  VAL 699          HG23      VAL 699  58.385  -2.502 -16.255

  No H/Q in entry =           9
  In of MODEL   45
    1    HA   PRO 700           HA       PRO 700  60.372  -1.843 -12.126
    2    HB2  PRO 700           HB2      PRO 700  58.337  -2.750 -10.647
    3    HB3  PRO 700           HB3      PRO 700  58.808  -1.047 -10.649
    4    HG2  PRO 700           HG2      PRO 700  56.541  -2.387 -12.050
    5    HG3  PRO 700           HG3      PRO 700  56.581  -0.807 -11.250
    6    HD2  PRO 700           HD2      PRO 700  56.802  -1.201 -13.973
    7    HD3  PRO 700           HD3      PRO 700  57.383   0.234 -13.105

  No H/Q in entry =           7
  In of MODEL   45
    1    H    LYS 701           H        LYS 701  61.023  -3.866 -11.777
    2    HA   LYS 701           HA       LYS 701  60.000  -5.980 -13.503
    3    HB2  LYS 701           HB2      LYS 701  62.444  -5.792 -11.737
    4    HB3  LYS 701           HB3      LYS 701  62.067  -7.159 -12.769
    5    HG2  LYS 701           HG2      LYS 701  62.472  -4.369 -13.756
    6    HG3  LYS 701           HG3      LYS 701  63.769  -5.573 -13.687
    7    HD2  LYS 701           HD2      LYS 701  62.377  -7.018 -15.183
    8    HD3  LYS 701           HD3      LYS 701  61.217  -5.694 -15.308
    9    HE2  LYS 701           HE2      LYS 701  62.905  -4.262 -16.295
   10    HE3  LYS 701           HE3      LYS 701  64.122  -5.520 -16.092
   11    HZ2  LYS 701           HZ1      LYS 701  63.285  -5.418 -18.343
   12    HZ1  LYS 701           HZ2      LYS 701  61.716  -5.746 -17.831
   13    HZ3  LYS 701           HZ3      LYS 701  62.940  -6.899 -17.644

  No H/Q in entry =          13
  In of MODEL   45
    1    H    CYS 702           H        CYS 702  58.228  -5.382 -11.573
    2    HA   CYS 702           HA       CYS 702  58.617  -7.353  -9.430
    3    HB2  CYS 702           HB2      CYS 702  56.499  -6.270  -8.532
    4    HB3  CYS 702           HB3      CYS 702  57.952  -5.366  -8.284

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLN 703           H        GLN 703  57.287  -8.973  -9.136
    2    HA   GLN 703           HA       GLN 703  55.433  -9.711 -11.232
    3    HB2  GLN 703           HB2      GLN 703  55.838 -10.962  -8.514
    4    HB3  GLN 703           HB3      GLN 703  55.129 -11.708  -9.934
    5    HG2  GLN 703           HG2      GLN 703  58.024 -10.973  -9.522
    6    HG3  GLN 703           HG3      GLN 703  57.340 -12.592  -9.598
    7   HE21  GLN 703          HE21      GLN 703  58.424  -9.865 -11.381
    8   HE22  GLN 703          HE22      GLN 703  58.320 -10.562 -12.948

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ARG 704           H        ARG 704  53.214 -10.594 -10.150
    2    HA   ARG 704           HA       ARG 704  51.953  -8.103  -9.568
    3    HB2  ARG 704           HB2      ARG 704  50.799 -10.869  -9.877
    4    HB3  ARG 704           HB3      ARG 704  49.819  -9.417  -9.654
    5    HG2  ARG 704           HG2      ARG 704  50.554  -8.471 -11.636
    6    HG3  ARG 704           HG3      ARG 704  51.865  -9.657 -11.813
    7    HD2  ARG 704           HD2      ARG 704  50.098 -11.358 -12.161
    8    HD3  ARG 704           HD3      ARG 704  48.901 -10.048 -12.145
    9    HE   ARG 704           HE       ARG 704  50.835  -9.283 -13.938
   10   HH11  ARG 704          HH11      ARG 704  48.614 -12.013 -13.754
   11   HH12  ARG 704          HH12      ARG 704  48.510 -12.186 -15.426
   12   HH21  ARG 704          HH21      ARG 704  50.709  -9.568 -16.208
   13   HH22  ARG 704          HH22      ARG 704  49.708 -10.812 -16.846

  No H/Q in entry =          13
  In of MODEL   45
    1    H    TRP 705           H        TRP 705  53.185 -10.485  -7.554
    2    HA   TRP 705           HA       TRP 705  51.660  -9.553  -5.235
    3    HB2  TRP 705           HB2      TRP 705  52.855 -11.420  -4.068
    4    HB3  TRP 705           HB3      TRP 705  51.837 -11.946  -5.400
    5    HD1  TRP 705           HD1      TRP 705  55.489 -11.732  -4.327
    6    HE1  TRP 705           HE1      TRP 705  56.911 -13.166  -5.899
    7    HE3  TRP 705           HE3      TRP 705  51.937 -12.850  -7.807
    8    HZ2  TRP 705           HZ2      TRP 705  56.566 -14.596  -8.318
    9    HZ3  TRP 705           HZ3      TRP 705  52.568 -14.234  -9.724
   10    HH2  TRP 705           HH2      TRP 705  54.828 -15.102  -9.970

  No H/Q in entry =          10
  In of MODEL   45
    1    H    GLU 706           H        GLU 706  54.216  -8.412  -6.968
    2    HA   GLU 706           HA       GLU 706  55.632  -7.626  -4.582
    3    HB2  GLU 706           HB2      GLU 706  56.558  -7.884  -7.434
    4    HB3  GLU 706           HB3      GLU 706  57.535  -7.227  -6.122
    5    HG2  GLU 706           HG2      GLU 706  57.440  -9.431  -5.038
    6    HG3  GLU 706           HG3      GLU 706  56.517 -10.039  -6.416

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LYS 707           H        LYS 707  56.720  -5.442  -5.124
    2    HA   LYS 707           HA       LYS 707  54.956  -3.735  -6.673
    3    HB2  LYS 707           HB2      LYS 707  54.485  -2.270  -4.840
    4    HB3  LYS 707           HB3      LYS 707  53.974  -3.888  -4.395
    5    HG2  LYS 707           HG2      LYS 707  56.018  -4.165  -3.057
    6    HG3  LYS 707           HG3      LYS 707  56.520  -2.535  -3.501
    7    HD2  LYS 707           HD2      LYS 707  54.082  -3.304  -1.896
    8    HD3  LYS 707           HD3      LYS 707  55.535  -2.513  -1.292
    9    HE2  LYS 707           HE2      LYS 707  53.588  -1.366  -3.295
   10    HE3  LYS 707           HE3      LYS 707  53.686  -0.926  -1.601
   11    HZ2  LYS 707           HZ1      LYS 707  55.791  -0.424  -3.665
   12    HZ1  LYS 707           HZ2      LYS 707  55.914  -0.061  -2.007
   13    HZ3  LYS 707           HZ3      LYS 707  54.761   0.686  -2.938

  No H/Q in entry =          13
  In of MODEL   45
    1    H    LEU 708           H        LEU 708  55.848  -1.440  -6.488
    2    HA   LEU 708           HA       LEU 708  58.774  -1.535  -6.535
    3    HB2  LEU 708           HB2      LEU 708  57.720  -0.888  -8.649
    4    HB3  LEU 708           HB3      LEU 708  56.790   0.346  -7.833
    5    HG   LEU 708           HG       LEU 708  58.920   1.544  -7.315
    6   HD11  LEU 708          HD11      LEU 708  60.157  -0.523  -9.118
    7   HD13  LEU 708          HD12      LEU 708  60.478  -0.286  -7.401
    8   HD12  LEU 708          HD13      LEU 708  60.935   0.958  -8.563
    9   HD22  LEU 708          HD21      LEU 708  59.268   2.398  -9.583
   10   HD21  LEU 708          HD22      LEU 708  57.554   2.205  -9.218
   11   HD23  LEU 708          HD23      LEU 708  58.378   1.025 -10.237

  No H/Q in entry =          11
  In of MODEL   45
    1    H    GLN 709           H        GLN 709  59.725  -0.555  -4.809
    2    HA   GLN 709           HA       GLN 709  58.546   1.918  -3.847
    3    HB2  GLN 709           HB2      GLN 709  58.219   1.278  -1.707
    4    HB3  GLN 709           HB3      GLN 709  58.048  -0.324  -2.399
    5    HG2  GLN 709           HG2      GLN 709  60.605   0.235  -2.188
    6    HG3  GLN 709           HG3      GLN 709  60.193   0.519  -0.528
    7   HE21  GLN 709          HE21      GLN 709  60.867  -1.224   0.355
    8   HE22  GLN 709          HE22      GLN 709  61.202  -2.703  -0.449

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ASN 710           H        ASN 710  60.157   3.359  -3.222
    2    HA   ASN 710           HA       ASN 710  62.289   4.215  -2.894
    3    HB2  ASN 710           HB2      ASN 710  61.946   2.367  -1.046
    4    HB3  ASN 710           HB3      ASN 710  63.055   1.434  -2.004
    5   HD21  ASN 710          HD21      ASN 710  62.680   4.247  -0.052
    6   HD22  ASN 710          HD22      ASN 710  64.351   4.561   0.221

  No H/Q in entry =           6
  In of MODEL   45
    1    H    SER 711           H        SER 711  61.625   2.957  -5.456
    2    HA   SER 711           HA       SER 711  62.488   2.496  -7.444
    3    HB2  SER 711           HB2      SER 711  65.077   3.292  -6.143
    4    HB3  SER 711           HB3      SER 711  64.876   3.059  -7.896
    5    HG   SER 711           HG       SER 711  62.934   4.616  -6.927

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ARG 712           H        ARG 712  62.631   0.424  -5.042
    2    HA   ARG 712           HA       ARG 712  64.123  -1.547  -6.608
    3    HB2  ARG 712           HB2      ARG 712  64.447  -2.817  -4.486
    4    HB3  ARG 712           HB3      ARG 712  65.239  -1.254  -4.445
    5    HG2  ARG 712           HG2      ARG 712  63.485  -0.364  -2.997
    6    HG3  ARG 712           HG3      ARG 712  62.559  -1.827  -3.230
    7    HD2  ARG 712           HD2      ARG 712  63.700  -1.756  -1.049
    8    HD3  ARG 712           HD3      ARG 712  64.159  -3.137  -2.033
    9    HE   ARG 712           HE       ARG 712  66.169  -1.630  -2.611
   10   HH11  ARG 712          HH11      ARG 712  64.604  -1.700   0.563
   11   HH12  ARG 712          HH12      ARG 712  66.030  -1.455   1.448
   12   HH21  ARG 712          HH21      ARG 712  68.130  -1.334  -1.397
   13   HH22  ARG 712          HH22      ARG 712  68.086  -1.218   0.310

  No H/Q in entry =          13
  In of MODEL   45
    1    H    CYS 713           H        CYS 713  63.164  -3.777  -6.341
    2    HA   CYS 713           HA       CYS 713  60.253  -3.501  -6.140
    3    HB2  CYS 713           HB2      CYS 713  61.854  -5.434  -7.836
    4    HB3  CYS 713           HB3      CYS 713  60.103  -5.429  -7.700

  No H/Q in entry =           4
  In of MODEL   45
    1    H    VAL 714           H        VAL 714  59.475  -4.383  -4.431
    2    HA   VAL 714           HA       VAL 714  60.784  -6.747  -3.285
    3    HB   VAL 714           HB       VAL 714  60.189  -5.993  -1.041
    4   HG13  VAL 714          HG11      VAL 714  61.877  -4.360  -0.761
    5   HG12  VAL 714          HG12      VAL 714  61.540  -3.642  -2.306
    6   HG11  VAL 714          HG13      VAL 714  62.360  -5.214  -2.240
    7   HG21  VAL 714          HG21      VAL 714  58.148  -4.580  -1.857
    8   HG23  VAL 714          HG22      VAL 714  59.351  -3.248  -2.059
    9   HG22  VAL 714          HG23      VAL 714  59.105  -3.971  -0.522

  No H/Q in entry =           9
  In of MODEL   45
    1    H    CYS 715           H        CYS 715  59.098  -7.737  -1.618
    2    HA   CYS 715           HA       CYS 715  56.752  -8.245  -3.217
    3    HB2  CYS 715           HB2      CYS 715  57.617  -9.422  -0.561
    4    HB3  CYS 715           HB3      CYS 715  56.349 -10.038  -1.604

  No H/Q in entry =           4
  In of MODEL   45
    1    H    LYS 716           H        LYS 716  54.644  -7.716  -2.489
    2    HA   LYS 716           HA       LYS 716  54.618  -5.428  -0.771
    3    HB2  LYS 716           HB2      LYS 716  52.189  -5.300  -1.273
    4    HB3  LYS 716           HB3      LYS 716  53.176  -5.373  -2.720
    5    HG2  LYS 716           HG2      LYS 716  52.663  -7.800  -2.865
    6    HG3  LYS 716           HG3      LYS 716  51.567  -7.595  -1.506
    7    HD2  LYS 716           HD2      LYS 716  51.335  -6.146  -4.152
    8    HD3  LYS 716           HD3      LYS 716  50.413  -7.580  -3.708
    9    HE2  LYS 716           HE2      LYS 716  49.422  -6.326  -1.831
   10    HE3  LYS 716           HE3      LYS 716  50.323  -4.897  -2.324
   11    HZ2  LYS 716           HZ1      LYS 716  48.040  -4.848  -3.137
   12    HZ1  LYS 716           HZ2      LYS 716  48.276  -6.279  -3.993
   13    HZ3  LYS 716           HZ3      LYS 716  49.127  -4.904  -4.418

  No H/Q in entry =          13
  In of MODEL   45
    1    H    MET 717           H        MET 717  52.549  -5.411   0.815
    2    HA   MET 717           HA       MET 717  53.298  -7.528   2.692
    3    HB2  MET 717           HB2      MET 717  52.033  -4.834   3.200
    4    HB3  MET 717           HB3      MET 717  52.448  -5.995   4.446
    5    HG2  MET 717           HG2      MET 717  54.375  -4.601   2.594
    6    HG3  MET 717           HG3      MET 717  54.122  -4.235   4.300
    7    HE3  MET 717           HE1      MET 717  54.990  -5.765   6.294
    8    HE2  MET 717           HE2      MET 717  55.624  -7.394   6.069
    9    HE1  MET 717           HE3      MET 717  53.935  -7.044   5.700

  No H/Q in entry =           9
  In of MODEL   45
    1    HA   PRO 718           HA       PRO 718  49.456  -9.681   2.490
    2    HB2  PRO 718           HB2      PRO 718  48.945 -10.100   5.197
    3    HB3  PRO 718           HB3      PRO 718  49.973 -11.105   4.173
    4    HG2  PRO 718           HG2      PRO 718  50.742  -8.899   6.041
    5    HG3  PRO 718           HG3      PRO 718  51.543 -10.456   5.757
    6    HD2  PRO 718           HD2      PRO 718  52.522  -8.221   4.712
    7    HD3  PRO 718           HD3      PRO 718  52.515  -9.722   3.764

  No H/Q in entry =           7
  In of MODEL   45
    1    H    TYR 719           H        TYR 719  49.525  -6.804   4.417
    2    HA   TYR 719           HA       TYR 719  46.612  -6.731   4.535
    3    HB2  TYR 719           HB2      TYR 719  46.903  -4.717   5.943
    4    HB3  TYR 719           HB3      TYR 719  47.728  -6.134   6.574
    5    HD1  TYR 719           HD1      TYR 719  50.252  -6.303   6.244
    6    HD2  TYR 719           HD2      TYR 719  48.059  -2.729   5.523
    7    HE1  TYR 719           HE1      TYR 719  52.303  -4.996   6.497
    8    HE2  TYR 719           HE2      TYR 719  50.117  -1.415   5.738
    9    HH   TYR 719           HH       TYR 719  52.264  -1.545   6.659

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLU 720           H        GLU 720  48.954  -5.844   2.400
    2    HA   GLU 720           HA       GLU 720  47.523  -3.505   1.429
    3    HB2  GLU 720           HB2      GLU 720  50.051  -3.539   1.605
    4    HB3  GLU 720           HB3      GLU 720  50.067  -4.793   0.381
    5    HG2  GLU 720           HG2      GLU 720  49.115  -3.274  -1.242
    6    HG3  GLU 720           HG3      GLU 720  48.964  -2.027  -0.007

  No H/Q in entry =           6
  In of MODEL   45
    1    H    CYS 721           H        CYS 721  47.296  -6.679   1.351
    2    HA   CYS 721           HA       CYS 721  46.645  -7.188  -1.408
    3    HB2  CYS 721           HB2      CYS 721  46.117  -8.835   1.081
    4    HB3  CYS 721           HB3      CYS 721  46.062  -9.396  -0.585

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLY 722           H        GLY 722  44.624  -6.893  -2.217
    2    HA3  GLY 722           HA2      GLY 722  42.427  -6.688  -0.280
    3    HA2  GLY 722           HA3      GLY 722  42.631  -5.452  -1.510

  No H/Q in entry =           3
  In of MODEL   45
    1    HA   PRO 723           HA       PRO 723  39.767  -7.680  -3.961
    2    HB2  PRO 723           HB2      PRO 723  40.598  -6.810  -6.446
    3    HB3  PRO 723           HB3      PRO 723  39.568  -5.878  -5.359
    4    HG2  PRO 723           HG2      PRO 723  42.513  -5.683  -5.814
    5    HG3  PRO 723           HG3      PRO 723  41.325  -4.388  -5.587
    6    HD2  PRO 723           HD2      PRO 723  42.956  -5.174  -3.612
    7    HD3  PRO 723           HD3      PRO 723  41.290  -4.653  -3.286

  No H/Q in entry =           7
  In of MODEL   45
    1    H    SER 724           H        SER 724  40.011  -9.888  -4.083
    2    HA   SER 724           HA       SER 724  41.480 -11.042  -6.151
    3    HB2  SER 724           HB2      SER 724  42.825 -12.454  -4.435
    4    HB3  SER 724           HB3      SER 724  43.424 -10.856  -4.886
    5    HG   SER 724           HG       SER 724  42.073 -10.183  -3.009

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU 725           H        LEU 725  41.308 -13.425  -5.977
    2    HA   LEU 725           HA       LEU 725  38.564 -14.103  -5.376
    3    HB2  LEU 725           HB2      LEU 725  40.819 -15.463  -6.702
    4    HB3  LEU 725           HB3      LEU 725  39.455 -16.441  -6.176
    5    HG   LEU 725           HG       LEU 725  39.207 -14.077  -8.035
    6   HD11  LEU 725          HD11      LEU 725  40.680 -15.824  -9.011
    7   HD13  LEU 725          HD12      LEU 725  39.124 -15.752  -9.835
    8   HD12  LEU 725          HD13      LEU 725  39.444 -17.034  -8.667
    9   HD23  LEU 725          HD21      LEU 725  37.112 -15.146  -8.610
   10   HD22  LEU 725          HD22      LEU 725  37.176 -14.751  -6.895
   11   HD21  LEU 725          HD23      LEU 725  37.416 -16.419  -7.430

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ASP 726           H        ASP 726  37.749 -15.155  -3.795
    2    HA   ASP 726           HA       ASP 726  39.236 -16.005  -1.496
    3    HB2  ASP 726           HB2      ASP 726  36.935 -16.872  -0.852
    4    HB3  ASP 726           HB3      ASP 726  37.112 -15.136  -1.049

  No H/Q in entry =           4
  In of MODEL   45
    1    H    VAL 727           H        VAL 727  40.125 -17.830  -1.123
    2    HA   VAL 727           HA       VAL 727  39.134 -20.137  -2.527
    3    HB   VAL 727           HB       VAL 727  41.490 -20.936  -3.036
    4   HG12  VAL 727          HG11      VAL 727  40.595 -18.412  -4.434
    5   HG11  VAL 727          HG12      VAL 727  40.071 -20.052  -4.809
    6   HG13  VAL 727          HG13      VAL 727  41.747 -19.584  -5.080
    7   HG22  VAL 727          HG21      VAL 727  43.282 -19.246  -3.159
    8   HG21  VAL 727          HG22      VAL 727  42.697 -19.453  -1.507
    9   HG23  VAL 727          HG23      VAL 727  42.194 -18.054  -2.450

  No H/Q in entry =           9
  In of MODEL   45
    1    H    CYS 728           H        CYS 728  40.016 -22.208  -1.603
    2    HA   CYS 728           HA       CYS 728  40.297 -21.950   1.299
    3    HB2  CYS 728           HB2      CYS 728  39.878 -24.452  -0.324
    4    HB3  CYS 728           HB3      CYS 728  39.606 -24.229   1.389

  No H/Q in entry =           4
  In of MODEL   45
    1    H    ALA 729           H        ALA 729  42.217 -22.564   2.287
    2    HA   ALA 729           HA       ALA 729  44.141 -24.009   0.649
    3    HB2  ALA 729           HB1      ALA 729  45.906 -22.486   1.309
    4    HB1  ALA 729           HB2      ALA 729  44.730 -21.504   2.185
    5    HB3  ALA 729           HB3      ALA 729  44.636 -21.630   0.427

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLN 730           H        GLN 730  45.534 -25.223   1.788
    2    HA   GLN 730           HA       GLN 730  44.879 -25.607   4.615
    3    HB2  GLN 730           HB2      GLN 730  44.785 -27.593   3.053
    4    HB3  GLN 730           HB3      GLN 730  46.506 -27.393   2.828
    5    HG2  GLN 730           HG2      GLN 730  46.993 -27.916   5.043
    6    HG3  GLN 730           HG3      GLN 730  45.320 -27.803   5.549
    7   HE21  GLN 730          HE21      GLN 730  47.125 -30.015   5.879
    8   HE22  GLN 730          HE22      GLN 730  46.442 -31.366   5.064

  No H/Q in entry =           8
  In of MODEL   45
    1    H    ASP 731           H        ASP 731  46.187 -24.990   6.070
    2    HA   ASP 731           HA       ASP 731  48.626 -23.681   5.428
    3    HB2  ASP 731           HB2      ASP 731  47.244 -22.942   7.319
    4    HB3  ASP 731           HB3      ASP 731  47.458 -24.470   8.133

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLU 732           H        GLU 732  50.521 -24.720   5.026
    2    HA   GLU 732           HA       GLU 732  50.706 -27.495   5.291
    3    HB2  GLU 732           HB2      GLU 732  52.778 -25.442   4.621
    4    HB3  GLU 732           HB3      GLU 732  53.191 -27.134   4.801
    5    HG2  GLU 732           HG2      GLU 732  51.419 -27.604   3.047
    6    HG3  GLU 732           HG3      GLU 732  51.392 -25.861   2.770

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ARG 733           H        ARG 733  51.385 -25.111   7.668
    2    HA   ARG 733           HA       ARG 733  53.282 -26.903   8.941
    3    HB2  ARG 733           HB2      ARG 733  53.735 -24.438   8.790
    4    HB3  ARG 733           HB3      ARG 733  52.365 -24.171   9.855
    5    HG2  ARG 733           HG2      ARG 733  54.413 -24.070  11.115
    6    HG3  ARG 733           HG3      ARG 733  53.496 -25.500  11.597
    7    HD2  ARG 733           HD2      ARG 733  54.897 -26.867  10.081
    8    HD3  ARG 733           HD3      ARG 733  55.811 -25.418   9.674
    9    HE   ARG 733           HE       ARG 733  55.843 -25.734  12.424
   10   HH11  ARG 733          HH11      ARG 733  57.082 -27.293   9.540
   11   HH12  ARG 733          HH12      ARG 733  58.391 -28.065  10.295
   12   HH21  ARG 733          HH21      ARG 733  57.640 -26.760  13.512
   13   HH22  ARG 733          HH22      ARG 733  58.714 -27.759  12.646

  No H/Q in entry =          13
  In of MODEL   45
    1    H    SER 734           H        SER 734  50.226 -25.295   9.587
    2    HA   SER 734           HA       SER 734  49.856 -26.686  12.093
    3    HB2  SER 734           HB2      SER 734  48.023 -24.801  10.630
    4    HB3  SER 734           HB3      SER 734  47.922 -25.276  12.328
    5    HG   SER 734           HG       SER 734  49.961 -23.761  11.055

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LYS 735           H        LYS 735  49.028 -27.182   8.805
    2    HA   LYS 735           HA       LYS 735  47.908 -28.704   7.677
    3    HB2  LYS 735           HB2      LYS 735  47.830 -30.192  10.301
    4    HB3  LYS 735           HB3      LYS 735  47.336 -30.877   8.757
    5    HG2  LYS 735           HG2      LYS 735  50.090 -29.943   9.537
    6    HG3  LYS 735           HG3      LYS 735  49.577 -31.612   9.268
    7    HD2  LYS 735           HD2      LYS 735  49.010 -30.867   6.891
    8    HD3  LYS 735           HD3      LYS 735  49.882 -29.390   7.259
    9    HE2  LYS 735           HE2      LYS 735  51.022 -32.180   7.349
   10    HE3  LYS 735           HE3      LYS 735  51.313 -30.974   6.104
   11    HZ2  LYS 735           HZ1      LYS 735  53.128 -31.141   7.665
   12    HZ1  LYS 735           HZ2      LYS 735  52.156 -30.710   8.961
   13    HZ3  LYS 735           HZ3      LYS 735  52.471 -29.607   7.713

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ARG 736           H        ARG 736  46.432 -26.571   9.066
    2    HA   ARG 736           HA       ARG 736  43.764 -27.799   9.096
    3    HB2  ARG 736           HB2      ARG 736  42.982 -25.613   9.982
    4    HB3  ARG 736           HB3      ARG 736  44.061 -26.495  11.052
    5    HG2  ARG 736           HG2      ARG 736  45.755 -24.994  10.794
    6    HG3  ARG 736           HG3      ARG 736  45.197 -24.481   9.203
    7    HD2  ARG 736           HD2      ARG 736  44.941 -22.858  11.020
    8    HD3  ARG 736           HD3      ARG 736  43.469 -23.175  10.114
    9    HE   ARG 736           HE       ARG 736  43.139 -24.825  12.147
   10   HH11  ARG 736          HH11      ARG 736  44.404 -21.519  12.329
   11   HH12  ARG 736          HH12      ARG 736  43.565 -21.125  13.745
   12   HH21  ARG 736          HH21      ARG 736  41.997 -24.291  14.089
   13   HH22  ARG 736          HH22      ARG 736  42.150 -22.719  14.765

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ILE 737           H        ILE 737  42.089 -26.944   7.827
    2    HA   ILE 737           HA       ILE 737  42.945 -25.643   5.379
    3    HB   ILE 737           HB       ILE 737  40.114 -26.285   6.234
    4   HG12  ILE 737          HG12      ILE 737  41.504 -28.366   6.333
    5   HG13  ILE 737          HG13      ILE 737  40.236 -28.433   5.118
    6   HG23  ILE 737          HG21      ILE 737  39.656 -26.261   3.842
    7   HG22  ILE 737          HG22      ILE 737  41.361 -25.999   3.506
    8   HG21  ILE 737          HG23      ILE 737  40.433 -24.754   4.338
    9   HD11  ILE 737          HD11      ILE 737  41.874 -27.943   3.407
   10   HD13  ILE 737          HD12      ILE 737  42.281 -29.413   4.307
   11   HD12  ILE 737          HD13      ILE 737  43.153 -27.906   4.623

  No H/Q in entry =          11
  In of MODEL   45
    1    H    LEU 738           H        LEU 738  42.811 -23.455   5.219
    2    HA   LEU 738           HA       LEU 738  40.856 -22.161   6.887
    3    HB2  LEU 738           HB2      LEU 738  42.364 -20.356   7.410
    4    HB3  LEU 738           HB3      LEU 738  42.913 -21.863   8.131
    5    HG   LEU 738           HG       LEU 738  44.526 -21.798   5.920
    6   HD12  LEU 738          HD11      LEU 738  44.063 -18.947   6.485
    7   HD11  LEU 738          HD12      LEU 738  43.412 -19.850   5.116
    8   HD13  LEU 738          HD13      LEU 738  45.176 -19.704   5.333
    9   HD21  LEU 738          HD21      LEU 738  44.887 -20.256   8.458
   10   HD23  LEU 738          HD22      LEU 738  46.142 -20.558   7.269
   11   HD22  LEU 738          HD23      LEU 738  45.412 -21.926   8.148

  No H/Q in entry =          11
  In of MODEL   45
    1    HA   PRO 739           HA       PRO 739  39.855 -20.137   3.179
    2    HB2  PRO 739           HB2      PRO 739  38.603 -17.944   4.137
    3    HB3  PRO 739           HB3      PRO 739  37.899 -19.575   4.222
    4    HG2  PRO 739           HG2      PRO 739  39.276 -17.979   6.324
    5    HG3  PRO 739           HG3      PRO 739  37.832 -18.998   6.457
    6    HD2  PRO 739           HD2      PRO 739  40.334 -19.804   7.217
    7    HD3  PRO 739           HD3      PRO 739  39.060 -20.914   6.668

  No H/Q in entry =           7
  In of MODEL   45
    1    H    LEU 740           H        LEU 740  41.247 -19.132   1.900
    2    HA   LEU 740           HA       LEU 740  42.541 -16.705   2.855
    3    HB2  LEU 740           HB2      LEU 740  43.715 -18.949   1.239
    4    HB3  LEU 740           HB3      LEU 740  44.364 -17.332   1.105
    5    HG   LEU 740           HG       LEU 740  44.255 -18.959   3.645
    6   HD12  LEU 740          HD11      LEU 740  46.608 -18.250   1.906
    7   HD11  LEU 740          HD12      LEU 740  45.817 -19.826   2.007
    8   HD13  LEU 740          HD13      LEU 740  46.604 -19.168   3.438
    9   HD23  LEU 740          HD21      LEU 740  45.699 -17.187   4.547
   10   HD22  LEU 740          HD22      LEU 740  44.109 -16.572   4.119
   11   HD21  LEU 740          HD23      LEU 740  45.488 -16.262   3.061

  No H/Q in entry =          11
  In of MODEL   45
    1    H    THR 741           H        THR 741  43.591 -15.776   0.647
    2    HA   THR 741           HA       THR 741  41.535 -15.686  -1.375
    3    HB   THR 741           HB       THR 741  42.767 -13.149  -0.251
    4    HG1  THR 741           HG1      THR 741  40.732 -14.762   0.770
    5   HG23  THR 741          HG21      THR 741  40.720 -12.137  -1.132
    6   HG22  THR 741          HG22      THR 741  40.133 -13.735  -1.594
    7   HG21  THR 741          HG23      THR 741  41.550 -13.053  -2.391

  No H/Q in entry =           7
  In of MODEL   45
    1    H    VAL 742           H        VAL 742  42.559 -15.078  -3.379
    2    HA   VAL 742           HA       VAL 742  45.012 -16.223  -3.862
    3    HB   VAL 742           HB       VAL 742  43.775 -14.037  -5.517
    4   HG13  VAL 742          HG11      VAL 742  46.029 -14.402  -6.194
    5   HG12  VAL 742          HG12      VAL 742  44.910 -15.022  -7.404
    6   HG11  VAL 742          HG13      VAL 742  45.750 -16.144  -6.321
    7   HG23  VAL 742          HG21      VAL 742  42.817 -15.872  -6.808
    8   HG22  VAL 742          HG22      VAL 742  42.196 -15.710  -5.168
    9   HG21  VAL 742          HG23      VAL 742  43.351 -17.002  -5.546

  No H/Q in entry =           9
  In of MODEL   45
    1    H    CYS 743           H        CYS 743  44.468 -12.712  -3.446
    2    HA   CYS 743           HA       CYS 743  47.169 -12.112  -3.935
    3    HB2  CYS 743           HB2      CYS 743  45.267 -10.434  -4.060
    4    HB3  CYS 743           HB3      CYS 743  45.270 -10.406  -2.307

  No H/Q in entry =           4
  In of MODEL   45
    1    H    LYS 744           H        LYS 744  45.379 -12.562  -0.890
    2    HA   LYS 744           HA       LYS 744  47.431 -12.237   0.952
    3    HB2  LYS 744           HB2      LYS 744  45.317 -14.395   0.967
    4    HB3  LYS 744           HB3      LYS 744  46.339 -13.989   2.326
    5    HG2  LYS 744           HG2      LYS 744  45.266 -11.759   2.411
    6    HG3  LYS 744           HG3      LYS 744  44.246 -12.243   1.048
    7    HD2  LYS 744           HD2      LYS 744  43.374 -14.115   2.367
    8    HD3  LYS 744           HD3      LYS 744  44.343 -13.595   3.742
    9    HE2  LYS 744           HE2      LYS 744  42.139 -12.019   2.408
   10    HE3  LYS 744           HE3      LYS 744  42.006 -12.886   3.933
   11    HZ1  LYS 744           HZ1      LYS 744  43.712 -11.395   4.841
   12    HZ3  LYS 744           HZ2      LYS 744  42.344 -10.571   4.346
   13    HZ2  LYS 744           HZ3      LYS 744  43.727 -10.516   3.403

  No H/Q in entry =          13
  In of MODEL   45
    1    H    MET 745           H        MET 745  46.459 -15.212  -0.652
    2    HA   MET 745           HA       MET 745  48.407 -16.931   0.325
    3    HB2  MET 745           HB2      MET 745  46.825 -18.067  -0.575
    4    HB3  MET 745           HB3      MET 745  46.459 -16.966  -1.884
    5    HG2  MET 745           HG2      MET 745  47.290 -18.817  -3.041
    6    HG3  MET 745           HG3      MET 745  48.735 -17.875  -2.827
    7    HE3  MET 745           HE1      MET 745  46.830 -20.129  -0.151
    8    HE2  MET 745           HE2      MET 745  47.700 -21.647  -0.418
    9    HE1  MET 745           HE3      MET 745  46.726 -20.953  -1.706

  No H/Q in entry =           9
  In of MODEL   45
    1    H    HIS 746           H        HIS 746  48.528 -15.008  -2.657
    2    HA   HIS 746           HA       HIS 746  51.061 -16.110  -3.442
    3    HB2  HIS 746           HB2      HIS 746  49.399 -13.861  -4.400
    4    HB3  HIS 746           HB3      HIS 746  51.104 -13.848  -4.887
    5    HD1  HIS 746           HD1      HIS 746  51.785 -15.792  -6.561
    6    HD2  HIS 746           HD2      HIS 746  47.741 -15.606  -5.651
    7    HE1  HIS 746           HE1      HIS 746  50.629 -17.077  -8.371
    8    HE2  HIS 746           HE2      HIS 746  48.206 -17.020  -7.792

  No H/Q in entry =           8
  In of MODEL   45
    1    H    VAL 747           H        VAL 747  50.159 -13.068  -1.883
    2    HA   VAL 747           HA       VAL 747  52.790 -12.075  -1.709
    3    HB   VAL 747           HB       VAL 747  50.189 -11.371  -0.359
    4   HG13  VAL 747          HG11      VAL 747  51.259  -9.348   0.563
    5   HG12  VAL 747          HG12      VAL 747  52.817  -9.869  -0.061
    6   HG11  VAL 747          HG13      VAL 747  52.031 -10.779   1.222
    7   HG21  VAL 747          HG21      VAL 747  50.390 -10.911  -2.709
    8   HG23  VAL 747          HG22      VAL 747  51.893 -10.044  -2.429
    9   HG22  VAL 747          HG23      VAL 747  50.373  -9.401  -1.792

  No H/Q in entry =           9
  In of MODEL   45
    1    H    LEU 748           H        LEU 748  50.733 -13.750   0.585
    2    HA   LEU 748           HA       LEU 748  52.652 -13.788   2.611
    3    HB2  LEU 748           HB2      LEU 748  50.698 -14.203   3.613
    4    HB3  LEU 748           HB3      LEU 748  49.967 -14.766   2.145
    5    HG   LEU 748           HG       LEU 748  51.602 -16.557   3.949
    6   HD11  LEU 748          HD11      LEU 748  49.660 -15.576   5.155
    7   HD13  LEU 748          HD12      LEU 748  49.439 -17.300   4.832
    8   HD12  LEU 748          HD13      LEU 748  48.612 -16.110   3.835
    9   HD21  LEU 748          HD21      LEU 748  51.224 -17.310   1.602
   10   HD23  LEU 748          HD22      LEU 748  49.483 -17.146   1.876
   11   HD22  LEU 748          HD23      LEU 748  50.408 -18.319   2.796

  No H/Q in entry =          11
  In of MODEL   45
    1    H    HIS 749           H        HIS 749  52.197 -15.742  -0.168
    2    HA   HIS 749           HA       HIS 749  53.892 -17.898   0.618
    3    HB2  HIS 749           HB2      HIS 749  52.210 -17.948  -1.308
    4    HB3  HIS 749           HB3      HIS 749  53.390 -17.021  -2.230
    5    HD1  HIS 749           HD1      HIS 749  55.579 -18.322  -2.992
    6    HD2  HIS 749           HD2      HIS 749  52.755 -20.589  -0.982
    7    HE1  HIS 749           HE1      HIS 749  56.278 -20.681  -3.327
    8    HE2  HIS 749           HE2      HIS 749  54.755 -22.008  -1.878

  No H/Q in entry =           8
  In of MODEL   45
    1    H    CYS 750           H        CYS 750  54.420 -14.805  -1.063
    2    HA   CYS 750           HA       CYS 750  57.170 -15.495  -1.544
    3    HB2  CYS 750           HB2      CYS 750  57.399 -13.210  -2.476
    4    HB3  CYS 750           HB3      CYS 750  56.070 -14.102  -3.204

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLN 751           H        GLN 751  55.353 -13.967   0.905
    2    HA   GLN 751           HA       GLN 751  57.515 -12.812   2.307
    3    HB2  GLN 751           HB2      GLN 751  54.872 -13.901   3.287
    4    HB3  GLN 751           HB3      GLN 751  56.016 -13.059   4.321
    5    HG2  GLN 751           HG2      GLN 751  54.750 -11.898   1.862
    6    HG3  GLN 751           HG3      GLN 751  54.147 -11.633   3.490
    7   HE21  GLN 751          HE21      GLN 751  55.060  -9.632   1.595
    8   HE22  GLN 751          HE22      GLN 751  56.408  -8.866   2.334

  No H/Q in entry =           8
  In of MODEL   45
    1    H    GLY 752           H        GLY 752  56.481 -16.066   1.831
    2    HA3  GLY 752           HA2      GLY 752  58.367 -17.646   2.118
    3    HA2  GLY 752           HA3      GLY 752  58.569 -16.949   3.713

  No H/Q in entry =           3
  In of MODEL   45
    1    H    ARG 753           H        ARG 753  55.266 -17.276   2.993
    2    HA   ARG 753           HA       ARG 753  55.184 -19.541   4.835
    3    HB2  ARG 753           HB2      ARG 753  52.828 -18.064   3.689
    4    HB3  ARG 753           HB3      ARG 753  52.870 -19.063   5.130
    5    HG2  ARG 753           HG2      ARG 753  54.207 -16.379   4.796
    6    HG3  ARG 753           HG3      ARG 753  52.746 -16.701   5.724
    7    HD2  ARG 753           HD2      ARG 753  53.990 -18.066   7.275
    8    HD3  ARG 753           HD3      ARG 753  55.446 -17.908   6.287
    9    HE   ARG 753           HE       ARG 753  54.607 -15.353   6.889
   10   HH11  ARG 753          HH11      ARG 753  55.747 -18.139   8.747
   11   HH12  ARG 753          HH12      ARG 753  56.502 -17.192   9.938
   12   HH21  ARG 753          HH21      ARG 753  55.628 -14.088   8.483
   13   HH22  ARG 753          HH22      ARG 753  56.443 -14.814   9.797

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ASN 754           H        ASN 754  53.982 -21.452   4.376
    2    HA   ASN 754           HA       ASN 754  53.776 -22.026   1.497
    3    HB2  ASN 754           HB2      ASN 754  54.451 -23.959   3.735
    4    HB3  ASN 754           HB3      ASN 754  54.341 -24.349   2.030
    5   HD21  ASN 754          HD21      ASN 754  56.242 -22.904   4.503
    6   HD22  ASN 754          HD22      ASN 754  57.667 -22.636   3.557

  No H/Q in entry =           6
  In of MODEL   45
    1    H    TYR 755           H        TYR 755  51.872 -22.749   0.758
    2    HA   TYR 755           HA       TYR 755  49.901 -23.837   2.580
    3    HB2  TYR 755           HB2      TYR 755  49.513 -21.279   1.057
    4    HB3  TYR 755           HB3      TYR 755  48.164 -22.338   1.462
    5    HD1  TYR 755           HD1      TYR 755  47.276 -22.372   3.628
    6    HD2  TYR 755           HD2      TYR 755  50.852 -20.251   2.867
    7    HE1  TYR 755           HE1      TYR 755  47.136 -21.378   5.840
    8    HE2  TYR 755           HE2      TYR 755  50.730 -19.218   5.086
    9    HH   TYR 755           HH       TYR 755  48.835 -20.478   7.459

  No H/Q in entry =           9
  In of MODEL   45
    1    H    THR 756           H        THR 756  48.403 -25.069   1.641
    2    HA   THR 756           HA       THR 756  48.944 -25.864  -1.130
    3    HB   THR 756           HB       THR 756  47.537 -27.321   1.112
    4    HG1  THR 756           HG1      THR 756  49.408 -27.835   1.777
    5   HG23  THR 756          HG21      THR 756  46.879 -28.056  -1.091
    6   HG22  THR 756          HG22      THR 756  47.852 -29.303  -0.289
    7   HG21  THR 756          HG23      THR 756  48.568 -28.278  -1.553

  No H/Q in entry =           7
  In of MODEL   45
    1    H    LEU 757           H        LEU 757  47.273 -25.675  -2.622
    2    HA   LEU 757           HA       LEU 757  44.820 -24.427  -1.763
    3    HB2  LEU 757           HB2      LEU 757  45.846 -25.271  -4.476
    4    HB3  LEU 757           HB3      LEU 757  44.210 -24.702  -4.245
    5    HG   LEU 757           HG       LEU 757  45.551 -22.932  -5.130
    6   HD12  LEU 757          HD11      LEU 757  44.927 -22.413  -2.234
    7   HD11  LEU 757          HD12      LEU 757  43.811 -22.305  -3.592
    8   HD13  LEU 757          HD13      LEU 757  45.172 -21.194  -3.485
    9   HD23  LEU 757          HD21      LEU 757  47.349 -23.256  -2.718
   10   HD22  LEU 757          HD22      LEU 757  47.479 -21.982  -3.934
   11   HD21  LEU 757          HD23      LEU 757  47.767 -23.662  -4.381

  No H/Q in entry =          11
  In of MODEL   45
    1    H    THR 758           H        THR 758  43.013 -25.416  -1.275
    2    HA   THR 758           HA       THR 758  42.958 -28.306  -1.698
    3    HB   THR 758           HB       THR 758  41.482 -28.329   0.311
    4    HG1  THR 758           HG1      THR 758  40.686 -26.312   0.401
    5   HG23  THR 758          HG21      THR 758  43.244 -27.961   1.913
    6   HG22  THR 758          HG22      THR 758  44.148 -26.997   0.743
    7   HG21  THR 758          HG23      THR 758  43.922 -28.726   0.475

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLY 759           H        GLY 759  40.389 -28.863  -1.137
    2    HA3  GLY 759           HA2      GLY 759  39.042 -27.987  -3.491
    3    HA2  GLY 759           HA3      GLY 759  38.443 -29.113  -2.279

  No H/Q in entry =           3
  In of MODEL   45
    1    H    ARG 760           H        ARG 760  36.923 -27.136  -3.491
    2    HA   ARG 760           HA       ARG 760  36.680 -24.753  -1.983
    3    HB2  ARG 760           HB2      ARG 760  34.615 -24.383  -3.258
    4    HB3  ARG 760           HB3      ARG 760  35.899 -24.935  -4.317
    5    HG2  ARG 760           HG2      ARG 760  34.091 -26.159  -5.090
    6    HG3  ARG 760           HG3      ARG 760  34.820 -27.289  -3.947
    7    HD2  ARG 760           HD2      ARG 760  33.173 -26.233  -2.235
    8    HD3  ARG 760           HD3      ARG 760  32.339 -25.631  -3.666
    9    HE   ARG 760           HE       ARG 760  32.715 -28.338  -4.041
   10   HH11  ARG 760          HH11      ARG 760  30.821 -26.191  -1.983
   11   HH12  ARG 760          HH12      ARG 760  29.777 -27.390  -1.390
   12   HH21  ARG 760          HH21      ARG 760  31.232 -30.034  -3.268
   13   HH22  ARG 760          HH22      ARG 760  30.035 -29.654  -2.133

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ASP 761           H        ASP 761  35.701 -27.914  -1.335
    2    HA   ASP 761           HA       ASP 761  33.425 -27.181   0.321
    3    HB2  ASP 761           HB2      ASP 761  33.223 -29.170  -1.041
    4    HB3  ASP 761           HB3      ASP 761  34.687 -29.844  -0.348

  No H/Q in entry =           4
  In of MODEL   45
    1    H    SER 762           H        SER 762  36.750 -27.432   0.728
    2    HA   SER 762           HA       SER 762  36.787 -28.694   3.254
    3    HB2  SER 762           HB2      SER 762  38.937 -27.081   1.896
    4    HB3  SER 762           HB3      SER 762  39.158 -28.174   3.264
    5    HG   SER 762           HG       SER 762  37.950 -29.666   1.688

  No H/Q in entry =           5
  In of MODEL   45
    1    H    CYS 763           H        CYS 763  36.654 -25.226   2.370
    2    HA   CYS 763           HA       CYS 763  36.006 -24.780   5.149
    3    HB2  CYS 763           HB2      CYS 763  37.523 -22.888   5.437
    4    HB3  CYS 763           HB3      CYS 763  38.437 -24.346   5.037

  No H/Q in entry =           4
  In of MODEL   45
    1    H    THR 764           H        THR 764  35.198 -22.547   5.491
    2    HA   THR 764           HA       THR 764  33.446 -21.856   3.284
    3    HB   THR 764           HB       THR 764  33.470 -21.060   6.205
    4    HG1  THR 764           HG1      THR 764  31.430 -22.622   5.190
    5   HG22  THR 764          HG21      THR 764  31.172 -20.257   5.795
    6   HG21  THR 764          HG22      THR 764  31.339 -20.655   4.084
    7   HG23  THR 764          HG23      THR 764  32.342 -19.390   4.798

  No H/Q in entry =           7
  In of MODEL   45
    1    H    LEU 765           H        LEU 765  33.670 -19.996   2.177
    2    HA   LEU 765           HA       LEU 765  35.927 -18.328   2.847
    3    HB2  LEU 765           HB2      LEU 765  34.311 -18.674   0.364
    4    HB3  LEU 765           HB3      LEU 765  35.313 -17.259   0.555
    5    HG   LEU 765           HG       LEU 765  36.536 -18.714  -0.764
    6   HD11  LEU 765          HD11      LEU 765  37.929 -17.796   0.974
    7   HD13  LEU 765          HD12      LEU 765  38.441 -19.423   0.529
    8   HD12  LEU 765          HD13      LEU 765  37.553 -19.170   2.022
    9   HD23  LEU 765          HD21      LEU 765  36.925 -20.965  -0.264
   10   HD22  LEU 765          HD22      LEU 765  35.192 -20.550  -0.478
   11   HD21  LEU 765          HD23      LEU 765  35.860 -20.818   1.164

  No H/Q in entry =          11
  In of MODEL   45
    1    HA   PRO 766           HA       PRO 766  33.509 -14.741   3.933
    2    HB2  PRO 766           HB2      PRO 766  35.178 -12.853   2.956
    3    HB3  PRO 766           HB3      PRO 766  35.598 -13.786   4.405
    4    HG2  PRO 766           HG2      PRO 766  36.294 -14.405   1.546
    5    HG3  PRO 766           HG3      PRO 766  37.456 -14.184   2.901
    6    HD2  PRO 766           HD2      PRO 766  36.734 -16.547   2.151
    7    HD3  PRO 766           HD3      PRO 766  36.678 -16.204   3.890

  No H/Q in entry =           7
  In of MODEL   45
    1    H    ALA 767           H        ALA 767  33.076 -12.601   2.637
    2    HA   ALA 767           HA       ALA 767  31.764 -11.621   1.103
    3    HB3  ALA 767           HB1      ALA 767  32.529 -11.600  -1.194
    4    HB1  ALA 767           HB2      ALA 767  33.485 -13.062  -0.912
    5    HB2  ALA 767           HB3      ALA 767  33.909 -11.561  -0.094

  No H/Q in entry =           5
  In of MODEL   45
    1    H    SER 768           H        SER 768  32.145 -14.341  -0.903
    2    HA   SER 768           HA       SER 768  30.817 -15.927  -1.711
    3    HB2  SER 768           HB2      SER 768  29.974 -16.468   0.481
    4    HB3  SER 768           HB3      SER 768  28.799 -15.134   0.349
    5    HG   SER 768           HG       SER 768  27.705 -16.239  -1.190

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA 769           H        ALA 769  30.946 -14.787  -3.424
    2    HA   ALA 769           HA       ALA 769  30.199 -14.046  -5.436
    3    HB1  ALA 769           HB1      ALA 769  27.722 -15.452  -4.542
    4    HB3  ALA 769           HB2      ALA 769  29.139 -16.212  -5.248
    5    HB2  ALA 769           HB3      ALA 769  28.153 -15.100  -6.221

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLU 770           H        GLU 770  26.998 -13.794  -4.200
    2    HA   GLU 770           HA       GLU 770  26.764 -11.158  -5.407
    3    HB2  GLU 770           HB2      GLU 770  24.311 -11.605  -5.241
    4    HB3  GLU 770           HB3      GLU 770  25.196 -12.776  -6.210
    5    HG2  GLU 770           HG2      GLU 770  25.249 -14.270  -4.208
    6    HG3  GLU 770           HG3      GLU 770  24.166 -13.136  -3.411

  No H/Q in entry =           6
  In of MODEL   45
    1    H    LYS 771           H        LYS 771  26.823  -9.441  -4.220
    2    HA   LYS 771           HA       LYS 771  26.165  -9.593  -1.352
    3    HB2  LYS 771           HB2      LYS 771  28.092  -7.807  -2.805
    4    HB3  LYS 771           HB3      LYS 771  27.681  -7.690  -1.106
    5    HG2  LYS 771           HG2      LYS 771  28.985 -10.104  -2.366
    6    HG3  LYS 771           HG3      LYS 771  29.868  -8.797  -1.589
    7    HD2  LYS 771           HD2      LYS 771  29.729 -10.366   0.103
    8    HD3  LYS 771           HD3      LYS 771  28.359  -9.326   0.459
    9    HE2  LYS 771           HE2      LYS 771  26.888 -11.097  -0.715
   10    HE3  LYS 771           HE3      LYS 771  28.353 -12.032  -0.855
   11    HZ2  LYS 771           HZ1      LYS 771  26.920 -12.594   1.028
   12    HZ1  LYS 771           HZ2      LYS 771  27.327 -11.099   1.735
   13    HZ3  LYS 771           HZ3      LYS 771  28.528 -12.263   1.400

  No H/Q in entry =          13
  In of MODEL   45
    1    H    ALA 772           H        ALA 772  25.487  -7.506  -0.427
    2    HA   ALA 772           HA       ALA 772  23.348  -6.562  -2.105
    3    HB1  ALA 772           HB1      ALA 772  22.380  -5.636  -0.066
    4    HB2  ALA 772           HB2      ALA 772  23.824  -6.097   0.834
    5    HB3  ALA 772           HB3      ALA 772  22.786  -7.342   0.137

  No H/Q in entry =           5
  In of MODEL   45
    1    H    CYS 773           H        CYS 773  22.786  -4.270  -2.076
    2    HA   CYS 773           HA       CYS 773  24.615  -2.715  -3.345
    3    HB2  CYS 773           HB2      CYS 773  22.231  -2.250  -3.378
    4    HB3  CYS 773           HB3      CYS 773  22.258  -1.816  -1.678

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLY 774           H        GLY 774  26.564  -2.181  -2.659
    2    HA3  GLY 774           HA2      GLY 774  27.610  -0.284  -1.417
    3    HA2  GLY 774           HA3      GLY 774  26.839  -0.952   0.012

  No H/Q in entry =           3
  In of MODEL   45
    1    H    ALA 775           H        ALA 775  27.414  -3.699  -1.150
    2    HA   ALA 775           HA       ALA 775  30.223  -3.797  -0.368
    3    HB2  ALA 775           HB1      ALA 775  29.764  -6.183   0.172
    4    HB1  ALA 775           HB2      ALA 775  28.063  -5.911  -0.235
    5    HB3  ALA 775           HB3      ALA 775  28.789  -5.068   1.129

  No H/Q in entry =           5
  In of MODEL   45
    1    H    CYS 776           H        CYS 776  31.315  -3.677  -2.198
    2    HA   CYS 776           HA       CYS 776  30.407  -5.346  -4.406
    3    HB2  CYS 776           HB2      CYS 776  31.448  -3.559  -5.888
    4    HB3  CYS 776           HB3      CYS 776  29.941  -3.153  -5.076

  No H/Q in entry =           4
  In of MODEL   45
    1    HA   PRO 777           HA       PRO 777  34.634  -6.869  -4.086
    2    HB2  PRO 777           HB2      PRO 777  34.153  -9.165  -5.504
    3    HB3  PRO 777           HB3      PRO 777  33.765  -9.001  -3.794
    4    HG2  PRO 777           HG2      PRO 777  31.974  -8.910  -6.156
    5    HG3  PRO 777           HG3      PRO 777  31.665  -9.523  -4.528
    6    HD2  PRO 777           HD2      PRO 777  30.834  -7.066  -5.522
    7    HD3  PRO 777           HD3      PRO 777  30.922  -7.508  -3.807

  No H/Q in entry =           7
  In of MODEL   45
    1    H    LEU 778           H        LEU 778  35.392  -8.418  -6.476
    2    HA   LEU 778           HA       LEU 778  36.071  -6.194  -8.215
    3    HB2  LEU 778           HB2      LEU 778  36.643  -9.141  -8.590
    4    HB3  LEU 778           HB3      LEU 778  37.337  -7.848  -9.528
    5    HG   LEU 778           HG       LEU 778  38.502  -7.091  -7.399
    6   HD12  LEU 778          HD11      LEU 778  38.778  -8.753  -5.624
    7   HD11  LEU 778          HD12      LEU 778  37.573  -9.779  -6.400
    8   HD13  LEU 778          HD13      LEU 778  37.110  -8.201  -5.754
    9   HD21  LEU 778          HD21      LEU 778  39.109  -9.837  -8.475
   10   HD23  LEU 778          HD22      LEU 778  40.231  -8.820  -7.571
   11   HD22  LEU 778          HD23      LEU 778  39.653  -8.303  -9.156

  No H/Q in entry =          11
  In of MODEL   45
    1    H    TRP 779           H        TRP 779  34.113  -9.010  -8.312
    2    HA   TRP 779           HA       TRP 779  33.282  -8.656 -11.075
    3    HB2  TRP 779           HB2      TRP 779  32.073 -10.889 -10.421
    4    HB3  TRP 779           HB3      TRP 779  33.813 -10.868 -10.702
    5    HD1  TRP 779           HD1      TRP 779  31.276 -11.076  -7.826
    6    HE1  TRP 779           HE1      TRP 779  32.471 -11.996  -5.742
    7    HE3  TRP 779           HE3      TRP 779  36.027 -11.132  -9.611
    8    HZ2  TRP 779           HZ2      TRP 779  35.134 -12.644  -4.959
    9    HZ3  TRP 779           HZ3      TRP 779  37.847 -11.895  -8.143
   10    HH2  TRP 779           HH2      TRP 779  37.394 -12.631  -5.864

  No H/Q in entry =          10
  In of MODEL   45
    1    H    GLY 780           H        GLY 780  32.122  -8.136  -7.902
    2    HA3  GLY 780           HA2      GLY 780  29.353  -7.929  -8.830
    3    HA2  GLY 780           HA3      GLY 780  29.859  -7.995  -7.141

  No H/Q in entry =           3
  In of MODEL   45
    1    H    LYS 781           H        LYS 781  28.589  -5.998  -9.268
    2    HA   LYS 781           HA       LYS 781  30.025  -3.682  -8.179
    3    HB2  LYS 781           HB2      LYS 781  30.608  -4.411 -10.591
    4    HB3  LYS 781           HB3      LYS 781  29.001  -3.828 -10.992
    5    HG2  LYS 781           HG2      LYS 781  30.589  -2.116 -11.488
    6    HG3  LYS 781           HG3      LYS 781  29.654  -1.608 -10.077
    7    HD2  LYS 781           HD2      LYS 781  31.447  -2.295  -8.592
    8    HD3  LYS 781           HD3      LYS 781  32.366  -2.925  -9.962
    9    HE2  LYS 781           HE2      LYS 781  32.489  -0.674 -10.889
   10    HE3  LYS 781           HE3      LYS 781  31.578  -0.063  -9.510
   11    HZ1  LYS 781           HZ1      LYS 781  34.213  -1.414  -9.323
   12    HZ3  LYS 781           HZ2      LYS 781  33.369  -0.684  -8.057
   13    HZ2  LYS 781           HZ3      LYS 781  33.975   0.253  -9.329

  No H/Q in entry =          13
  In of MODEL   45
    1    H    CYS 782           H        CYS 782  28.666  -1.987  -7.672
    2    HA   CYS 782           HA       CYS 782  25.839  -2.460  -8.196
    3    HB2  CYS 782           HB2      CYS 782  26.436  -2.198  -5.793
    4    HB3  CYS 782           HB3      CYS 782  27.115  -0.618  -6.148

  No H/Q in entry =           4
  In of MODEL   45
    1    H    ASP 783           H        ASP 783  26.127  -1.787 -10.320
    2    HA   ASP 783           HA       ASP 783  26.178   1.141 -10.577
    3    HB2  ASP 783           HB2      ASP 783  27.134   0.923 -12.799
    4    HB3  ASP 783           HB3      ASP 783  28.153   0.033 -11.682

  No H/Q in entry =           4
  In of MODEL   45
    1    H    ALA 784           H        ALA 784  24.402  -1.412 -10.363
    2    HA   ALA 784           HA       ALA 784  22.112  -0.380 -11.649
    3    HB2  ALA 784           HB1      ALA 784  23.337  -3.057 -12.404
    4    HB3  ALA 784           HB2      ALA 784  23.013  -1.715 -13.504
    5    HB1  ALA 784           HB3      ALA 784  21.675  -2.595 -12.761

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLU 785           H        GLU 785  20.313  -1.867 -10.839
    2    HA   GLU 785           HA       GLU 785  19.207  -2.967  -9.245
    3    HB2  GLU 785           HB2      GLU 785  21.673  -4.301  -9.304
    4    HB3  GLU 785           HB3      GLU 785  21.332  -4.039  -7.602
    5    HG2  GLU 785           HG2      GLU 785  19.322  -5.265  -9.461
    6    HG3  GLU 785           HG3      GLU 785  20.550  -6.234  -8.663

  No H/Q in entry =           6
  In of MODEL   45
    1    H    SER 786           H        SER 786  18.716  -2.878  -6.986
    2    HA   SER 786           HA       SER 786  19.734  -0.380  -5.803
    3    HB2  SER 786           HB2      SER 786  16.866  -1.312  -5.808
    4    HB3  SER 786           HB3      SER 786  17.484   0.246  -5.261
    5    HG   SER 786           HG       SER 786  18.276   0.445  -7.545

  No H/Q in entry =           5
  In of MODEL   45
    1    H    SER 787           H        SER 787  18.615  -3.662  -5.345
    2    HA   SER 787           HA       SER 787  18.824  -3.329  -2.440
    3    HB2  SER 787           HB2      SER 787  17.752  -5.653  -4.051
    4    HB3  SER 787           HB3      SER 787  17.629  -5.444  -2.301
    5    HG   SER 787           HG       SER 787  16.700  -3.250  -3.311

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LYS 788           H        LYS 788  19.814  -5.571  -5.007
    2    HA   LYS 788           HA       LYS 788  22.030  -6.509  -3.374
    3    HB2  LYS 788           HB2      LYS 788  20.372  -8.133  -4.262
    4    HB3  LYS 788           HB3      LYS 788  20.688  -7.509  -5.864
    5    HG2  LYS 788           HG2      LYS 788  23.009  -8.378  -5.668
    6    HG3  LYS 788           HG3      LYS 788  22.535  -9.130  -4.147
    7    HD2  LYS 788           HD2      LYS 788  22.413 -10.769  -5.934
    8    HD3  LYS 788           HD3      LYS 788  20.793 -10.412  -5.356
    9    HE2  LYS 788           HE2      LYS 788  21.936  -9.018  -7.781
   10    HE3  LYS 788           HE3      LYS 788  21.197 -10.597  -7.921
   11    HZ2  LYS 788           HZ1      LYS 788  19.790  -8.064  -7.046
   12    HZ1  LYS 788           HZ2      LYS 788  19.126  -9.593  -7.000
   13    HZ3  LYS 788           HZ3      LYS 788  19.590  -8.946  -8.460

  No H/Q in entry =          13
  In of MODEL   45
    1    H    CYS 789           H        CYS 789  24.056  -6.891  -4.845
    2    HA   CYS 789           HA       CYS 789  24.332  -4.748  -6.824
    3    HB2  CYS 789           HB2      CYS 789  26.380  -6.532  -5.465
    4    HB3  CYS 789           HB3      CYS 789  26.778  -5.331  -6.689

  No H/Q in entry =           4
  In of MODEL   45
    1    H    VAL 790           H        VAL 790  25.352  -5.412  -8.932
    2    HA   VAL 790           HA       VAL 790  24.384  -8.093  -9.582
    3    HB   VAL 790           HB       VAL 790  24.333  -7.383 -11.944
    4   HG11  VAL 790          HG11      VAL 790  22.761  -5.667 -10.063
    5   HG13  VAL 790          HG12      VAL 790  22.293  -7.250 -10.689
    6   HG12  VAL 790          HG13      VAL 790  22.383  -5.858 -11.774
    7   HG23  VAL 790          HG21      VAL 790  24.993  -4.628 -10.880
    8   HG22  VAL 790          HG22      VAL 790  24.522  -4.997 -12.539
    9   HG21  VAL 790          HG23      VAL 790  26.035  -5.630 -11.890

  No H/Q in entry =           9
  In of MODEL   45
    1    H    CYS 791           H        CYS 791  25.577  -9.178 -11.313
    2    HA   CYS 791           HA       CYS 791  28.409  -9.001 -10.675
    3    HB2  CYS 791           HB2      CYS 791  26.879 -11.170 -12.130
    4    HB3  CYS 791           HB3      CYS 791  28.536 -11.259 -11.546

  No H/Q in entry =           4
  In of MODEL   45
    1    H    ARG 792           H        ARG 792  29.643  -8.052 -12.079
    2    HA   ARG 792           HA       ARG 792  28.730  -7.236 -14.674
    3    HB2  ARG 792           HB2      ARG 792  31.272  -6.985 -13.110
    4    HB3  ARG 792           HB3      ARG 792  31.276  -6.622 -14.830
    5    HG2  ARG 792           HG2      ARG 792  29.481  -5.291 -12.804
    6    HG3  ARG 792           HG3      ARG 792  31.025  -4.630 -13.355
    7    HD2  ARG 792           HD2      ARG 792  30.142  -4.753 -15.691
    8    HD3  ARG 792           HD3      ARG 792  28.582  -5.197 -15.025
    9    HE   ARG 792           HE       ARG 792  28.457  -3.029 -14.004
   10   HH11  ARG 792          HH11      ARG 792  31.185  -3.365 -16.259
   11   HH12  ARG 792          HH12      ARG 792  31.089  -1.799 -16.876
   12   HH21  ARG 792          HH21      ARG 792  28.283  -0.865 -14.895
   13   HH22  ARG 792          HH22      ARG 792  29.413  -0.293 -16.055

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLU 793           H        GLU 793  29.693  -7.892 -16.674
    2    HA   GLU 793           HA       GLU 793  30.168 -10.633 -16.951
    3    HB2  GLU 793           HB2      GLU 793  30.807  -8.309 -18.733
    4    HB3  GLU 793           HB3      GLU 793  31.158  -9.959 -19.170
    5    HG2  GLU 793           HG2      GLU 793  28.414  -9.100 -18.396
    6    HG3  GLU 793           HG3      GLU 793  28.993  -9.014 -20.066

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ALA 794           H        ALA 794  32.022 -11.642 -17.573
    2    HA   ALA 794           HA       ALA 794  34.192 -11.129 -15.815
    3    HB2  ALA 794           HB1      ALA 794  33.346 -13.360 -16.531
    4    HB3  ALA 794           HB2      ALA 794  35.079 -13.156 -16.583
    5    HB1  ALA 794           HB3      ALA 794  34.141 -13.099 -18.089

  No H/Q in entry =           5
  In of MODEL   45
    1    H    SER 795           H        SER 795  33.457 -10.198 -18.978
    2    HA   SER 795           HA       SER 795  36.166  -9.566 -19.708
    3    HB2  SER 795           HB2      SER 795  34.847  -8.887 -21.817
    4    HB3  SER 795           HB3      SER 795  34.974 -10.607 -21.413
    5    HG   SER 795           HG       SER 795  32.745  -9.026 -21.543

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLU 796           H        GLU 796  33.887  -8.090 -17.794
    2    HA   GLU 796           HA       GLU 796  34.604  -5.428 -18.784
    3    HB2  GLU 796           HB2      GLU 796  31.875  -6.369 -17.987
    4    HB3  GLU 796           HB3      GLU 796  32.293  -4.671 -18.129
    5    HG2  GLU 796           HG2      GLU 796  32.926  -5.098 -20.499
    6    HG3  GLU 796           HG3      GLU 796  32.329  -6.744 -20.311

  No H/Q in entry =           6
  In of MODEL   45
    1    H    CYS 797           H        CYS 797  35.288  -7.256 -16.393
    2    HA   CYS 797           HA       CYS 797  34.608  -5.386 -14.279
    3    HB2  CYS 797           HB2      CYS 797  35.809  -7.187 -12.848
    4    HB3  CYS 797           HB3      CYS 797  34.229  -7.562 -13.522

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLU 798           H        GLU 798  35.805  -3.750 -14.002
    2    HA   GLU 798           HA       GLU 798  38.179  -3.190 -15.437
    3    HB2  GLU 798           HB2      GLU 798  36.810  -1.708 -13.221
    4    HB3  GLU 798           HB3      GLU 798  38.063  -1.049 -14.251
    5    HG2  GLU 798           HG2      GLU 798  36.657  -1.118 -16.150
    6    HG3  GLU 798           HG3      GLU 798  35.455  -2.099 -15.308

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU 799           H        GLU 799  38.550  -5.279 -13.136
    2    HA   GLU 799           HA       GLU 799  40.412  -3.667 -11.525
    3    HB2  GLU 799           HB2      GLU 799  38.491  -4.710 -10.314
    4    HB3  GLU 799           HB3      GLU 799  39.187  -6.284 -10.671
    5    HG2  GLU 799           HG2      GLU 799  39.731  -5.484  -8.405
    6    HG3  GLU 799           HG3      GLU 799  41.165  -5.747  -9.404

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLU 800           H        GLU 800  42.503  -4.238 -11.232
    2    HA   GLU 800           HA       GLU 800  43.493  -6.286 -13.024
    3    HB2  GLU 800           HB2      GLU 800  45.760  -5.247 -12.619
    4    HB3  GLU 800           HB3      GLU 800  44.621  -4.247 -13.507
    5    HG2  GLU 800           HG2      GLU 800  44.191  -2.972 -11.428
    6    HG3  GLU 800           HG3      GLU 800  45.332  -4.020 -10.595

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLY 801           H        GLY 801  42.722  -7.773 -11.658
    2    HA3  GLY 801           HA2      GLY 801  44.188  -8.374  -9.205
    3    HA2  GLY 801           HA3      GLY 801  42.930  -9.379  -9.918

  No H/Q in entry =           3
  In of MODEL   45
    1    H    PHE 802           H        PHE 802  44.417 -11.092  -9.364
    2    HA   PHE 802           HA       PHE 802  46.851 -11.374 -10.941
    3    HB2  PHE 802           HB2      PHE 802  45.444 -13.220  -9.024
    4    HB3  PHE 802           HB3      PHE 802  46.901 -13.672  -9.892
    5    HD1  PHE 802           HD1      PHE 802  49.023 -12.482  -9.443
    6    HD2  PHE 802           HD2      PHE 802  45.507 -11.803  -7.142
    7    HE1  PHE 802           HE1      PHE 802  50.357 -11.508  -7.705
    8    HE2  PHE 802           HE2      PHE 802  46.849 -10.797  -5.396
    9    HZ   PHE 802           HZ       PHE 802  49.300 -10.645  -5.644

  No H/Q in entry =           9
  In of MODEL   45
    1    H    SER 803           H        SER 803  46.936 -13.951 -11.687
    2    HA   SER 803           HA       SER 803  44.656 -14.386 -13.404
    3    HB2  SER 803           HB2      SER 803  47.559 -14.974 -14.013
    4    HB3  SER 803           HB3      SER 803  46.180 -15.186 -15.095
    5    HG   SER 803           HG       SER 803  45.928 -12.951 -15.176

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ILE 804           H        ILE 804  43.949 -16.482 -13.299
    2    HA   ILE 804           HA       ILE 804  45.495 -18.360 -11.674
    3    HB   ILE 804           HB       ILE 804  43.579 -19.097 -10.410
    4   HG12  ILE 804          HG12      ILE 804  41.809 -18.748 -12.133
    5   HG13  ILE 804          HG13      ILE 804  41.332 -18.165 -10.548
    6   HG21  ILE 804          HG21      ILE 804  44.755 -17.237  -9.428
    7   HG23  ILE 804          HG22      ILE 804  43.031 -17.109  -9.056
    8   HG22  ILE 804          HG23      ILE 804  43.741 -16.099 -10.317
    9   HD12  ILE 804          HD11      ILE 804  42.190 -16.516 -12.919
   10   HD11  ILE 804          HD12      ILE 804  41.880 -15.871 -11.312
   11   HD13  ILE 804          HD13      ILE 804  40.576 -16.640 -12.219

  No H/Q in entry =          11
  In of MODEL   45
    1    H    CYS 805           H        CYS 805  44.465 -20.599 -11.840
    2    HA   CYS 805           HA       CYS 805  43.811 -21.050 -14.666
    3    HB2  CYS 805           HB2      CYS 805  45.943 -22.021 -13.944
    4    HB3  CYS 805           HB3      CYS 805  45.126 -22.847 -12.625

  No H/Q in entry =           4
  In of MODEL   45
    1    H    VAL 806           H        VAL 806  41.864 -21.668 -15.092
    2    HA   VAL 806           HA       VAL 806  40.344 -22.978 -12.956
    3    HB   VAL 806           HB       VAL 806  39.151 -21.217 -15.071
    4   HG11  VAL 806          HG11      VAL 806  38.083 -22.195 -12.451
    5   HG13  VAL 806          HG12      VAL 806  37.593 -22.703 -14.054
    6   HG12  VAL 806          HG13      VAL 806  37.273 -21.046 -13.513
    7   HG22  VAL 806          HG21      VAL 806  40.627 -19.763 -13.863
    8   HG21  VAL 806          HG22      VAL 806  39.992 -20.332 -12.319
    9   HG23  VAL 806          HG23      VAL 806  38.964 -19.403 -13.417

  No H/Q in entry =           9
  In of MODEL   45
    1    H    GLU 807           H        GLU 807  39.467 -24.880 -13.552
    2    HA   GLU 807           HA       GLU 807  39.813 -25.782 -16.256
    3    HB2  GLU 807           HB2      GLU 807  40.304 -27.283 -14.319
    4    HB3  GLU 807           HB3      GLU 807  38.606 -27.221 -13.883
    5    HG2  GLU 807           HG2      GLU 807  38.017 -28.233 -16.026
    6    HG3  GLU 807           HG3      GLU 807  39.724 -28.305 -16.455

  No H/Q in entry =           6
  In of MODEL   45
    1    H    VAL 808           H        VAL 808  38.428 -25.284 -17.627
    2    HA   VAL 808           HA       VAL 808  35.553 -25.315 -17.092
    3    HB   VAL 808           HB       VAL 808  36.982 -23.120 -18.547
    4   HG12  VAL 808          HG11      VAL 808  34.089 -23.321 -17.848
    5   HG11  VAL 808          HG12      VAL 808  34.848 -23.502 -19.441
    6   HG13  VAL 808          HG13      VAL 808  34.901 -21.941 -18.615
    7   HG21  VAL 808          HG21      VAL 808  35.850 -23.045 -15.803
    8   HG23  VAL 808          HG22      VAL 808  36.260 -21.617 -16.746
    9   HG22  VAL 808          HG23      VAL 808  37.519 -22.774 -16.315

  No H/Q in entry =           9
  In of MODEL   45
    1    H    ASN 809           H        ASN 809  34.498 -26.044 -18.949
    2    HA   ASN 809           HA       ASN 809  34.135 -26.918 -20.979
    3    HB2  ASN 809           HB2      ASN 809  36.664 -25.466 -21.671
    4    HB3  ASN 809           HB3      ASN 809  35.825 -26.434 -22.862
    5   HD21  ASN 809          HD21      ASN 809  36.349 -23.591 -22.641
    6   HD22  ASN 809          HD22      ASN 809  34.804 -22.830 -22.787

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLY 810           H        GLY 810  36.252 -27.901 -18.881
    2    HA3  GLY 810           HA2      GLY 810  37.123 -30.077 -18.596
    3    HA2  GLY 810           HA3      GLY 810  37.035 -30.297 -20.345

  No H/Q in entry =           3
  In of MODEL   45
    1    H    LYS 811           H        LYS 811  38.253 -27.351 -20.047
    2    HA   LYS 811           HA       LYS 811  41.030 -28.261 -20.385
    3    HB2  LYS 811           HB2      LYS 811  39.851 -25.570 -21.017
    4    HB3  LYS 811           HB3      LYS 811  41.375 -26.228 -21.577
    5    HG2  LYS 811           HG2      LYS 811  38.671 -27.243 -22.324
    6    HG3  LYS 811           HG3      LYS 811  39.626 -26.074 -23.258
    7    HD2  LYS 811           HD2      LYS 811  40.472 -28.902 -22.604
    8    HD3  LYS 811           HD3      LYS 811  39.727 -28.397 -24.123
    9    HE2  LYS 811           HE2      LYS 811  41.614 -26.798 -24.462
   10    HE3  LYS 811           HE3      LYS 811  42.368 -27.427 -23.000
   11    HZ3  LYS 811           HZ1      LYS 811  43.321 -28.422 -24.951
   12    HZ2  LYS 811           HZ2      LYS 811  41.831 -28.962 -25.489
   13    HZ1  LYS 811           HZ3      LYS 811  42.510 -29.613 -24.091

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLU 812           H        GLU 812  42.512 -26.627 -19.616
    2    HA   GLU 812           HA       GLU 812  41.521 -25.217 -17.247
    3    HB2  GLU 812           HB2      GLU 812  44.139 -26.682 -17.514
    4    HB3  GLU 812           HB3      GLU 812  43.927 -25.399 -16.329
    5    HG2  GLU 812           HG2      GLU 812  42.039 -26.620 -15.374
    6    HG3  GLU 812           HG3      GLU 812  42.305 -27.921 -16.523

  No H/Q in entry =           6
  In of MODEL   45
    1    H    GLN 813           H        GLN 813  41.229 -23.322 -17.870
    2    HA   GLN 813           HA       GLN 813  43.160 -22.038 -19.668
    3    HB2  GLN 813           HB2      GLN 813  40.958 -22.263 -20.530
    4    HB3  GLN 813           HB3      GLN 813  40.229 -21.559 -19.093
    5    HG2  GLN 813           HG2      GLN 813  41.202 -19.444 -19.641
    6    HG3  GLN 813           HG3      GLN 813  42.019 -20.109 -21.066
    7   HE21  GLN 813          HE21      GLN 813  39.089 -18.952 -19.716
    8   HE22  GLN 813          HE22      GLN 813  38.119 -19.057 -21.150

  No H/Q in entry =           8
  In of MODEL   45
    1    H    THR 814           H        THR 814  44.058 -20.133 -19.099
    2    HA   THR 814           HA       THR 814  43.952 -19.356 -16.328
    3    HB   THR 814           HB       THR 814  45.358 -18.051 -18.653
    4    HG1  THR 814           HG1      THR 814  47.043 -19.361 -18.235
    5   HG21  THR 814          HG21      THR 814  45.835 -17.891 -15.670
    6   HG23  THR 814          HG22      THR 814  45.188 -16.606 -16.686
    7   HG22  THR 814          HG23      THR 814  46.856 -17.143 -16.894

  No H/Q in entry =           7
  In of MODEL   45
    1    H    MET 815           H        MET 815  42.781 -17.705 -15.579
    2    HA   MET 815           HA       MET 815  41.588 -15.846 -17.525
    3    HB2  MET 815           HB2      MET 815  40.236 -16.721 -14.983
    4    HB3  MET 815           HB3      MET 815  39.554 -15.751 -16.276
    5    HG2  MET 815           HG2      MET 815  39.916 -17.879 -17.715
    6    HG3  MET 815           HG3      MET 815  40.110 -18.630 -16.137
    7    HE2  MET 815           HE1      MET 815  38.202 -20.279 -16.776
    8    HE1  MET 815           HE2      MET 815  38.049 -19.418 -18.298
    9    HE3  MET 815           HE3      MET 815  36.602 -19.751 -17.331

  No H/Q in entry =           9
  In of MODEL   45
    1    H    SER 816           H        SER 816  40.988 -13.835 -16.457
    2    HA   SER 816           HA       SER 816  42.963 -13.079 -14.516
    3    HB2  SER 816           HB2      SER 816  40.595 -11.535 -15.617
    4    HB3  SER 816           HB3      SER 816  41.920 -10.871 -14.654
    5    HG   SER 816           HG       SER 816  41.819 -11.172 -17.284

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLU 817           H        GLU 817  42.492 -12.466 -12.455
    2    HA   GLU 817           HA       GLU 817  40.962 -14.093 -10.912
    3    HB2  GLU 817           HB2      GLU 817  42.850 -12.565 -10.330
    4    HB3  GLU 817           HB3      GLU 817  41.676 -11.278 -10.379
    5    HG2  GLU 817           HG2      GLU 817  40.593 -11.927  -8.522
    6    HG3  GLU 817           HG3      GLU 817  41.181 -13.596  -8.636

  No H/Q in entry =           6
  In of MODEL   45
    1    H    CYS 818           H        CYS 818  40.138 -10.823 -11.939
    2    HA   CYS 818           HA       CYS 818  37.635 -10.702 -10.695
    3    HB2  CYS 818           HB2      CYS 818  37.274  -8.806 -12.373
    4    HB3  CYS 818           HB3      CYS 818  38.663  -8.666 -11.295

  No H/Q in entry =           4
  In of MODEL   45
    1    H    GLU 819           H        GLU 819  38.677 -11.833 -13.799
    2    HA   GLU 819           HA       GLU 819  36.244 -12.058 -15.162
    3    HB2  GLU 819           HB2      GLU 819  38.410 -11.941 -16.251
    4    HB3  GLU 819           HB3      GLU 819  38.913 -13.420 -15.475
    5    HG2  GLU 819           HG2      GLU 819  37.397 -14.701 -16.850
    6    HG3  GLU 819           HG3      GLU 819  36.733 -13.212 -17.535

  No H/Q in entry =           6
  In of MODEL   45
    1    H    ALA 820           H        ALA 820  38.319 -14.609 -13.756
    2    HA   ALA 820           HA       ALA 820  36.578 -16.722 -14.043
    3    HB2  ALA 820           HB1      ALA 820  37.873 -17.841 -12.295
    4    HB3  ALA 820           HB2      ALA 820  38.596 -16.290 -11.869
    5    HB1  ALA 820           HB3      ALA 820  38.900 -17.005 -13.459

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLY 821           H        GLY 821  36.921 -14.387 -11.436
    2    HA3  GLY 821           HA2      GLY 821  35.179 -15.510  -9.551
    3    HA2  GLY 821           HA3      GLY 821  35.581 -13.799  -9.673

  No H/Q in entry =           3
  In of MODEL   45
    1    H    ALA 822           H        ALA 822  34.573 -13.267 -12.213
    2    HA   ALA 822           HA       ALA 822  31.865 -12.878 -11.578
    3    HB1  ALA 822           HB1      ALA 822  33.149 -11.328 -12.960
    4    HB3  ALA 822           HB2      ALA 822  31.650 -11.854 -13.729
    5    HB2  ALA 822           HB3      ALA 822  33.205 -12.528 -14.256

  No H/Q in entry =           5
  In of MODEL   45
    1    H    LEU 823           H        LEU 823  33.527 -15.244 -13.616
    2    HA   LEU 823           HA       LEU 823  31.203 -16.395 -14.713
    3    HB2  LEU 823           HB2      LEU 823  33.873 -17.667 -14.132
    4    HB3  LEU 823           HB3      LEU 823  32.534 -18.618 -14.714
    5    HG   LEU 823           HG       LEU 823  33.793 -18.244 -16.589
    6   HD13  LEU 823          HD11      LEU 823  32.544 -16.899 -18.094
    7   HD12  LEU 823          HD12      LEU 823  31.838 -16.008 -16.761
    8   HD11  LEU 823          HD13      LEU 823  31.447 -17.720 -16.971
    9   HD23  LEU 823          HD21      LEU 823  34.714 -16.080 -17.298
   10   HD22  LEU 823          HD22      LEU 823  35.367 -16.642 -15.764
   11   HD21  LEU 823          HD23      LEU 823  34.142 -15.371 -15.787

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ARG 824           H        ARG 824  32.791 -17.010 -11.648
    2    HA   ARG 824           HA       ARG 824  31.148 -19.173 -10.783
    3    HB2  ARG 824           HB2      ARG 824  32.271 -17.023  -8.977
    4    HB3  ARG 824           HB3      ARG 824  31.809 -18.643  -8.507
    5    HG2  ARG 824           HG2      ARG 824  33.728 -19.491  -9.874
    6    HG3  ARG 824           HG3      ARG 824  34.200 -17.808 -10.143
    7    HD2  ARG 824           HD2      ARG 824  34.016 -19.296  -7.535
    8    HD3  ARG 824           HD3      ARG 824  35.474 -18.710  -8.317
    9    HE   ARG 824           HE       ARG 824  33.927 -16.472  -7.933
   10   HH11  ARG 824          HH11      ARG 824  35.362 -18.893  -5.700
   11   HH12  ARG 824          HH12      ARG 824  35.466 -17.792  -4.397
   12   HH21  ARG 824          HH21      ARG 824  34.165 -14.984  -6.053
   13   HH22  ARG 824          HH22      ARG 824  34.853 -15.590  -4.622

  No H/Q in entry =          13
  In of MODEL   45
    1    H    CYS 825           H        CYS 825  30.939 -15.729 -10.332
    2    HA   CYS 825           HA       CYS 825  28.657 -15.681  -8.748
    3    HB2  CYS 825           HB2      CYS 825  30.096 -13.688 -10.385
    4    HB3  CYS 825           HB3      CYS 825  28.684 -13.205  -9.478

  No H/Q in entry =           4
  In of MODEL   45
    1    H    ARG 826           H        ARG 826  28.942 -15.340 -12.274
    2    HA   ARG 826           HA       ARG 826  26.191 -14.725 -12.613
    3    HB2  ARG 826           HB2      ARG 826  26.563 -15.353 -15.020
    4    HB3  ARG 826           HB3      ARG 826  27.651 -14.099 -14.409
    5    HG2  ARG 826           HG2      ARG 826  29.390 -15.739 -14.206
    6    HG3  ARG 826           HG3      ARG 826  28.294 -17.006 -14.754
    7    HD2  ARG 826           HD2      ARG 826  29.001 -14.568 -16.377
    8    HD3  ARG 826           HD3      ARG 826  29.816 -16.125 -16.516
    9    HE   ARG 826           HE       ARG 826  27.121 -16.598 -16.787
   10   HH11  ARG 826          HH11      ARG 826  29.611 -14.787 -18.541
   11   HH12  ARG 826          HH12      ARG 826  28.944 -15.059 -20.065
   12   HH21  ARG 826          HH21      ARG 826  26.191 -16.993 -18.919
   13   HH22  ARG 826          HH22      ARG 826  26.931 -16.318 -20.293

  No H/Q in entry =          13
  In of MODEL   45
    1    H    GLY 827           H        GLY 827  27.861 -17.678 -12.169
    2    HA3  GLY 827           HA2      GLY 827  26.558 -19.594 -11.488
    3    HA2  GLY 827           HA3      GLY 827  25.302 -19.066 -12.591

  No H/Q in entry =           3
  In of MODEL   45
    1    H    GLN 828           H        GLN 828  28.441 -18.789 -13.844
    2    HA   GLN 828           HA       GLN 828  27.948 -20.848 -15.782
    3    HB2  GLN 828           HB2      GLN 828  29.109 -18.734 -16.358
    4    HB3  GLN 828           HB3      GLN 828  30.417 -19.171 -15.275
    5    HG2  GLN 828           HG2      GLN 828  30.978 -19.571 -17.648
    6    HG3  GLN 828           HG3      GLN 828  30.999 -21.041 -16.674
    7   HE21  GLN 828          HE21      GLN 828  29.306 -19.266 -19.116
    8   HE22  GLN 828          HE22      GLN 828  28.334 -20.565 -19.681

  No H/Q in entry =           8
  In of MODEL   45
    1    H    SER 829           H        SER 829  29.216 -22.749 -16.060
    2    HA   SER 829           HA       SER 829  30.148 -23.843 -13.542
    3    HB2  SER 829           HB2      SER 829  29.783 -25.154 -16.251
    4    HB3  SER 829           HB3      SER 829  30.157 -25.997 -14.747
    5    HG   SER 829           HG       SER 829  27.887 -24.332 -15.004

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ILE 830           H        ILE 830  32.165 -23.440 -12.988
    2    HA   ILE 830           HA       ILE 830  34.452 -23.850 -14.806
    3    HB   ILE 830           HB       ILE 830  35.538 -21.834 -14.127
    4   HG12  ILE 830          HG12      ILE 830  34.618 -21.687 -11.780
    5   HG13  ILE 830          HG13      ILE 830  34.729 -20.130 -12.552
    6   HG21  ILE 830          HG21      ILE 830  34.153 -21.545 -16.021
    7   HG23  ILE 830          HG22      ILE 830  34.219 -20.043 -15.097
    8   HG22  ILE 830          HG23      ILE 830  32.782 -21.078 -15.010
    9   HD13  ILE 830          HD11      ILE 830  32.332 -20.201 -13.000
   10   HD12  ILE 830          HD12      ILE 830  32.703 -20.325 -11.285
   11   HD11  ILE 830          HD13      ILE 830  32.230 -21.768 -12.194

  No H/Q in entry =          11
  In of MODEL   45
    1    H    SER 831           H        SER 831  36.240 -24.577 -13.572
    2    HA   SER 831           HA       SER 831  35.727 -24.936 -10.721
    3    HB2  SER 831           HB2      SER 831  37.028 -26.752 -12.704
    4    HB3  SER 831           HB3      SER 831  36.895 -27.036 -10.966
    5    HG   SER 831           HG       SER 831  34.643 -27.159 -11.218

  No H/Q in entry =           5
  In of MODEL   45
    1    H    VAL 832           H        VAL 832  37.111 -23.370  -9.853
    2    HA   VAL 832           HA       VAL 832  39.636 -22.756 -11.010
    3    HB   VAL 832           HB       VAL 832  38.741 -22.257  -8.153
    4   HG11  VAL 832          HG11      VAL 832  41.194 -22.141  -8.405
    5   HG13  VAL 832          HG12      VAL 832  40.524 -20.539  -8.102
    6   HG12  VAL 832          HG13      VAL 832  41.012 -21.000  -9.732
    7   HG23  VAL 832          HG21      VAL 832  38.657 -20.436 -10.566
    8   HG22  VAL 832          HG22      VAL 832  38.239 -19.968  -8.920
    9   HG21  VAL 832          HG23      VAL 832  37.264 -21.169  -9.769

  No H/Q in entry =           9
  In of MODEL   45
    1    H    THR 833           H        THR 833  41.154 -24.220 -11.232
    2    HA   THR 833           HA       THR 833  41.374 -26.359  -9.320
    3    HB   THR 833           HB       THR 833  43.209 -27.103 -10.920
    4    HG1  THR 833           HG1      THR 833  43.198 -26.067 -12.944
    5   HG23  THR 833          HG21      THR 833  40.933 -28.022 -10.977
    6   HG22  THR 833          HG22      THR 833  41.592 -27.861 -12.607
    7   HG21  THR 833          HG23      THR 833  40.423 -26.682 -12.006

  No H/Q in entry =           7
  In of MODEL   45
    1    H    SER 834           H        SER 834  43.089 -23.467 -10.242
    2    HA   SER 834           HA       SER 834  44.760 -23.702  -7.934
    3    HB2  SER 834           HB2      SER 834  46.821 -23.419  -9.518
    4    HB3  SER 834           HB3      SER 834  46.163 -25.029  -9.168
    5    HG   SER 834           HG       SER 834  44.781 -24.267 -11.147

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ILE 835           H        ILE 835  45.915 -21.781  -7.447
    2    HA   ILE 835           HA       ILE 835  44.667 -19.475  -8.672
    3    HB   ILE 835           HB       ILE 835  45.538 -18.181  -6.704
    4   HG12  ILE 835          HG12      ILE 835  46.055 -19.578  -4.642
    5   HG13  ILE 835          HG13      ILE 835  46.352 -20.927  -5.726
    6   HG22  ILE 835          HG21      ILE 835  43.918 -19.076  -5.145
    7   HG21  ILE 835          HG22      ILE 835  43.767 -20.523  -6.151
    8   HG23  ILE 835          HG23      ILE 835  43.280 -18.945  -6.787
    9   HD13  ILE 835          HD11      ILE 835  48.397 -19.871  -5.020
   10   HD12  ILE 835          HD12      ILE 835  47.793 -18.321  -5.635
   11   HD11  ILE 835          HD13      ILE 835  48.147 -19.635  -6.761

  No H/Q in entry =          11
  In of MODEL   45
    1    H    ARG 836           H        ARG 836  47.066 -21.115  -9.455
    2    HA   ARG 836           HA       ARG 836  48.978 -18.990  -9.982
    3    HB2  ARG 836           HB2      ARG 836  49.058 -21.979 -10.265
    4    HB3  ARG 836           HB3      ARG 836  50.299 -20.927 -10.932
    5    HG2  ARG 836           HG2      ARG 836  50.866 -20.121  -8.761
    6    HG3  ARG 836           HG3      ARG 836  49.519 -21.002  -8.036
    7    HD2  ARG 836           HD2      ARG 836  51.798 -22.269  -9.522
    8    HD3  ARG 836           HD3      ARG 836  51.678 -22.063  -7.762
    9    HE   ARG 836           HE       ARG 836  49.628 -23.412  -7.880
   10   HH11  ARG 836          HH11      ARG 836  52.059 -23.880 -10.446
   11   HH12  ARG 836          HH12      ARG 836  51.546 -25.439 -10.826
   12   HH21  ARG 836          HH21      ARG 836  48.975 -25.623  -8.415
   13   HH22  ARG 836          HH22      ARG 836  49.752 -26.451  -9.664

  No H/Q in entry =          13
  In of MODEL   45
    1    HA   PRO 837           HA       PRO 837  47.184 -18.955 -14.091
    2    HB2  PRO 837           HB2      PRO 837  49.691 -18.144 -15.323
    3    HB3  PRO 837           HB3      PRO 837  48.245 -17.184 -15.053
    4    HG2  PRO 837           HG2      PRO 837  50.587 -16.762 -13.706
    5    HG3  PRO 837           HG3      PRO 837  48.994 -16.349 -13.056
    6    HD2  PRO 837           HD2      PRO 837  50.735 -18.704 -12.468
    7    HD3  PRO 837           HD3      PRO 837  49.710 -17.744 -11.375

  No H/Q in entry =           7
  In of MODEL   45
    1    H    CYS 838           H        CYS 838  47.128 -20.249 -15.947
    2    HA   CYS 838           HA       CYS 838  48.900 -22.568 -15.890
    3    HB2  CYS 838           HB2      CYS 838  46.352 -22.825 -16.021
    4    HB3  CYS 838           HB3      CYS 838  46.440 -22.021 -17.572

  No H/Q in entry =           4
  In of MODEL   45
    1    H    ALA 839           H        ALA 839  49.412 -23.311 -18.269
    2    HA   ALA 839           HA       ALA 839  50.810 -21.179 -19.571
    3    HB2  ALA 839           HB1      ALA 839  50.379 -24.052 -20.387
    4    HB1  ALA 839           HB2      ALA 839  51.760 -23.421 -19.481
    5    HB3  ALA 839           HB3      ALA 839  51.492 -22.926 -21.153

  No H/Q in entry =           5
  In of MODEL   45
    1    H    ALA 840           H        ALA 840  47.667 -22.081 -19.598
    2    HA   ALA 840           HA       ALA 840  47.133 -21.519 -22.392
    3    HB1  ALA 840           HB1      ALA 840  45.913 -23.351 -21.367
    4    HB3  ALA 840           HB2      ALA 840  44.793 -22.057 -21.807
    5    HB2  ALA 840           HB3      ALA 840  45.302 -22.265 -20.129

  No H/Q in entry =           5
  In of MODEL   45
    1    H    GLU 841           H        GLU 841  48.049 -19.313 -22.026
    2    HA   GLU 841           HA       GLU 841  45.953 -17.505 -21.027
    3    HB2  GLU 841           HB2      GLU 841  48.903 -16.957 -21.469
    4    HB3  GLU 841           HB3      GLU 841  47.723 -15.709 -21.108
    5    HG2  GLU 841           HG2      GLU 841  47.259 -16.822 -18.966
    6    HG3  GLU 841           HG3      GLU 841  48.520 -18.002 -19.325

  No H/Q in entry =           6
  In of MODEL   45
    1    H    THR 842           H        THR 842  44.722 -17.770 -22.858
    2    HA   THR 842           HA       THR 842  43.969 -17.658 -24.883
    3    HB   THR 842           HB       THR 842  44.531 -15.714 -26.314
    4    HG1  THR 842           HG1      THR 842  46.692 -15.628 -24.715
    5   HG22  THR 842          HG21      THR 842  43.707 -13.973 -24.772
    6   HG21  THR 842          HG22      THR 842  44.030 -15.055 -23.417
    7   HG23  THR 842          HG23      THR 842  42.815 -15.487 -24.621

  No H/Q in entry =           7
  In of MODEL   45
    1    H    GLN 843           H        GLN 843  44.363 -17.899 -27.231
    2    HA   GLN 843           HA       GLN 843  46.935 -19.176 -27.678
    3    HB2  GLN 843           HB2      GLN 843  44.210 -20.247 -28.454
    4    HB3  GLN 843           HB3      GLN 843  45.726 -20.892 -29.066
    5    HG2  GLN 843           HG2      GLN 843  46.404 -21.545 -26.845
    6    HG3  GLN 843           HG3      GLN 843  44.972 -20.794 -26.152
    7   HE21  GLN 843          HE21      GLN 843  43.201 -21.793 -28.275
    8   HE22  GLN 843          HE22      GLN 843  43.009 -23.469 -27.954

  No H/Q in entry =           8
  In of MODEL   46
    1    H1   GLY 689           H3       GLY 689  76.165   0.599 -15.847
    2    H2   GLY 689           H2       GLY 689  77.464  -0.321 -15.302
    3    H3   GLY 689           H1       GLY 689  76.648   0.728 -14.251
    4    HA2  GLY 689           HA2      GLY 689  78.252   1.531 -16.588
    5    HA3  GLY 689           HA3      GLY 689  78.692   1.767 -14.896

  No H/Q in entry =           5
  In of MODEL   46
    1    H    SER 690           H        SER 690  78.735   4.066 -16.036
    2    HA   SER 690           HA       SER 690  76.209   5.269 -15.293
    3    HB2  SER 690           HB2      SER 690  78.444   6.183 -14.447
    4    HB3  SER 690           HB3      SER 690  78.767   6.682 -16.109
    5    HG   SER 690           HG       SER 690  77.735   8.193 -14.507

  No H/Q in entry =           5
  In of MODEL   46
    1    H    HIS 691           H        HIS 691  74.778   5.350 -16.860
    2    HA   HIS 691           HA       HIS 691  75.699   5.450 -19.657
    3    HB2  HIS 691           HB2      HIS 691  74.373   3.464 -18.746
    4    HB3  HIS 691           HB3      HIS 691  73.016   4.561 -18.588
    5    HD1  HIS 691           HD1      HIS 691  71.605   4.889 -20.609
    6    HD2  HIS 691           HD2      HIS 691  75.194   3.010 -21.482
    7    HE1  HIS 691           HE1      HIS 691  71.397   4.098 -22.984
    8    HE2  HIS 691           HE2      HIS 691  73.482   2.769 -23.387

  No H/Q in entry =           8
  In of MODEL   46
    1    H    MET 692           H        MET 692  75.009   7.113 -20.934
    2    HA   MET 692           HA       MET 692  74.149   9.534 -19.796
    3    HB2  MET 692           HB2      MET 692  74.033   8.637 -22.675
    4    HB3  MET 692           HB3      MET 692  73.746  10.281 -22.146
    5    HG2  MET 692           HG2      MET 692  76.045  10.383 -21.297
    6    HG3  MET 692           HG3      MET 692  76.310   8.737 -21.867
    7    HE2  MET 692           HE1      MET 692  78.387  10.964 -24.354
    8    HE1  MET 692           HE2      MET 692  78.457   9.654 -23.174
    9    HE3  MET 692           HE3      MET 692  78.110  11.299 -22.649

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ASN 693           H        ASN 693  72.367   7.426 -21.989
    2    HA   ASN 693           HA       ASN 693  69.867   8.757 -21.479
    3    HB2  ASN 693           HB2      ASN 693  70.436   6.125 -22.896
    4    HB3  ASN 693           HB3      ASN 693  68.871   6.911 -22.844
    5   HD21  ASN 693          HD21      ASN 693  68.702   7.121 -25.023
    6   HD22  ASN 693          HD22      ASN 693  69.699   8.164 -25.968

  No H/Q in entry =           6
  In of MODEL   46
    1    HA   PRO 694           HA       PRO 694  68.655   6.390 -17.886
    2    HB2  PRO 694           HB2      PRO 694  65.951   6.101 -18.510
    3    HB3  PRO 694           HB3      PRO 694  66.641   7.496 -17.676
    4    HG2  PRO 694           HG2      PRO 694  65.934   7.165 -20.557
    5    HG3  PRO 694           HG3      PRO 694  65.761   8.589 -19.516
    6    HD2  PRO 694           HD2      PRO 694  67.737   8.405 -21.308
    7    HD3  PRO 694           HD3      PRO 694  67.994   9.169 -19.724

  No H/Q in entry =           7
  In of MODEL   46
    1    H    LEU 695           H        LEU 695  68.639   4.199 -17.519
    2    HA   LEU 695           HA       LEU 695  68.664   2.587 -19.875
    3    HB2  LEU 695           HB2      LEU 695  69.412   0.695 -18.551
    4    HB3  LEU 695           HB3      LEU 695  70.363   2.103 -18.174
    5    HG   LEU 695           HG       LEU 695  68.177   0.973 -16.409
    6   HD12  LEU 695          HD11      LEU 695  71.169   0.720 -16.207
    7   HD11  LEU 695          HD12      LEU 695  70.029  -0.565 -16.610
    8   HD13  LEU 695          HD13      LEU 695  70.003   0.167 -15.004
    9   HD23  LEU 695          HD21      LEU 695  69.175   2.399 -14.664
   10   HD22  LEU 695          HD22      LEU 695  68.523   3.346 -15.990
   11   HD21  LEU 695          HD23      LEU 695  70.267   3.092 -15.863

  No H/Q in entry =          11
  In of MODEL   46
    1    H    THR 696           H        THR 696  66.684   2.819 -20.600
    2    HA   THR 696           HA       THR 696  64.436   1.831 -19.120
    3    HB   THR 696           HB       THR 696  64.201   3.789 -20.621
    4    HG1  THR 696           HG1      THR 696  62.653   1.496 -20.975
    5   HG21  THR 696          HG21      THR 696  64.703   1.817 -22.860
    6   HG23  THR 696          HG22      THR 696  65.755   3.153 -22.394
    7   HG22  THR 696          HG23      THR 696  64.160   3.482 -23.074

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLN 697           H        GLN 697  66.864   0.318 -20.601
    2    HA   GLN 697           HA       GLN 697  65.435  -1.821 -21.916
    3    HB2  GLN 697           HB2      GLN 697  68.323  -1.667 -21.006
    4    HB3  GLN 697           HB3      GLN 697  67.642  -2.916 -22.032
    5    HG2  GLN 697           HG2      GLN 697  67.806  -0.003 -22.755
    6    HG3  GLN 697           HG3      GLN 697  68.970  -1.229 -23.248
    7   HE21  GLN 697          HE21      GLN 697  68.571  -0.905 -25.411
    8   HE22  GLN 697          HE22      GLN 697  67.105  -1.405 -26.183

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ALA 698           H        ALA 698  66.664  -1.032 -18.841
    2    HA   ALA 698           HA       ALA 698  66.415  -3.714 -17.830
    3    HB1  ALA 698           HB1      ALA 698  67.229  -1.196 -16.383
    4    HB3  ALA 698           HB2      ALA 698  68.337  -2.335 -17.143
    5    HB2  ALA 698           HB3      ALA 698  67.351  -2.847 -15.772

  No H/Q in entry =           5
  In of MODEL   46
    1    H    VAL 699           H        VAL 699  64.224  -3.946 -18.102
    2    HA   VAL 699           HA       VAL 699  62.565  -2.390 -16.246
    3    HB   VAL 699           HB       VAL 699  61.583  -4.357 -18.335
    4   HG12  VAL 699          HG11      VAL 699  60.173  -2.094 -16.927
    5   HG11  VAL 699          HG12      VAL 699  60.033  -3.793 -16.517
    6   HG13  VAL 699          HG13      VAL 699  59.449  -3.213 -18.084
    7   HG22  VAL 699          HG21      VAL 699  62.814  -2.618 -19.506
    8   HG21  VAL 699          HG22      VAL 699  61.913  -1.376 -18.641
    9   HG23  VAL 699          HG23      VAL 699  61.081  -2.435 -19.781

  No H/Q in entry =           9
  In of MODEL   46
    1    HA   PRO 700           HA       PRO 700  63.446  -6.070 -13.798
    2    HB2  PRO 700           HB2      PRO 700  61.651  -4.692 -11.901
    3    HB3  PRO 700           HB3      PRO 700  63.283  -5.316 -11.638
    4    HG2  PRO 700           HG2      PRO 700  62.864  -2.696 -11.840
    5    HG3  PRO 700           HG3      PRO 700  64.290  -3.439 -12.582
    6    HD2  PRO 700           HD2      PRO 700  61.740  -2.543 -13.864
    7    HD3  PRO 700           HD3      PRO 700  63.419  -2.375 -14.426

  No H/Q in entry =           7
  In of MODEL   46
    1    H    LYS 701           H        LYS 701  60.242  -4.711 -13.632
    2    HA   LYS 701           HA       LYS 701  58.174  -5.605 -13.703
    3    HB2  LYS 701           HB2      LYS 701  59.558  -7.853 -15.152
    4    HB3  LYS 701           HB3      LYS 701  57.818  -7.761 -14.926
    5    HG2  LYS 701           HG2      LYS 701  57.719  -5.734 -16.216
    6    HG3  LYS 701           HG3      LYS 701  59.485  -5.711 -16.329
    7    HD2  LYS 701           HD2      LYS 701  59.522  -7.686 -17.551
    8    HD3  LYS 701           HD3      LYS 701  57.788  -7.959 -17.326
    9    HE2  LYS 701           HE2      LYS 701  59.013  -5.635 -18.823
   10    HE3  LYS 701           HE3      LYS 701  58.354  -7.077 -19.590
   11    HZ2  LYS 701           HZ1      LYS 701  56.781  -5.274 -19.620
   12    HZ1  LYS 701           HZ2      LYS 701  56.776  -5.136 -17.944
   13    HZ3  LYS 701           HZ3      LYS 701  56.176  -6.522 -18.688

  No H/Q in entry =          13
  In of MODEL   46
    1    H    CYS 702           H        CYS 702  57.393  -6.057 -11.858
    2    HA   CYS 702           HA       CYS 702  58.440  -8.339 -10.352
    3    HB2  CYS 702           HB2      CYS 702  56.671  -6.085  -9.343
    4    HB3  CYS 702           HB3      CYS 702  57.529  -7.290  -8.410

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLN 703           H        GLN 703  56.861  -9.748  -9.375
    2    HA   GLN 703           HA       GLN 703  54.563 -10.230 -11.014
    3    HB2  GLN 703           HB2      GLN 703  55.359 -11.308  -8.302
    4    HB3  GLN 703           HB3      GLN 703  54.105 -11.966  -9.340
    5    HG2  GLN 703           HG2      GLN 703  57.023 -11.826 -10.070
    6    HG3  GLN 703           HG3      GLN 703  56.217 -13.246  -9.402
    7   HE21  GLN 703          HE21      GLN 703  54.861 -14.421 -10.691
    8   HE22  GLN 703          HE22      GLN 703  54.737 -14.176 -12.392

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ARG 704           H        ARG 704  52.421 -10.397  -9.925
    2    HA   ARG 704           HA       ARG 704  51.816  -7.688  -9.280
    3    HB2  ARG 704           HB2      ARG 704  49.996 -10.088  -9.280
    4    HB3  ARG 704           HB3      ARG 704  49.457  -8.415  -9.180
    5    HG2  ARG 704           HG2      ARG 704  50.477  -7.979 -11.381
    6    HG3  ARG 704           HG3      ARG 704  50.986  -9.676 -11.401
    7    HD2  ARG 704           HD2      ARG 704  48.808 -10.441 -11.456
    8    HD3  ARG 704           HD3      ARG 704  48.116  -8.829 -11.208
    9    HE   ARG 704           HE       ARG 704  49.699  -9.528 -13.597
   10   HH11  ARG 704          HH11      ARG 704  46.713  -8.109 -12.223
   11   HH12  ARG 704          HH12      ARG 704  46.072  -7.742 -13.742
   12   HH21  ARG 704          HH21      ARG 704  48.745  -8.965 -15.666
   13   HH22  ARG 704          HH22      ARG 704  47.214  -8.215 -15.713

  No H/Q in entry =          13
  In of MODEL   46
    1    H    TRP 705           H        TRP 705  52.489 -10.365  -7.320
    2    HA   TRP 705           HA       TRP 705  51.336  -9.160  -4.926
    3    HB2  TRP 705           HB2      TRP 705  52.147 -11.265  -3.838
    4    HB3  TRP 705           HB3      TRP 705  50.981 -11.514  -5.130
    5    HD1  TRP 705           HD1      TRP 705  54.615 -12.163  -4.206
    6    HE1  TRP 705           HE1      TRP 705  55.600 -13.866  -5.839
    7    HE3  TRP 705           HE3      TRP 705  50.776 -12.363  -7.581
    8    HZ2  TRP 705           HZ2      TRP 705  54.841 -15.133  -8.271
    9    HZ3  TRP 705           HZ3      TRP 705  50.986 -13.833  -9.517
   10    HH2  TRP 705           HH2      TRP 705  52.977 -15.198  -9.855

  No H/Q in entry =          10
  In of MODEL   46
    1    H    GLU 706           H        GLU 706  53.839  -8.462  -6.653
    2    HA   GLU 706           HA       GLU 706  55.607  -7.915  -4.405
    3    HB2  GLU 706           HB2      GLU 706  56.286  -8.593  -7.262
    4    HB3  GLU 706           HB3      GLU 706  57.443  -7.974  -6.092
    5    HG2  GLU 706           HG2      GLU 706  57.044  -9.964  -4.714
    6    HG3  GLU 706           HG3      GLU 706  55.953 -10.578  -5.959

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LYS 707           H        LYS 707  57.034  -6.075  -5.016
    2    HA   LYS 707           HA       LYS 707  55.902  -4.168  -6.849
    3    HB2  LYS 707           HB2      LYS 707  55.898  -2.349  -5.188
    4    HB3  LYS 707           HB3      LYS 707  54.744  -3.603  -4.768
    5    HG2  LYS 707           HG2      LYS 707  56.256  -4.459  -3.069
    6    HG3  LYS 707           HG3      LYS 707  57.472  -3.265  -3.535
    7    HD2  LYS 707           HD2      LYS 707  55.931  -1.474  -2.963
    8    HD3  LYS 707           HD3      LYS 707  54.721  -2.665  -2.483
    9    HE2  LYS 707           HE2      LYS 707  56.164  -3.449  -0.705
   10    HE3  LYS 707           HE3      LYS 707  57.443  -2.352  -1.217
   11    HZ2  LYS 707           HZ1      LYS 707  54.784  -1.563  -0.125
   12    HZ1  LYS 707           HZ2      LYS 707  55.914  -0.499  -0.754
   13    HZ3  LYS 707           HZ3      LYS 707  56.287  -1.373   0.629

  No H/Q in entry =          13
  In of MODEL   46
    1    H    LEU 708           H        LEU 708  57.425  -2.289  -7.028
    2    HA   LEU 708           HA       LEU 708  60.114  -3.422  -7.090
    3    HB2  LEU 708           HB2      LEU 708  59.108  -2.826  -9.203
    4    HB3  LEU 708           HB3      LEU 708  58.816  -1.199  -8.635
    5    HG   LEU 708           HG       LEU 708  61.272  -0.870  -8.484
    6   HD11  LEU 708          HD11      LEU 708  61.380  -3.518  -9.900
    7   HD13  LEU 708          HD12      LEU 708  61.969  -3.175  -8.275
    8   HD12  LEU 708          HD13      LEU 708  62.735  -2.413  -9.667
    9   HD21  LEU 708          HD21      LEU 708  60.174  -1.645 -11.165
   10   HD23  LEU 708          HD22      LEU 708  61.608  -0.659 -10.887
   11   HD22  LEU 708          HD23      LEU 708  60.024  -0.069 -10.389

  No H/Q in entry =          11
  In of MODEL   46
    1    H    GLN 709           H        GLN 709  61.568  -2.676  -5.652
    2    HA   GLN 709           HA       GLN 709  61.860   0.182  -5.380
    3    HB2  GLN 709           HB2      GLN 709  61.944   0.290  -3.006
    4    HB3  GLN 709           HB3      GLN 709  60.478  -0.606  -3.338
    5    HG2  GLN 709           HG2      GLN 709  61.658  -2.697  -2.828
    6    HG3  GLN 709           HG3      GLN 709  63.121  -1.758  -2.507
    7   HE21  GLN 709          HE21      GLN 709  63.288  -0.590  -0.638
    8   HE22  GLN 709          HE22      GLN 709  62.164  -0.738   0.665

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ASN 710           H        ASN 710  64.020   0.713  -4.892
    2    HA   ASN 710           HA       ASN 710  66.282   0.420  -4.739
    3    HB2  ASN 710           HB2      ASN 710  65.569  -1.013  -2.836
    4    HB3  ASN 710           HB3      ASN 710  65.548  -2.396  -3.891
    5   HD21  ASN 710          HD21      ASN 710  67.450  -0.200  -2.167
    6   HD22  ASN 710          HD22      ASN 710  68.967  -1.023  -2.275

  No H/Q in entry =           6
  In of MODEL   46
    1    H    SER 711           H        SER 711  64.518  -0.570  -7.102
    2    HA   SER 711           HA       SER 711  64.736  -1.305  -9.196
    3    HB2  SER 711           HB2      SER 711  66.976  -0.077  -9.125
    4    HB3  SER 711           HB3      SER 711  67.734  -1.595  -8.673
    5    HG   SER 711           HG       SER 711  66.559  -0.804 -11.090

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ARG 712           H        ARG 712  64.378  -3.060  -6.805
    2    HA   ARG 712           HA       ARG 712  64.794  -5.575  -8.219
    3    HB2  ARG 712           HB2      ARG 712  65.279  -6.737  -6.119
    4    HB3  ARG 712           HB3      ARG 712  66.514  -5.534  -6.481
    5    HG2  ARG 712           HG2      ARG 712  65.615  -4.086  -4.835
    6    HG3  ARG 712           HG3      ARG 712  64.239  -5.163  -4.540
    7    HD2  ARG 712           HD2      ARG 712  65.920  -6.934  -3.912
    8    HD3  ARG 712           HD3      ARG 712  67.176  -5.716  -4.060
    9    HE   ARG 712           HE       ARG 712  65.427  -4.663  -2.260
   10   HH11  ARG 712          HH11      ARG 712  67.331  -7.637  -2.496
   11   HH12  ARG 712          HH12      ARG 712  67.404  -7.908  -0.820
   12   HH21  ARG 712          HH21      ARG 712  65.506  -5.066   0.092
   13   HH22  ARG 712          HH22      ARG 712  66.331  -6.440   0.671

  No H/Q in entry =          13
  In of MODEL   46
    1    H    CYS 713           H        CYS 713  63.444  -7.345  -7.046
    2    HA   CYS 713           HA       CYS 713  60.749  -6.241  -6.873
    3    HB2  CYS 713           HB2      CYS 713  61.650  -9.111  -7.175
    4    HB3  CYS 713           HB3      CYS 713  60.015  -8.496  -7.380

  No H/Q in entry =           4
  In of MODEL   46
    1    H    VAL 714           H        VAL 714  59.945  -5.981  -4.924
    2    HA   VAL 714           HA       VAL 714  60.673  -7.871  -2.816
    3    HB   VAL 714           HB       VAL 714  60.320  -6.082  -1.139
    4   HG12  VAL 714          HG11      VAL 714  62.352  -4.747  -1.600
    5   HG11  VAL 714          HG12      VAL 714  62.366  -5.377  -3.248
    6   HG13  VAL 714          HG13      VAL 714  62.589  -6.470  -1.888
    7   HG21  VAL 714          HG21      VAL 714  58.760  -4.688  -2.412
    8   HG23  VAL 714          HG22      VAL 714  60.065  -4.233  -3.514
    9   HG22  VAL 714          HG23      VAL 714  60.124  -3.740  -1.819

  No H/Q in entry =           9
  In of MODEL   46
    1    H    CYS 715           H        CYS 715  58.743  -7.532  -1.030
    2    HA   CYS 715           HA       CYS 715  56.523  -8.605  -2.585
    3    HB2  CYS 715           HB2      CYS 715  56.793  -8.430   0.404
    4    HB3  CYS 715           HB3      CYS 715  55.785  -9.525  -0.531

  No H/Q in entry =           4
  In of MODEL   46
    1    H    LYS 716           H        LYS 716  54.359  -8.010  -2.244
    2    HA   LYS 716           HA       LYS 716  53.678  -5.277  -1.678
    3    HB2  LYS 716           HB2      LYS 716  52.473  -6.691  -3.310
    4    HB3  LYS 716           HB3      LYS 716  52.126  -7.853  -2.059
    5    HG2  LYS 716           HG2      LYS 716  50.111  -6.717  -2.563
    6    HG3  LYS 716           HG3      LYS 716  50.649  -6.131  -0.994
    7    HD2  LYS 716           HD2      LYS 716  51.372  -4.064  -1.932
    8    HD3  LYS 716           HD3      LYS 716  51.178  -4.680  -3.579
    9    HE2  LYS 716           HE2      LYS 716  48.765  -4.861  -3.254
   10    HE3  LYS 716           HE3      LYS 716  48.932  -4.321  -1.587
   11    HZ2  LYS 716           HZ1      LYS 716  48.198  -2.566  -3.157
   12    HZ1  LYS 716           HZ2      LYS 716  49.687  -2.646  -3.932
   13    HZ3  LYS 716           HZ3      LYS 716  49.599  -2.199  -2.305

  No H/Q in entry =          13
  In of MODEL   46
    1    H    MET 717           H        MET 717  52.149  -4.804   0.224
    2    HA   MET 717           HA       MET 717  52.984  -6.372   2.518
    3    HB2  MET 717           HB2      MET 717  51.355  -3.827   2.377
    4    HB3  MET 717           HB3      MET 717  51.766  -4.642   3.878
    5    HG2  MET 717           HG2      MET 717  53.683  -3.403   1.911
    6    HG3  MET 717           HG3      MET 717  53.251  -2.784   3.500
    7    HE3  MET 717           HE1      MET 717  54.047  -3.980   5.830
    8    HE2  MET 717           HE2      MET 717  54.920  -5.511   5.866
    9    HE1  MET 717           HE3      MET 717  53.256  -5.465   5.296

  No H/Q in entry =           9
  In of MODEL   46
    1    HA   PRO 718           HA       PRO 718  49.592  -9.141   2.296
    2    HB2  PRO 718           HB2      PRO 718  49.444  -9.862   4.962
    3    HB3  PRO 718           HB3      PRO 718  50.589 -10.530   3.792
    4    HG2  PRO 718           HG2      PRO 718  50.987  -8.338   5.791
    5    HG3  PRO 718           HG3      PRO 718  52.082  -9.665   5.360
    6    HD2  PRO 718           HD2      PRO 718  52.471  -7.201   4.435
    7    HD3  PRO 718           HD3      PRO 718  52.770  -8.614   3.402

  No H/Q in entry =           7
  In of MODEL   46
    1    H    TYR 719           H        TYR 719  49.407  -6.534   4.589
    2    HA   TYR 719           HA       TYR 719  46.553  -6.950   4.986
    3    HB2  TYR 719           HB2      TYR 719  46.677  -5.107   6.582
    4    HB3  TYR 719           HB3      TYR 719  47.930  -6.288   6.917
    5    HD1  TYR 719           HD1      TYR 719  50.322  -5.753   6.157
    6    HD2  TYR 719           HD2      TYR 719  47.197  -2.867   6.172
    7    HE1  TYR 719           HE1      TYR 719  51.986  -3.941   6.137
    8    HE2  TYR 719           HE2      TYR 719  48.845  -1.064   6.132
    9    HH   TYR 719           HH       TYR 719  52.172  -1.581   5.512

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLU 720           H        GLU 720  48.400  -5.573   2.660
    2    HA   GLU 720           HA       GLU 720  46.584  -3.334   2.122
    3    HB2  GLU 720           HB2      GLU 720  49.127  -3.050   2.288
    4    HB3  GLU 720           HB3      GLU 720  49.239  -4.004   0.825
    5    HG2  GLU 720           HG2      GLU 720  47.936  -2.299  -0.363
    6    HG3  GLU 720           HG3      GLU 720  47.867  -1.349   1.122

  No H/Q in entry =           6
  In of MODEL   46
    1    H    CYS 721           H        CYS 721  46.598  -6.398   1.703
    2    HA   CYS 721           HA       CYS 721  46.212  -6.639  -1.162
    3    HB2  CYS 721           HB2      CYS 721  46.022  -8.696   1.034
    4    HB3  CYS 721           HB3      CYS 721  46.021  -9.025  -0.697

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLY 722           H        GLY 722  44.310  -5.428  -1.410
    2    HA3  GLY 722           HA2      GLY 722  41.936  -6.244   0.075
    3    HA2  GLY 722           HA3      GLY 722  42.059  -4.897  -1.049

  No H/Q in entry =           3
  In of MODEL   46
    1    HA   PRO 723           HA       PRO 723  39.922  -7.109  -4.208
    2    HB2  PRO 723           HB2      PRO 723  41.561  -6.546  -6.398
    3    HB3  PRO 723           HB3      PRO 723  40.264  -5.509  -5.803
    4    HG2  PRO 723           HG2      PRO 723  43.202  -5.357  -5.281
    5    HG3  PRO 723           HG3      PRO 723  42.043  -4.041  -5.550
    6    HD2  PRO 723           HD2      PRO 723  42.927  -4.618  -3.101
    7    HD3  PRO 723           HD3      PRO 723  41.233  -4.153  -3.363

  No H/Q in entry =           7
  In of MODEL   46
    1    H    SER 724           H        SER 724  39.945  -9.256  -4.303
    2    HA   SER 724           HA       SER 724  41.812 -10.728  -5.735
    3    HB2  SER 724           HB2      SER 724  42.551 -12.136  -3.704
    4    HB3  SER 724           HB3      SER 724  43.400 -10.637  -4.080
    5    HG   SER 724           HG       SER 724  41.901  -9.661  -2.537

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU 725           H        LEU 725  41.241 -12.715  -6.165
    2    HA   LEU 725           HA       LEU 725  38.531 -13.514  -5.785
    3    HB2  LEU 725           HB2      LEU 725  40.219 -14.013  -7.742
    4    HB3  LEU 725           HB3      LEU 725  40.750 -15.275  -6.650
    5    HG   LEU 725           HG       LEU 725  38.425 -16.094  -6.587
    6   HD11  LEU 725          HD11      LEU 725  38.074 -14.291  -8.945
    7   HD13  LEU 725          HD12      LEU 725  37.232 -14.199  -7.398
    8   HD12  LEU 725          HD13      LEU 725  36.963 -15.572  -8.471
    9   HD22  LEU 725          HD21      LEU 725  38.610 -17.317  -8.704
   10   HD21  LEU 725          HD22      LEU 725  40.162 -17.233  -7.859
   11   HD23  LEU 725          HD23      LEU 725  39.834 -16.168  -9.233

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ASP 726           H        ASP 726  37.766 -14.753  -4.129
    2    HA   ASP 726           HA       ASP 726  39.518 -15.680  -2.075
    3    HB2  ASP 726           HB2      ASP 726  37.373 -16.588  -1.086
    4    HB3  ASP 726           HB3      ASP 726  37.471 -14.848  -1.301

  No H/Q in entry =           4
  In of MODEL   46
    1    H    VAL 727           H        VAL 727  40.196 -17.569  -1.625
    2    HA   VAL 727           HA       VAL 727  39.199 -19.858  -3.075
    3    HB   VAL 727           HB       VAL 727  41.558 -20.702  -3.472
    4   HG13  VAL 727          HG11      VAL 727  41.991 -19.350  -5.466
    5   HG12  VAL 727          HG12      VAL 727  40.862 -18.124  -4.886
    6   HG11  VAL 727          HG13      VAL 727  40.275 -19.729  -5.317
    7   HG23  VAL 727          HG21      VAL 727  42.315 -17.856  -2.800
    8   HG22  VAL 727          HG22      VAL 727  43.400 -19.089  -3.444
    9   HG21  VAL 727          HG23      VAL 727  42.697 -19.285  -1.839

  No H/Q in entry =           9
  In of MODEL   46
    1    H    CYS 728           H        CYS 728  40.134 -21.967  -2.069
    2    HA   CYS 728           HA       CYS 728  40.257 -21.600   0.834
    3    HB2  CYS 728           HB2      CYS 728  39.832 -24.217  -0.622
    4    HB3  CYS 728           HB3      CYS 728  39.435 -23.785   1.018

  No H/Q in entry =           4
  In of MODEL   46
    1    H    ALA 729           H        ALA 729  42.128 -21.966   1.870
    2    HA   ALA 729           HA       ALA 729  44.162 -23.471   0.423
    3    HB1  ALA 729           HB1      ALA 729  44.560 -20.925   1.944
    4    HB3  ALA 729           HB2      ALA 729  44.610 -21.104   0.187
    5    HB2  ALA 729           HB3      ALA 729  45.837 -21.881   1.189

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLN 730           H        GLN 730  45.906 -24.103   1.866
    2    HA   GLN 730           HA       GLN 730  44.874 -24.758   4.525
    3    HB2  GLN 730           HB2      GLN 730  45.066 -26.737   3.008
    4    HB3  GLN 730           HB3      GLN 730  46.774 -26.382   2.864
    5    HG2  GLN 730           HG2      GLN 730  47.173 -26.801   5.146
    6    HG3  GLN 730           HG3      GLN 730  45.465 -26.936   5.511
    7   HE21  GLN 730          HE21      GLN 730  45.551 -29.053   6.273
    8   HE22  GLN 730          HE22      GLN 730  45.943 -30.383   5.265

  No H/Q in entry =           8
  In of MODEL   46
    1    H    ASP 731           H        ASP 731  45.956 -24.060   6.070
    2    HA   ASP 731           HA       ASP 731  48.380 -22.554   5.813
    3    HB2  ASP 731           HB2      ASP 731  46.633 -21.909   7.409
    4    HB3  ASP 731           HB3      ASP 731  46.721 -23.488   8.146

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLU 732           H        GLU 732  50.380 -23.556   5.794
    2    HA   GLU 732           HA       GLU 732  50.523 -26.333   6.432
    3    HB2  GLU 732           HB2      GLU 732  52.493 -24.382   5.361
    4    HB3  GLU 732           HB3      GLU 732  53.004 -25.988   5.842
    5    HG2  GLU 732           HG2      GLU 732  50.940 -25.297   3.759
    6    HG3  GLU 732           HG3      GLU 732  52.567 -25.909   3.466

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ARG 733           H        ARG 733  50.491 -23.927   8.581
    2    HA   ARG 733           HA       ARG 733  52.654 -24.950  10.202
    3    HB2  ARG 733           HB2      ARG 733  50.773 -22.625  10.371
    4    HB3  ARG 733           HB3      ARG 733  51.661 -23.172  11.774
    5    HG2  ARG 733           HG2      ARG 733  52.960 -22.349   9.179
    6    HG3  ARG 733           HG3      ARG 733  52.693 -21.251  10.536
    7    HD2  ARG 733           HD2      ARG 733  54.040 -22.717  11.972
    8    HD3  ARG 733           HD3      ARG 733  54.324 -23.789  10.605
    9    HE   ARG 733           HE       ARG 733  55.321 -21.679   9.561
   10   HH11  ARG 733          HH11      ARG 733  55.495 -22.319  13.044
   11   HH12  ARG 733          HH12      ARG 733  57.040 -21.644  13.230
   12   HH21  ARG 733          HH21      ARG 733  57.429 -20.756   9.820
   13   HH22  ARG 733          HH22      ARG 733  58.190 -20.745  11.331

  No H/Q in entry =          13
  In of MODEL   46
    1    H    SER 734           H        SER 734  49.191 -24.335  10.432
    2    HA   SER 734           HA       SER 734  49.031 -26.309  12.581
    3    HB2  SER 734           HB2      SER 734  47.016 -24.275  11.647
    4    HB3  SER 734           HB3      SER 734  46.901 -25.269  13.101
    5    HG   SER 734           HG       SER 734  49.011 -24.298  13.624

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LYS 735           H        LYS 735  48.556 -26.164   9.257
    2    HA   LYS 735           HA       LYS 735  47.615 -27.452   7.705
    3    HB2  LYS 735           HB2      LYS 735  47.291 -29.434   9.957
    4    HB3  LYS 735           HB3      LYS 735  47.126 -29.803   8.246
    5    HG2  LYS 735           HG2      LYS 735  49.623 -28.773   9.568
    6    HG3  LYS 735           HG3      LYS 735  49.326 -30.457   9.148
    7    HD2  LYS 735           HD2      LYS 735  49.434 -28.159   7.188
    8    HD3  LYS 735           HD3      LYS 735  50.763 -29.255   7.516
    9    HE2  LYS 735           HE2      LYS 735  49.268 -31.146   6.798
   10    HE3  LYS 735           HE3      LYS 735  48.067 -29.947   6.332
   11    HZ3  LYS 735           HZ1      LYS 735  49.376 -30.671   4.451
   12    HZ2  LYS 735           HZ2      LYS 735  50.792 -30.202   5.239
   13    HZ1  LYS 735           HZ3      LYS 735  49.714 -29.028   4.740

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ARG 736           H        ARG 736  46.047 -25.634   9.113
    2    HA   ARG 736           HA       ARG 736  43.342 -26.723   9.216
    3    HB2  ARG 736           HB2      ARG 736  42.780 -24.380   9.970
    4    HB3  ARG 736           HB3      ARG 736  43.953 -25.186  11.009
    5    HG2  ARG 736           HG2      ARG 736  45.771 -23.993   9.927
    6    HG3  ARG 736           HG3      ARG 736  44.634 -23.223   8.835
    7    HD2  ARG 736           HD2      ARG 736  43.647 -22.006  10.691
    8    HD3  ARG 736           HD3      ARG 736  44.698 -22.859  11.833
    9    HE   ARG 736           HE       ARG 736  46.575 -21.851  10.452
   10   HH11  ARG 736          HH11      ARG 736  43.523 -20.114  11.027
   11   HH12  ARG 736          HH12      ARG 736  44.237 -18.584  10.800
   12   HH21  ARG 736          HH21      ARG 736  47.479 -19.730  10.084
   13   HH22  ARG 736          HH22      ARG 736  46.471 -18.361  10.267

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ILE 737           H        ILE 737  41.744 -26.078   7.698
    2    HA   ILE 737           HA       ILE 737  42.774 -24.921   5.235
    3    HB   ILE 737           HB       ILE 737  39.953 -25.854   5.813
    4   HG12  ILE 737          HG12      ILE 737  41.557 -27.716   6.210
    5   HG13  ILE 737          HG13      ILE 737  40.496 -28.019   4.843
    6   HG21  ILE 737          HG21      ILE 737  40.330 -24.393   3.849
    7   HG23  ILE 737          HG22      ILE 737  39.751 -25.993   3.416
    8   HG22  ILE 737          HG23      ILE 737  41.458 -25.588   3.203
    9   HD11  ILE 737          HD11      ILE 737  42.291 -27.372   3.343
   10   HD13  ILE 737          HD12      ILE 737  42.746 -28.738   4.369
   11   HD12  ILE 737          HD13      ILE 737  43.363 -27.119   4.720

  No H/Q in entry =          11
  In of MODEL   46
    1    H    LEU 738           H        LEU 738  42.464 -22.803   4.860
    2    HA   LEU 738           HA       LEU 738  40.272 -21.515   6.252
    3    HB2  LEU 738           HB2      LEU 738  41.524 -19.602   6.923
    4    HB3  LEU 738           HB3      LEU 738  42.345 -21.012   7.566
    5    HG   LEU 738           HG       LEU 738  43.211 -19.301   5.227
    6   HD13  LEU 738          HD11      LEU 738  43.503 -18.207   7.362
    7   HD12  LEU 738          HD12      LEU 738  45.067 -18.663   6.685
    8   HD11  LEU 738          HD13      LEU 738  44.359 -19.615   7.989
    9   HD23  LEU 738          HD21      LEU 738  45.267 -20.631   5.232
   10   HD22  LEU 738          HD22      LEU 738  43.815 -21.586   4.890
   11   HD21  LEU 738          HD23      LEU 738  44.559 -21.673   6.489

  No H/Q in entry =          11
  In of MODEL   46
    1    HA   PRO 739           HA       PRO 739  39.544 -19.658   2.347
    2    HB2  PRO 739           HB2      PRO 739  38.107 -17.507   3.127
    3    HB3  PRO 739           HB3      PRO 739  37.452 -19.154   3.208
    4    HG2  PRO 739           HG2      PRO 739  38.613 -17.471   5.390
    5    HG3  PRO 739           HG3      PRO 739  37.176 -18.513   5.424
    6    HD2  PRO 739           HD2      PRO 739  39.648 -19.303   6.390
    7    HD3  PRO 739           HD3      PRO 739  38.424 -20.423   5.741

  No H/Q in entry =           7
  In of MODEL   46
    1    H    LEU 740           H        LEU 740  41.142 -18.760   1.325
    2    HA   LEU 740           HA       LEU 740  42.262 -16.268   2.359
    3    HB2  LEU 740           HB2      LEU 740  43.637 -18.485   0.872
    4    HB3  LEU 740           HB3      LEU 740  44.304 -16.873   0.969
    5    HG   LEU 740           HG       LEU 740  43.849 -18.780   3.257
    6   HD12  LEU 740          HD11      LEU 740  46.287 -18.713   3.392
    7   HD11  LEU 740          HD12      LEU 740  46.321 -17.657   1.972
    8   HD13  LEU 740          HD13      LEU 740  45.719 -19.305   1.830
    9   HD23  LEU 740          HD21      LEU 740  44.979 -17.064   4.630
   10   HD22  LEU 740          HD22      LEU 740  43.426 -16.505   4.023
   11   HD21  LEU 740          HD23      LEU 740  44.920 -15.950   3.262

  No H/Q in entry =          11
  In of MODEL   46
    1    H    THR 741           H        THR 741  43.574 -15.398   0.259
    2    HA   THR 741           HA       THR 741  41.698 -15.400  -1.941
    3    HB   THR 741           HB       THR 741  42.716 -12.760  -1.521
    4    HG1  THR 741           HG1      THR 741  41.413 -14.004   0.673
    5   HG23  THR 741          HG21      THR 741  40.376 -12.198  -1.465
    6   HG22  THR 741          HG22      THR 741  39.955 -13.884  -1.127
    7   HG21  THR 741          HG23      THR 741  40.687 -13.443  -2.680

  No H/Q in entry =           7
  In of MODEL   46
    1    H    VAL 742           H        VAL 742  42.734 -14.910  -3.882
    2    HA   VAL 742           HA       VAL 742  45.266 -15.895  -4.216
    3    HB   VAL 742           HB       VAL 742  43.908 -15.871  -6.156
    4   HG13  VAL 742          HG11      VAL 742  43.100 -14.014  -7.229
    5   HG12  VAL 742          HG12      VAL 742  43.737 -12.937  -5.961
    6   HG11  VAL 742          HG13      VAL 742  42.473 -14.143  -5.586
    7   HG21  VAL 742          HG21      VAL 742  46.360 -15.373  -6.653
    8   HG23  VAL 742          HG22      VAL 742  45.871 -13.687  -6.764
    9   HG22  VAL 742          HG23      VAL 742  45.185 -14.869  -7.870

  No H/Q in entry =           9
  In of MODEL   46
    1    H    CYS 743           H        CYS 743  44.532 -12.434  -3.971
    2    HA   CYS 743           HA       CYS 743  47.163 -11.585  -4.351
    3    HB2  CYS 743           HB2      CYS 743  45.248 -10.030  -4.397
    4    HB3  CYS 743           HB3      CYS 743  45.021 -10.249  -2.661

  No H/Q in entry =           4
  In of MODEL   46
    1    H    LYS 744           H        LYS 744  45.331 -12.231  -1.342
    2    HA   LYS 744           HA       LYS 744  47.370 -11.606   0.462
    3    HB2  LYS 744           HB2      LYS 744  45.080 -13.539   0.810
    4    HB3  LYS 744           HB3      LYS 744  46.100 -12.941   2.107
    5    HG2  LYS 744           HG2      LYS 744  45.310 -10.641   1.613
    6    HG3  LYS 744           HG3      LYS 744  44.232 -11.304   0.382
    7    HD2  LYS 744           HD2      LYS 744  43.153 -12.685   2.133
    8    HD3  LYS 744           HD3      LYS 744  44.166 -11.912   3.345
    9    HE2  LYS 744           HE2      LYS 744  42.131 -10.545   1.567
   10    HE3  LYS 744           HE3      LYS 744  41.932 -10.911   3.276
   11    HZ1  LYS 744           HZ1      LYS 744  43.890  -9.391   3.673
   12    HZ3  LYS 744           HZ2      LYS 744  42.500  -8.670   3.105
   13    HZ2  LYS 744           HZ3      LYS 744  43.757  -8.906   2.048

  No H/Q in entry =          13
  In of MODEL   46
    1    H    MET 745           H        MET 745  46.359 -14.819  -0.676
    2    HA   MET 745           HA       MET 745  48.231 -16.450   0.558
    3    HB2  MET 745           HB2      MET 745  46.719 -17.686  -0.487
    4    HB3  MET 745           HB3      MET 745  46.521 -16.605  -1.860
    5    HG2  MET 745           HG2      MET 745  47.416 -18.564  -2.804
    6    HG3  MET 745           HG3      MET 745  48.801 -17.522  -2.619
    7    HE1  MET 745           HE1      MET 745  46.983 -20.699  -1.493
    8    HE3  MET 745           HE2      MET 745  46.878 -19.794   0.022
    9    HE2  MET 745           HE3      MET 745  47.887 -21.235  -0.084

  No H/Q in entry =           9
  In of MODEL   46
    1    H    HIS 746           H        HIS 746  48.549 -14.691  -2.536
    2    HA   HIS 746           HA       HIS 746  51.088 -15.857  -3.153
    3    HB2  HIS 746           HB2      HIS 746  49.501 -13.642  -4.282
    4    HB3  HIS 746           HB3      HIS 746  51.226 -13.656  -4.655
    5    HD1  HIS 746           HD1      HIS 746  51.779 -16.438  -5.509
    6    HD2  HIS 746           HD2      HIS 746  48.185 -14.548  -6.328
    7    HE1  HIS 746           HE1      HIS 746  50.884 -17.572  -7.544
    8    HE2  HIS 746           HE2      HIS 746  48.639 -16.485  -7.953

  No H/Q in entry =           8
  In of MODEL   46
    1    H    VAL 747           H        VAL 747  50.130 -12.719  -1.827
    2    HA   VAL 747           HA       VAL 747  52.709 -11.678  -1.555
    3    HB   VAL 747           HB       VAL 747  50.135 -11.108  -0.064
    4   HG13  VAL 747          HG11      VAL 747  51.192  -9.046   0.763
    5   HG12  VAL 747          HG12      VAL 747  52.715  -9.520   0.032
    6   HG11  VAL 747          HG13      VAL 747  52.045 -10.456   1.368
    7   HG23  VAL 747          HG21      VAL 747  50.184  -9.078  -1.481
    8   HG22  VAL 747          HG22      VAL 747  50.080 -10.591  -2.389
    9   HG21  VAL 747          HG23      VAL 747  51.620  -9.746  -2.271

  No H/Q in entry =           9
  In of MODEL   46
    1    H    LEU 748           H        LEU 748  50.641 -13.381   0.668
    2    HA   LEU 748           HA       LEU 748  52.311 -13.608   2.847
    3    HB2  LEU 748           HB2      LEU 748  50.103 -14.108   3.242
    4    HB3  LEU 748           HB3      LEU 748  49.921 -14.980   1.752
    5    HG   LEU 748           HG       LEU 748  51.392 -16.232   4.067
    6   HD12  LEU 748          HD11      LEU 748  48.409 -16.195   3.537
    7   HD11  LEU 748          HD12      LEU 748  49.206 -15.378   4.884
    8   HD13  LEU 748          HD13      LEU 748  49.229 -17.139   4.782
    9   HD22  LEU 748          HD21      LEU 748  50.568 -18.273   3.010
   10   HD21  LEU 748          HD22      LEU 748  51.438 -17.310   1.823
   11   HD23  LEU 748          HD23      LEU 748  49.676 -17.328   1.821

  No H/Q in entry =          11
  In of MODEL   46
    1    H    HIS 749           H        HIS 749  52.060 -15.685   0.006
    2    HA   HIS 749           HA       HIS 749  53.913 -17.637   0.868
    3    HB2  HIS 749           HB2      HIS 749  52.226 -17.805  -1.052
    4    HB3  HIS 749           HB3      HIS 749  53.387 -16.887  -2.004
    5    HD1  HIS 749           HD1      HIS 749  55.686 -18.132  -2.570
    6    HD2  HIS 749           HD2      HIS 749  52.760 -20.397  -0.727
    7    HE1  HIS 749           HE1      HIS 749  56.443 -20.498  -2.821
    8    HE2  HIS 749           HE2      HIS 749  54.515 -21.851  -1.963

  No H/Q in entry =           8
  In of MODEL   46
    1    H    CYS 750           H        CYS 750  54.202 -14.603  -0.841
    2    HA   CYS 750           HA       CYS 750  56.949 -15.007  -1.548
    3    HB2  CYS 750           HB2      CYS 750  55.313 -13.660  -2.887
    4    HB3  CYS 750           HB3      CYS 750  55.336 -12.434  -1.635

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLN 751           H        GLN 751  55.173 -13.621   1.083
    2    HA   GLN 751           HA       GLN 751  57.262 -12.287   2.395
    3    HB2  GLN 751           HB2      GLN 751  54.876 -13.756   3.532
    4    HB3  GLN 751           HB3      GLN 751  55.945 -12.745   4.486
    5    HG2  GLN 751           HG2      GLN 751  54.306 -11.814   2.147
    6    HG3  GLN 751           HG3      GLN 751  53.834 -11.625   3.827
    7   HE21  GLN 751          HE21      GLN 751  54.282  -9.546   1.829
    8   HE22  GLN 751          HE22      GLN 751  55.555  -8.572   2.447

  No H/Q in entry =           8
  In of MODEL   46
    1    H    GLY 752           H        GLY 752  56.385 -15.626   2.149
    2    HA3  GLY 752           HA2      GLY 752  58.348 -17.178   2.319
    3    HA2  GLY 752           HA3      GLY 752  58.685 -16.377   3.849

  No H/Q in entry =           3
  In of MODEL   46
    1    H    ARG 753           H        ARG 753  55.419 -17.067   2.872
    2    HA   ARG 753           HA       ARG 753  55.196 -18.958   5.102
    3    HB2  ARG 753           HB2      ARG 753  53.127 -17.359   3.598
    4    HB3  ARG 753           HB3      ARG 753  52.782 -18.469   4.909
    5    HG2  ARG 753           HG2      ARG 753  54.603 -16.110   5.265
    6    HG3  ARG 753           HG3      ARG 753  52.860 -15.978   5.470
    7    HD2  ARG 753           HD2      ARG 753  54.631 -17.908   6.957
    8    HD3  ARG 753           HD3      ARG 753  54.046 -16.367   7.592
    9    HE   ARG 753           HE       ARG 753  51.837 -17.758   6.725
   10   HH11  ARG 753          HH11      ARG 753  54.327 -18.217   9.188
   11   HH12  ARG 753          HH12      ARG 753  53.340 -19.026  10.280
   12   HH21  ARG 753          HH21      ARG 753  50.434 -18.902   8.179
   13   HH22  ARG 753          HH22      ARG 753  51.028 -19.429   9.673

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ASN 754           H        ASN 754  54.644 -21.066   4.682
    2    HA   ASN 754           HA       ASN 754  54.299 -21.818   1.882
    3    HB2  ASN 754           HB2      ASN 754  54.686 -23.574   4.328
    4    HB3  ASN 754           HB3      ASN 754  54.608 -24.137   2.669
    5   HD21  ASN 754          HD21      ASN 754  56.677 -24.490   4.606
    6   HD22  ASN 754          HD22      ASN 754  58.114 -23.802   3.938

  No H/Q in entry =           6
  In of MODEL   46
    1    H    TYR 755           H        TYR 755  52.309 -22.068   1.144
    2    HA   TYR 755           HA       TYR 755  50.315 -23.212   2.915
    3    HB2  TYR 755           HB2      TYR 755  49.884 -20.670   1.311
    4    HB3  TYR 755           HB3      TYR 755  48.603 -21.773   1.764
    5    HD1  TYR 755           HD1      TYR 755  47.307 -20.846   3.405
    6    HD2  TYR 755           HD2      TYR 755  51.501 -20.392   3.686
    7    HE1  TYR 755           HE1      TYR 755  47.043 -19.742   5.564
    8    HE2  TYR 755           HE2      TYR 755  51.252 -19.307   5.852
    9    HH   TYR 755           HH       TYR 755  48.509 -19.516   7.631

  No H/Q in entry =           9
  In of MODEL   46
    1    H    THR 756           H        THR 756  48.890 -24.479   1.970
    2    HA   THR 756           HA       THR 756  49.508 -25.291  -0.772
    3    HB   THR 756           HB       THR 756  48.057 -26.750   1.459
    4    HG1  THR 756           HG1      THR 756  49.935 -27.112   2.272
    5   HG22  THR 756          HG21      THR 756  49.314 -27.760  -1.091
    6   HG21  THR 756          HG22      THR 756  47.583 -27.542  -0.792
    7   HG23  THR 756          HG23      THR 756  48.490 -28.742   0.133

  No H/Q in entry =           7
  In of MODEL   46
    1    H    LEU 757           H        LEU 757  47.521 -25.739  -2.098
    2    HA   LEU 757           HA       LEU 757  45.213 -24.380  -0.985
    3    HB2  LEU 757           HB2      LEU 757  45.869 -24.940  -3.859
    4    HB3  LEU 757           HB3      LEU 757  44.297 -24.387  -3.323
    5    HG   LEU 757           HG       LEU 757  45.709 -22.477  -2.226
    6   HD12  LEU 757          HD11      LEU 757  47.487 -23.288  -4.499
    7   HD11  LEU 757          HD12      LEU 757  47.876 -23.340  -2.783
    8   HD13  LEU 757          HD13      LEU 757  47.605 -21.789  -3.573
    9   HD22  LEU 757          HD21      LEU 757  45.272 -21.127  -4.166
   10   HD21  LEU 757          HD22      LEU 757  43.946 -22.241  -3.798
   11   HD23  LEU 757          HD23      LEU 757  45.037 -22.588  -5.149

  No H/Q in entry =          11
  In of MODEL   46
    1    H    THR 758           H        THR 758  43.139 -25.285  -1.319
    2    HA   THR 758           HA       THR 758  43.244 -28.183  -1.545
    3    HB   THR 758           HB       THR 758  41.699 -28.235   0.525
    4    HG1  THR 758           HG1      THR 758  42.825 -26.156   1.732
    5   HG22  THR 758          HG21      THR 758  44.610 -27.453   0.880
    6   HG21  THR 758          HG22      THR 758  44.035 -29.076   0.518
    7   HG23  THR 758          HG23      THR 758  43.630 -28.325   2.058

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLY 759           H        GLY 759  40.598 -28.749  -0.873
    2    HA3  GLY 759           HA2      GLY 759  39.344 -27.966  -3.318
    3    HA2  GLY 759           HA3      GLY 759  38.704 -29.055  -2.100

  No H/Q in entry =           3
  In of MODEL   46
    1    H    ARG 760           H        ARG 760  37.157 -27.254  -3.413
    2    HA   ARG 760           HA       ARG 760  36.809 -24.723  -2.361
    3    HB2  ARG 760           HB2      ARG 760  35.700 -25.124  -4.366
    4    HB3  ARG 760           HB3      ARG 760  34.991 -26.620  -3.784
    5    HG2  ARG 760           HG2      ARG 760  33.294 -24.893  -4.073
    6    HG3  ARG 760           HG3      ARG 760  33.445 -25.365  -2.382
    7    HD2  ARG 760           HD2      ARG 760  34.914 -23.408  -2.067
    8    HD3  ARG 760           HD3      ARG 760  34.459 -22.832  -3.690
    9    HE   ARG 760           HE       ARG 760  32.623 -23.328  -1.452
   10   HH11  ARG 760          HH11      ARG 760  33.379 -21.436  -4.350
   11   HH12  ARG 760          HH12      ARG 760  32.263 -20.193  -3.995
   12   HH21  ARG 760          HH21      ARG 760  31.120 -21.605  -0.960
   13   HH22  ARG 760          HH22      ARG 760  31.002 -20.279  -2.043

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ASP 761           H        ASP 761  35.445 -27.763  -1.071
    2    HA   ASP 761           HA       ASP 761  34.198 -25.932   0.787
    3    HB2  ASP 761           HB2      ASP 761  32.733 -27.517  -0.683
    4    HB3  ASP 761           HB3      ASP 761  33.132 -28.718   0.544

  No H/Q in entry =           4
  In of MODEL   46
    1    H    SER 762           H        SER 762  36.879 -27.106   0.856
    2    HA   SER 762           HA       SER 762  36.919 -28.827   3.152
    3    HB2  SER 762           HB2      SER 762  39.134 -27.155   1.921
    4    HB3  SER 762           HB3      SER 762  39.369 -28.459   3.090
    5    HG   SER 762           HG       SER 762  37.862 -29.041   0.867

  No H/Q in entry =           5
  In of MODEL   46
    1    H    CYS 763           H        CYS 763  36.607 -25.505   2.544
    2    HA   CYS 763           HA       CYS 763  36.260 -25.032   5.362
    3    HB2  CYS 763           HB2      CYS 763  37.395 -22.870   5.267
    4    HB3  CYS 763           HB3      CYS 763  38.524 -24.146   4.786

  No H/Q in entry =           4
  In of MODEL   46
    1    H    THR 764           H        THR 764  35.138 -22.748   5.467
    2    HA   THR 764           HA       THR 764  33.046 -22.815   3.463
    3    HB   THR 764           HB       THR 764  33.266 -21.076   5.920
    4    HG1  THR 764           HG1      THR 764  33.240 -23.129   6.689
    5   HG22  THR 764          HG21      THR 764  30.804 -20.990   5.693
    6   HG21  THR 764          HG22      THR 764  30.934 -21.935   4.200
    7   HG23  THR 764          HG23      THR 764  31.637 -20.323   4.286

  No H/Q in entry =           7
  In of MODEL   46
    1    H    LEU 765           H        LEU 765  33.418 -21.744   1.694
    2    HA   LEU 765           HA       LEU 765  35.062 -19.368   1.764
    3    HB2  LEU 765           HB2      LEU 765  34.992 -21.385  -0.011
    4    HB3  LEU 765           HB3      LEU 765  33.720 -20.367  -0.667
    5    HG   LEU 765           HG       LEU 765  35.285 -18.527  -0.963
    6   HD11  LEU 765          HD11      LEU 765  37.283 -20.485   0.131
    7   HD13  LEU 765          HD12      LEU 765  36.776 -18.989   0.901
    8   HD12  LEU 765          HD13      LEU 765  37.701 -18.941  -0.606
    9   HD23  LEU 765          HD21      LEU 765  36.641 -19.518  -2.740
   10   HD22  LEU 765          HD22      LEU 765  34.989 -20.136  -2.784
   11   HD21  LEU 765          HD23      LEU 765  36.285 -21.131  -2.117

  No H/Q in entry =          11
  In of MODEL   46
    1    HA   PRO 766           HA       PRO 766  31.721 -16.615   2.400
    2    HB2  PRO 766           HB2      PRO 766  32.509 -14.647   0.523
    3    HB3  PRO 766           HB3      PRO 766  32.874 -14.690   2.244
    4    HG2  PRO 766           HG2      PRO 766  34.547 -15.481  -0.060
    5    HG3  PRO 766           HG3      PRO 766  35.036 -14.912   1.542
    6    HD2  PRO 766           HD2      PRO 766  35.271 -17.480   0.749
    7    HD3  PRO 766           HD3      PRO 766  34.982 -17.065   2.438

  No H/Q in entry =           7
  In of MODEL   46
    1    H    ALA 767           H        ALA 767  32.438 -16.300  -1.086
    2    HA   ALA 767           HA       ALA 767  29.664 -15.949  -1.689
    3    HB1  ALA 767           HB1      ALA 767  31.958 -16.484  -3.575
    4    HB3  ALA 767           HB2      ALA 767  31.461 -14.886  -3.021
    5    HB2  ALA 767           HB3      ALA 767  30.366 -15.861  -4.010

  No H/Q in entry =           5
  In of MODEL   46
    1    H    SER 768           H        SER 768  28.402 -17.483  -1.260
    2    HA   SER 768           HA       SER 768  29.049 -20.131  -2.294
    3    HB2  SER 768           HB2      SER 768  27.147 -19.338  -0.082
    4    HB3  SER 768           HB3      SER 768  27.493 -20.979  -0.629
    5    HG   SER 768           HG       SER 768  29.464 -19.190   0.387

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA 769           H        ALA 769  26.097 -18.223  -1.583
    2    HA   ALA 769           HA       ALA 769  24.963 -19.311  -4.059
    3    HB3  ALA 769           HB1      ALA 769  23.691 -19.963  -2.076
    4    HB1  ALA 769           HB2      ALA 769  22.781 -18.853  -3.121
    5    HB2  ALA 769           HB3      ALA 769  23.532 -18.257  -1.640

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLU 770           H        GLU 770  23.676 -16.589  -2.395
    2    HA   GLU 770           HA       GLU 770  24.068 -15.216  -4.865
    3    HB2  GLU 770           HB2      GLU 770  22.194 -14.952  -2.642
    4    HB3  GLU 770           HB3      GLU 770  22.442 -13.546  -3.694
    5    HG2  GLU 770           HG2      GLU 770  21.510 -16.311  -4.447
    6    HG3  GLU 770           HG3      GLU 770  20.558 -14.824  -4.470

  No H/Q in entry =           6
  In of MODEL   46
    1    H    LYS 771           H        LYS 771  24.107 -12.656  -4.411
    2    HA   LYS 771           HA       LYS 771  26.817 -12.450  -3.333
    3    HB2  LYS 771           HB2      LYS 771  25.564 -10.443  -5.169
    4    HB3  LYS 771           HB3      LYS 771  27.254 -10.908  -5.010
    5    HG2  LYS 771           HG2      LYS 771  25.092 -12.614  -6.240
    6    HG3  LYS 771           HG3      LYS 771  26.227 -11.624  -7.147
    7    HD2  LYS 771           HD2      LYS 771  27.884 -13.159  -6.929
    8    HD3  LYS 771           HD3      LYS 771  27.457 -13.514  -5.251
    9    HE2  LYS 771           HE2      LYS 771  27.127 -15.429  -6.859
   10    HE3  LYS 771           HE3      LYS 771  25.717 -15.019  -5.913
   11    HZ1  LYS 771           HZ1      LYS 771  24.905 -13.736  -7.892
   12    HZ3  LYS 771           HZ2      LYS 771  25.036 -15.372  -8.144
   13    HZ2  LYS 771           HZ3      LYS 771  26.180 -14.364  -8.802

  No H/Q in entry =          13
  In of MODEL   46
    1    H    ALA 772           H        ALA 772  27.130 -11.131  -1.661
    2    HA   ALA 772           HA       ALA 772  24.779  -9.786  -0.564
    3    HB1  ALA 772           HB1      ALA 772  27.399 -10.417   0.776
    4    HB2  ALA 772           HB2      ALA 772  25.936 -11.403   0.857
    5    HB3  ALA 772           HB3      ALA 772  25.947  -9.784   1.556

  No H/Q in entry =           5
  In of MODEL   46
    1    H    CYS 773           H        CYS 773  24.905  -7.740   0.379
    2    HA   CYS 773           HA       CYS 773  26.068  -5.641  -0.986
    3    HB2  CYS 773           HB2      CYS 773  24.203  -5.403   0.616
    4    HB3  CYS 773           HB3      CYS 773  25.310  -5.735   1.942

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLY 774           H        GLY 774  27.955  -4.572  -0.879
    2    HA3  GLY 774           HA2      GLY 774  30.076  -3.967  -0.267
    3    HA2  GLY 774           HA3      GLY 774  29.738  -4.636   1.321

  No H/Q in entry =           3
  In of MODEL   46
    1    H    ALA 775           H        ALA 775  29.581  -6.522  -1.683
    2    HA   ALA 775           HA       ALA 775  32.085  -7.736  -1.052
    3    HB3  ALA 775           HB1      ALA 775  30.437  -9.092   0.157
    4    HB2  ALA 775           HB2      ALA 775  31.059  -9.969  -1.242
    5    HB1  ALA 775           HB3      ALA 775  29.460  -9.228  -1.306

  No H/Q in entry =           5
  In of MODEL   46
    1    H    CYS 776           H        CYS 776  32.795  -8.859  -2.814
    2    HA   CYS 776           HA       CYS 776  33.311  -9.194  -5.021
    3    HB2  CYS 776           HB2      CYS 776  30.316  -8.958  -5.366
    4    HB3  CYS 776           HB3      CYS 776  31.432  -9.642  -6.541

  No H/Q in entry =           4
  In of MODEL   46
    1    HA   PRO 777           HA       PRO 777  32.314  -4.520  -5.890
    2    HB2  PRO 777           HB2      PRO 777  34.687  -3.343  -5.330
    3    HB3  PRO 777           HB3      PRO 777  33.439  -3.593  -4.104
    4    HG2  PRO 777           HG2      PRO 777  35.889  -5.225  -4.670
    5    HG3  PRO 777           HG3      PRO 777  35.245  -4.689  -3.107
    6    HD2  PRO 777           HD2      PRO 777  34.854  -7.188  -4.064
    7    HD3  PRO 777           HD3      PRO 777  33.647  -6.363  -3.059

  No H/Q in entry =           7
  In of MODEL   46
    1    H    LEU 778           H        LEU 778  34.721  -6.701  -6.785
    2    HA   LEU 778           HA       LEU 778  35.502  -5.062  -9.029
    3    HB2  LEU 778           HB2      LEU 778  37.301  -6.680  -9.509
    4    HB3  LEU 778           HB3      LEU 778  37.431  -5.873  -7.968
    5    HG   LEU 778           HG       LEU 778  36.418  -8.707  -8.239
    6   HD11  LEU 778          HD11      LEU 778  39.232  -7.701  -7.824
    7   HD13  LEU 778          HD12      LEU 778  38.619  -8.536  -9.255
    8   HD12  LEU 778          HD13      LEU 778  38.715  -9.384  -7.712
    9   HD23  LEU 778          HD21      LEU 778  37.182  -8.869  -5.909
   10   HD22  LEU 778          HD22      LEU 778  35.962  -7.610  -6.079
   11   HD21  LEU 778          HD23      LEU 778  37.668  -7.175  -5.944

  No H/Q in entry =          11
  In of MODEL   46
    1    H    TRP 779           H        TRP 779  34.525  -8.506  -8.690
    2    HA   TRP 779           HA       TRP 779  33.920  -8.494 -11.510
    3    HB2  TRP 779           HB2      TRP 779  33.230 -10.903 -11.109
    4    HB3  TRP 779           HB3      TRP 779  34.915 -10.519 -10.812
    5    HD1  TRP 779           HD1      TRP 779  31.644 -11.174  -8.874
    6    HE1  TRP 779           HE1      TRP 779  32.272 -12.155  -6.575
    7    HE3  TRP 779           HE3      TRP 779  36.737 -10.812  -9.165
    8    HZ2  TRP 779           HZ2      TRP 779  34.609 -12.709  -5.089
    9    HZ3  TRP 779           HZ3      TRP 779  38.070 -11.580  -7.260
   10    HH2  TRP 779           HH2      TRP 779  37.008 -12.499  -5.266

  No H/Q in entry =          10
  In of MODEL   46
    1    H    GLY 780           H        GLY 780  32.285  -7.624  -8.817
    2    HA3  GLY 780           HA2      GLY 780  29.769  -7.762 -10.270
    3    HA2  GLY 780           HA3      GLY 780  29.866  -8.080  -8.531

  No H/Q in entry =           3
  In of MODEL   46
    1    H    LYS 781           H        LYS 781  28.413  -6.211  -8.364
    2    HA   LYS 781           HA       LYS 781  30.000  -3.909  -7.754
    3    HB2  LYS 781           HB2      LYS 781  29.202  -3.839 -10.287
    4    HB3  LYS 781           HB3      LYS 781  27.680  -3.348  -9.565
    5    HG2  LYS 781           HG2      LYS 781  28.851  -1.357 -10.174
    6    HG3  LYS 781           HG3      LYS 781  28.931  -1.487  -8.416
    7    HD2  LYS 781           HD2      LYS 781  31.197  -2.403  -8.555
    8    HD3  LYS 781           HD3      LYS 781  31.115  -2.369 -10.314
    9    HE2  LYS 781           HE2      LYS 781  30.879   0.095 -10.211
   10    HE3  LYS 781           HE3      LYS 781  31.054   0.012  -8.462
   11    HZ3  LYS 781           HZ1      LYS 781  33.129   0.575  -9.470
   12    HZ2  LYS 781           HZ2      LYS 781  33.132  -0.751 -10.479
   13    HZ1  LYS 781           HZ3      LYS 781  33.289  -0.949  -8.794

  No H/Q in entry =          13
  In of MODEL   46
    1    H    CYS 782           H        CYS 782  29.052  -2.801  -6.134
    2    HA   CYS 782           HA       CYS 782  26.374  -3.663  -5.307
    3    HB2  CYS 782           HB2      CYS 782  28.262  -4.299  -3.776
    4    HB3  CYS 782           HB3      CYS 782  28.648  -2.590  -3.613

  No H/Q in entry =           4
  In of MODEL   46
    1    H    ASP 783           H        ASP 783  24.875  -2.040  -5.052
    2    HA   ASP 783           HA       ASP 783  25.736   0.568  -6.061
    3    HB2  ASP 783           HB2      ASP 783  23.948  -0.464  -7.344
    4    HB3  ASP 783           HB3      ASP 783  22.994  -0.667  -5.882

  No H/Q in entry =           4
  In of MODEL   46
    1    H    ALA 784           H        ALA 784  22.959  -0.096  -4.022
    2    HA   ALA 784           HA       ALA 784  23.489   0.924  -1.572
    3    HB3  ALA 784           HB1      ALA 784  22.652   3.183  -3.437
    4    HB2  ALA 784           HB2      ALA 784  24.218   3.056  -2.638
    5    HB1  ALA 784           HB3      ALA 784  22.763   3.295  -1.677

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLU 785           H        GLU 785  21.334   1.551  -4.301
    2    HA   GLU 785           HA       GLU 785  18.977   0.992  -2.728
    3    HB2  GLU 785           HB2      GLU 785  19.368   1.554  -5.670
    4    HB3  GLU 785           HB3      GLU 785  17.795   1.323  -4.909
    5    HG2  GLU 785           HG2      GLU 785  19.767   3.488  -4.207
    6    HG3  GLU 785           HG3      GLU 785  18.334   3.693  -5.218

  No H/Q in entry =           6
  In of MODEL   46
    1    H    SER 786           H        SER 786  20.741  -0.369  -5.458
    2    HA   SER 786           HA       SER 786  19.572  -2.942  -4.994
    3    HB2  SER 786           HB2      SER 786  22.158  -2.315  -6.494
    4    HB3  SER 786           HB3      SER 786  21.129  -3.732  -6.670
    5    HG   SER 786           HG       SER 786  19.477  -1.948  -7.196

  No H/Q in entry =           5
  In of MODEL   46
    1    H    SER 787           H        SER 787  19.905  -3.467  -2.924
    2    HA   SER 787           HA       SER 787  22.364  -2.928  -1.551
    3    HB2  SER 787           HB2      SER 787  20.102  -2.698  -0.489
    4    HB3  SER 787           HB3      SER 787  19.901  -4.439  -0.632
    5    HG   SER 787           HG       SER 787  21.593  -4.734   0.750

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LYS 788           H        LYS 788  20.990  -5.427  -3.363
    2    HA   LYS 788           HA       LYS 788  22.778  -7.467  -2.357
    3    HB2  LYS 788           HB2      LYS 788  21.897  -8.838  -4.185
    4    HB3  LYS 788           HB3      LYS 788  20.567  -8.094  -3.310
    5    HG2  LYS 788           HG2      LYS 788  20.302  -6.427  -5.065
    6    HG3  LYS 788           HG3      LYS 788  21.709  -7.066  -5.905
    7    HD2  LYS 788           HD2      LYS 788  20.518  -9.210  -6.204
    8    HD3  LYS 788           HD3      LYS 788  19.097  -8.507  -5.430
    9    HE2  LYS 788           HE2      LYS 788  18.905  -6.836  -7.159
   10    HE3  LYS 788           HE3      LYS 788  20.410  -7.371  -7.897
   11    HZ1  LYS 788           HZ1      LYS 788  19.338  -9.472  -8.453
   12    HZ3  LYS 788           HZ2      LYS 788  18.497  -8.183  -9.106
   13    HZ2  LYS 788           HZ3      LYS 788  17.888  -8.962  -7.760

  No H/Q in entry =          13
  In of MODEL   46
    1    H    CYS 789           H        CYS 789  24.410  -8.377  -3.891
    2    HA   CYS 789           HA       CYS 789  25.518  -6.216  -5.519
    3    HB2  CYS 789           HB2      CYS 789  27.086  -7.213  -3.928
    4    HB3  CYS 789           HB3      CYS 789  26.767  -8.816  -4.563

  No H/Q in entry =           4
  In of MODEL   46
    1    H    VAL 790           H        VAL 790  25.765  -6.414  -7.688
    2    HA   VAL 790           HA       VAL 790  24.379  -8.702  -8.881
    3    HB   VAL 790           HB       VAL 790  24.040  -7.305 -10.888
    4   HG13  VAL 790          HG11      VAL 790  22.314  -7.275  -9.188
    5   HG12  VAL 790          HG12      VAL 790  22.439  -5.691  -9.952
    6   HG11  VAL 790          HG13      VAL 790  23.127  -5.954  -8.351
    7   HG21  VAL 790          HG21      VAL 790  25.377  -5.103  -9.302
    8   HG23  VAL 790          HG22      VAL 790  24.567  -4.894 -10.854
    9   HG22  VAL 790          HG23      VAL 790  26.024  -5.880 -10.747

  No H/Q in entry =           9
  In of MODEL   46
    1    H    CYS 791           H        CYS 791  25.288  -9.549 -10.892
    2    HA   CYS 791           HA       CYS 791  28.203  -9.601 -10.662
    3    HB2  CYS 791           HB2      CYS 791  26.382 -11.472 -12.193
    4    HB3  CYS 791           HB3      CYS 791  28.089 -11.706 -11.820

  No H/Q in entry =           4
  In of MODEL   46
    1    H    ARG 792           H        ARG 792  29.504  -8.899 -12.311
    2    HA   ARG 792           HA       ARG 792  28.095  -7.716 -14.575
    3    HB2  ARG 792           HB2      ARG 792  30.730  -6.992 -13.303
    4    HB3  ARG 792           HB3      ARG 792  30.118  -6.257 -14.776
    5    HG2  ARG 792           HG2      ARG 792  28.122  -5.504 -13.487
    6    HG3  ARG 792           HG3      ARG 792  28.896  -6.116 -12.028
    7    HD2  ARG 792           HD2      ARG 792  30.057  -4.039 -13.868
    8    HD3  ARG 792           HD3      ARG 792  29.209  -3.682 -12.372
    9    HE   ARG 792           HE       ARG 792  31.128  -5.304 -11.520
   10   HH11  ARG 792          HH11      ARG 792  31.454  -2.633 -13.879
   11   HH12  ARG 792          HH12      ARG 792  32.884  -2.054 -13.161
   12   HH21  ARG 792          HH21      ARG 792  33.128  -4.545 -10.678
   13   HH22  ARG 792          HH22      ARG 792  33.909  -3.194 -11.383

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLU 793           H        GLU 793  29.741  -7.464 -16.487
    2    HA   GLU 793           HA       GLU 793  30.682 -10.150 -17.094
    3    HB2  GLU 793           HB2      GLU 793  30.676  -7.677 -18.810
    4    HB3  GLU 793           HB3      GLU 793  31.157  -9.281 -19.325
    5    HG2  GLU 793           HG2      GLU 793  28.838 -10.040 -18.830
    6    HG3  GLU 793           HG3      GLU 793  28.412  -8.342 -18.574

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ALA 794           H        ALA 794  32.820 -10.432 -18.073
    2    HA   ALA 794           HA       ALA 794  34.765  -9.655 -16.241
    3    HB3  ALA 794           HB1      ALA 794  36.295 -10.834 -17.688
    4    HB1  ALA 794           HB2      ALA 794  35.110 -10.805 -18.991
    5    HB2  ALA 794           HB3      ALA 794  34.787 -11.737 -17.530

  No H/Q in entry =           5
  In of MODEL   46
    1    H    SER 795           H        SER 795  33.955  -8.491 -19.461
    2    HA   SER 795           HA       SER 795  36.218  -6.767 -19.377
    3    HB2  SER 795           HB2      SER 795  35.635  -7.911 -21.494
    4    HB3  SER 795           HB3      SER 795  34.131  -7.007 -21.558
    5    HG   SER 795           HG       SER 795  35.681  -5.112 -21.373

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLU 796           H        GLU 796  33.383  -6.563 -17.918
    2    HA   GLU 796           HA       GLU 796  33.130  -3.686 -18.392
    3    HB2  GLU 796           HB2      GLU 796  31.083  -5.251 -18.609
    4    HB3  GLU 796           HB3      GLU 796  31.156  -5.399 -16.863
    5    HG2  GLU 796           HG2      GLU 796  31.084  -2.652 -17.965
    6    HG3  GLU 796           HG3      GLU 796  29.627  -3.616 -18.148

  No H/Q in entry =           6
  In of MODEL   46
    1    H    CYS 797           H        CYS 797  33.742  -6.173 -16.017
    2    HA   CYS 797           HA       CYS 797  34.075  -4.635 -13.730
    3    HB2  CYS 797           HB2      CYS 797  35.749  -6.976 -14.663
    4    HB3  CYS 797           HB3      CYS 797  35.610  -6.400 -13.007

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLU 798           H        GLU 798  35.650  -3.176 -13.106
    2    HA   GLU 798           HA       GLU 798  37.531  -2.431 -15.208
    3    HB2  GLU 798           HB2      GLU 798  37.393  -0.191 -14.366
    4    HB3  GLU 798           HB3      GLU 798  35.783  -0.804 -14.680
    5    HG2  GLU 798           HG2      GLU 798  37.075  -0.546 -11.954
    6    HG3  GLU 798           HG3      GLU 798  35.915   0.556 -12.687

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU 799           H        GLU 799  37.675  -4.182 -12.564
    2    HA   GLU 799           HA       GLU 799  39.876  -2.791 -11.272
    3    HB2  GLU 799           HB2      GLU 799  38.055  -3.798  -9.917
    4    HB3  GLU 799           HB3      GLU 799  38.534  -5.383 -10.511
    5    HG2  GLU 799           HG2      GLU 799  39.373  -4.940  -8.250
    6    HG3  GLU 799           HG3      GLU 799  40.685  -5.173  -9.409

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLU 800           H        GLU 800  41.901  -3.774 -10.884
    2    HA   GLU 800           HA       GLU 800  42.651  -5.688 -12.943
    3    HB2  GLU 800           HB2      GLU 800  44.979  -4.813 -12.657
    4    HB3  GLU 800           HB3      GLU 800  43.853  -3.681 -13.406
    5    HG2  GLU 800           HG2      GLU 800  43.700  -2.427 -11.355
    6    HG3  GLU 800           HG3      GLU 800  44.643  -3.640 -10.492

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLY 801           H        GLY 801  41.862  -7.234 -11.474
    2    HA3  GLY 801           HA2      GLY 801  43.360  -7.775  -9.100
    3    HA2  GLY 801           HA3      GLY 801  42.141  -8.841  -9.807

  No H/Q in entry =           3
  In of MODEL   46
    1    H    PHE 802           H        PHE 802  43.795 -10.494  -9.186
    2    HA   PHE 802           HA       PHE 802  46.232 -10.498 -10.695
    3    HB2  PHE 802           HB2      PHE 802  45.026 -12.443  -8.744
    4    HB3  PHE 802           HB3      PHE 802  46.523 -12.784  -9.610
    5    HD1  PHE 802           HD1      PHE 802  48.536 -12.136  -8.659
    6    HD2  PHE 802           HD2      PHE 802  44.968 -10.125  -7.515
    7    HE1  PHE 802           HE1      PHE 802  49.770 -10.841  -7.048
    8    HE2  PHE 802           HE2      PHE 802  46.221  -8.819  -5.913
    9    HZ   PHE 802           HZ       PHE 802  48.637  -9.175  -5.648

  No H/Q in entry =           9
  In of MODEL   46
    1    H    SER 803           H        SER 803  46.753 -12.884 -11.610
    2    HA   SER 803           HA       SER 803  44.570 -13.565 -13.432
    3    HB2  SER 803           HB2      SER 803  47.544 -13.975 -13.879
    4    HB3  SER 803           HB3      SER 803  46.211 -14.161 -15.034
    5    HG   SER 803           HG       SER 803  46.051 -11.761 -13.999

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ILE 804           H        ILE 804  43.845 -15.630 -13.243
    2    HA   ILE 804           HA       ILE 804  45.473 -17.462 -11.651
    3    HB   ILE 804           HB       ILE 804  43.615 -18.280 -10.370
    4   HG12  ILE 804          HG12      ILE 804  41.810 -17.971 -12.102
    5   HG13  ILE 804          HG13      ILE 804  41.334 -17.482 -10.487
    6   HG21  ILE 804          HG21      ILE 804  44.737 -16.362  -9.433
    7   HG23  ILE 804          HG22      ILE 804  43.020 -16.305  -9.017
    8   HG22  ILE 804          HG23      ILE 804  43.654 -15.280 -10.307
    9   HD13  ILE 804          HD11      ILE 804  40.492 -15.928 -12.120
   10   HD12  ILE 804          HD12      ILE 804  42.097 -15.682 -12.775
   11   HD11  ILE 804          HD13      ILE 804  41.722 -15.127 -11.140

  No H/Q in entry =          11
  In of MODEL   46
    1    H    CYS 805           H        CYS 805  44.827 -19.692 -11.841
    2    HA   CYS 805           HA       CYS 805  44.074 -20.368 -14.605
    3    HB2  CYS 805           HB2      CYS 805  46.267 -21.156 -13.887
    4    HB3  CYS 805           HB3      CYS 805  45.576 -21.877 -12.441

  No H/Q in entry =           4
  In of MODEL   46
    1    H    VAL 806           H        VAL 806  42.208 -21.109 -14.935
    2    HA   VAL 806           HA       VAL 806  40.964 -22.576 -12.766
    3    HB   VAL 806           HB       VAL 806  40.058 -20.336 -12.689
    4   HG13  VAL 806          HG11      VAL 806  40.531 -19.580 -14.858
    5   HG12  VAL 806          HG12      VAL 806  38.799 -19.381 -14.544
    6   HG11  VAL 806          HG13      VAL 806  39.377 -20.716 -15.547
    7   HG22  VAL 806          HG21      VAL 806  38.474 -22.111 -12.197
    8   HG21  VAL 806          HG22      VAL 806  38.060 -22.225 -13.901
    9   HG23  VAL 806          HG23      VAL 806  37.669 -20.759 -12.994

  No H/Q in entry =           9
  In of MODEL   46
    1    H    GLU 807           H        GLU 807  40.017 -24.391 -13.306
    2    HA   GLU 807           HA       GLU 807  40.381 -25.383 -15.972
    3    HB2  GLU 807           HB2      GLU 807  40.941 -26.762 -14.045
    4    HB3  GLU 807           HB3      GLU 807  39.295 -26.636 -13.454
    5    HG2  GLU 807           HG2      GLU 807  38.548 -27.785 -15.536
    6    HG3  GLU 807           HG3      GLU 807  40.246 -28.025 -15.931

  No H/Q in entry =           6
  In of MODEL   46
    1    H    VAL 808           H        VAL 808  38.957 -24.842 -17.346
    2    HA   VAL 808           HA       VAL 808  36.100 -25.020 -16.751
    3    HB   VAL 808           HB       VAL 808  37.457 -22.867 -18.329
    4   HG11  VAL 808          HG11      VAL 808  35.329 -23.406 -19.207
    5   HG13  VAL 808          HG12      VAL 808  35.366 -21.785 -18.503
    6   HG12  VAL 808          HG13      VAL 808  34.563 -23.117 -17.632
    7   HG21  VAL 808          HG21      VAL 808  36.258 -22.723 -15.619
    8   HG23  VAL 808          HG22      VAL 808  36.684 -21.320 -16.592
    9   HG22  VAL 808          HG23      VAL 808  37.937 -22.451 -16.081

  No H/Q in entry =           9
  In of MODEL   46
    1    H    ASN 809           H        ASN 809  35.076 -26.104 -18.344
    2    HA   ASN 809           HA       ASN 809  34.691 -27.338 -20.181
    3    HB2  ASN 809           HB2      ASN 809  36.863 -25.615 -21.410
    4    HB3  ASN 809           HB3      ASN 809  35.963 -26.810 -22.317
    5   HD21  ASN 809          HD21      ASN 809  36.008 -23.659 -21.023
    6   HD22  ASN 809          HD22      ASN 809  34.454 -23.165 -21.587

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLY 810           H        GLY 810  36.901 -27.808 -18.169
    2    HA3  GLY 810           HA2      GLY 810  38.056 -29.837 -17.766
    3    HA2  GLY 810           HA3      GLY 810  38.055 -30.117 -19.510

  No H/Q in entry =           3
  In of MODEL   46
    1    H    LYS 811           H        LYS 811  38.866 -27.195 -19.717
    2    HA   LYS 811           HA       LYS 811  41.703 -27.831 -19.777
    3    HB2  LYS 811           HB2      LYS 811  40.124 -25.589 -20.988
    4    HB3  LYS 811           HB3      LYS 811  41.847 -25.853 -21.186
    5    HG2  LYS 811           HG2      LYS 811  41.446 -27.908 -22.358
    6    HG3  LYS 811           HG3      LYS 811  39.714 -27.785 -22.039
    7    HD2  LYS 811           HD2      LYS 811  40.221 -27.070 -24.291
    8    HD3  LYS 811           HD3      LYS 811  39.605 -25.737 -23.322
    9    HE2  LYS 811           HE2      LYS 811  41.879 -24.904 -22.970
   10    HE3  LYS 811           HE3      LYS 811  42.535 -26.244 -23.906
   11    HZ2  LYS 811           HZ1      LYS 811  40.723 -24.119 -24.888
   12    HZ1  LYS 811           HZ2      LYS 811  41.296 -25.392 -25.816
   13    HZ3  LYS 811           HZ3      LYS 811  42.383 -24.226 -25.201

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLU 812           H        GLU 812  43.196 -26.471 -18.886
    2    HA   GLU 812           HA       GLU 812  42.263 -24.688 -16.755
    3    HB2  GLU 812           HB2      GLU 812  45.056 -25.436 -17.656
    4    HB3  GLU 812           HB3      GLU 812  44.669 -24.465 -16.249
    5    HG2  GLU 812           HG2      GLU 812  43.637 -26.395 -15.190
    6    HG3  GLU 812           HG3      GLU 812  43.972 -27.369 -16.625

  No H/Q in entry =           6
  In of MODEL   46
    1    H    GLN 813           H        GLN 813  41.704 -22.721 -17.388
    2    HA   GLN 813           HA       GLN 813  43.464 -21.461 -19.346
    3    HB2  GLN 813           HB2      GLN 813  41.342 -21.897 -20.339
    4    HB3  GLN 813           HB3      GLN 813  40.487 -21.137 -18.997
    5    HG2  GLN 813           HG2      GLN 813  41.360 -19.043 -19.577
    6    HG3  GLN 813           HG3      GLN 813  42.374 -19.712 -20.861
    7   HE21  GLN 813          HE21      GLN 813  39.220 -18.729 -19.979
    8   HE22  GLN 813          HE22      GLN 813  38.432 -18.992 -21.483

  No H/Q in entry =           8
  In of MODEL   46
    1    H    THR 814           H        THR 814  44.195 -19.455 -18.894
    2    HA   THR 814           HA       THR 814  43.994 -18.574 -16.156
    3    HB   THR 814           HB       THR 814  45.294 -17.112 -18.449
    4    HG1  THR 814           HG1      THR 814  46.678 -18.617 -18.498
    5   HG23  THR 814          HG21      THR 814  45.077 -15.820 -16.397
    6   HG22  THR 814          HG22      THR 814  46.776 -16.243 -16.674
    7   HG21  THR 814          HG23      THR 814  45.831 -17.133 -15.487

  No H/Q in entry =           7
  In of MODEL   46
    1    H    MET 815           H        MET 815  42.666 -17.090 -15.477
    2    HA   MET 815           HA       MET 815  41.438 -15.311 -17.456
    3    HB2  MET 815           HB2      MET 815  40.078 -16.391 -14.989
    4    HB3  MET 815           HB3      MET 815  39.362 -15.338 -16.203
    5    HG2  MET 815           HG2      MET 815  39.819 -17.247 -17.849
    6    HG3  MET 815           HG3      MET 815  40.151 -18.174 -16.396
    7    HE2  MET 815           HE1      MET 815  36.849 -19.653 -17.546
    8    HE1  MET 815           HE2      MET 815  38.585 -19.902 -17.200
    9    HE3  MET 815           HE3      MET 815  38.088 -18.963 -18.591

  No H/Q in entry =           9
  In of MODEL   46
    1    H    SER 816           H        SER 816  40.923 -13.301 -16.596
    2    HA   SER 816           HA       SER 816  42.674 -12.362 -14.564
    3    HB2  SER 816           HB2      SER 816  40.199 -11.033 -15.711
    4    HB3  SER 816           HB3      SER 816  41.584 -10.246 -14.952
    5    HG   SER 816           HG       SER 816  42.815 -11.336 -16.695

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLU 817           H        GLU 817  42.004 -11.641 -12.526
    2    HA   GLU 817           HA       GLU 817  40.558 -13.375 -10.997
    3    HB2  GLU 817           HB2      GLU 817  42.240 -11.546 -10.487
    4    HB3  GLU 817           HB3      GLU 817  40.849 -10.480 -10.424
    5    HG2  GLU 817           HG2      GLU 817  39.908 -11.890  -8.620
    6    HG3  GLU 817           HG3      GLU 817  41.351 -12.880  -8.761

  No H/Q in entry =           6
  In of MODEL   46
    1    H    CYS 818           H        CYS 818  39.497 -10.245 -12.306
    2    HA   CYS 818           HA       CYS 818  36.889 -10.358 -11.234
    3    HB2  CYS 818           HB2      CYS 818  37.846  -8.864 -13.677
    4    HB3  CYS 818           HB3      CYS 818  36.327  -8.591 -12.829

  No H/Q in entry =           4
  In of MODEL   46
    1    H    GLU 819           H        GLU 819  38.320 -11.727 -14.089
    2    HA   GLU 819           HA       GLU 819  35.884 -12.170 -15.485
    3    HB2  GLU 819           HB2      GLU 819  37.994 -11.977 -16.684
    4    HB3  GLU 819           HB3      GLU 819  38.641 -13.361 -15.835
    5    HG2  GLU 819           HG2      GLU 819  37.194 -14.850 -16.992
    6    HG3  GLU 819           HG3      GLU 819  36.240 -13.520 -17.641

  No H/Q in entry =           6
  In of MODEL   46
    1    H    ALA 820           H        ALA 820  38.162 -14.383 -13.887
    2    HA   ALA 820           HA       ALA 820  36.565 -16.643 -14.034
    3    HB2  ALA 820           HB1      ALA 820  37.926 -17.585 -12.240
    4    HB3  ALA 820           HB2      ALA 820  38.526 -15.977 -11.856
    5    HB1  ALA 820           HB3      ALA 820  38.925 -16.721 -13.409

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLY 821           H        GLY 821  36.724 -14.054 -11.659
    2    HA3  GLY 821           HA2      GLY 821  35.050 -15.134  -9.671
    3    HA2  GLY 821           HA3      GLY 821  35.394 -13.428  -9.919

  No H/Q in entry =           3
  In of MODEL   46
    1    H    ALA 822           H        ALA 822  34.350 -13.077 -12.481
    2    HA   ALA 822           HA       ALA 822  31.624 -12.801 -11.848
    3    HB3  ALA 822           HB1      ALA 822  31.346 -11.919 -14.054
    4    HB1  ALA 822           HB2      ALA 822  32.943 -12.525 -14.542
    5    HB2  ALA 822           HB3      ALA 822  32.806 -11.250 -13.323

  No H/Q in entry =           5
  In of MODEL   46
    1    H    LEU 823           H        LEU 823  33.416 -15.083 -13.873
    2    HA   LEU 823           HA       LEU 823  31.133 -16.426 -14.775
    3    HB2  LEU 823           HB2      LEU 823  33.967 -17.391 -14.506
    4    HB3  LEU 823           HB3      LEU 823  32.701 -18.506 -14.951
    5    HG   LEU 823           HG       LEU 823  33.682 -17.933 -16.975
    6   HD13  LEU 823          HD11      LEU 823  32.074 -16.732 -18.272
    7   HD12  LEU 823          HD12      LEU 823  31.393 -16.026 -16.820
    8   HD11  LEU 823          HD13      LEU 823  31.253 -17.761 -17.091
    9   HD23  LEU 823          HD21      LEU 823  34.181 -15.665 -17.744
   10   HD22  LEU 823          HD22      LEU 823  35.066 -16.082 -16.276
   11   HD21  LEU 823          HD23      LEU 823  33.651 -15.033 -16.188

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ARG 824           H        ARG 824  33.040 -16.947 -11.838
    2    HA   ARG 824           HA       ARG 824  31.609 -19.115 -10.741
    3    HB2  ARG 824           HB2      ARG 824  32.904 -16.741  -9.395
    4    HB3  ARG 824           HB3      ARG 824  32.189 -18.082  -8.515
    5    HG2  ARG 824           HG2      ARG 824  33.841 -19.587  -9.350
    6    HG3  ARG 824           HG3      ARG 824  34.477 -18.352 -10.448
    7    HD2  ARG 824           HD2      ARG 824  35.823 -18.680  -8.370
    8    HD3  ARG 824           HD3      ARG 824  35.253 -17.034  -8.606
    9    HE   ARG 824           HE       ARG 824  33.349 -18.270  -7.050
   10   HH11  ARG 824          HH11      ARG 824  36.824 -17.701  -6.662
   11   HH12  ARG 824          HH12      ARG 824  36.729 -17.464  -4.980
   12   HH21  ARG 824          HH21      ARG 824  33.242 -17.884  -4.753
   13   HH22  ARG 824          HH22      ARG 824  34.665 -17.460  -3.885

  No H/Q in entry =          13
  In of MODEL   46
    1    H    CYS 825           H        CYS 825  31.139 -15.671 -10.409
    2    HA   CYS 825           HA       CYS 825  28.895 -15.819  -8.782
    3    HB2  CYS 825           HB2      CYS 825  30.247 -13.704 -10.315
    4    HB3  CYS 825           HB3      CYS 825  28.687 -13.328  -9.622

  No H/Q in entry =           4
  In of MODEL   46
    1    H    ARG 826           H        ARG 826  29.055 -16.105 -12.237
    2    HA   ARG 826           HA       ARG 826  26.214 -15.524 -12.337
    3    HB2  ARG 826           HB2      ARG 826  26.394 -15.838 -14.748
    4    HB3  ARG 826           HB3      ARG 826  27.444 -14.545 -14.145
    5    HG2  ARG 826           HG2      ARG 826  29.326 -15.946 -14.425
    6    HG3  ARG 826           HG3      ARG 826  28.313 -17.338 -14.835
    7    HD2  ARG 826           HD2      ARG 826  28.538 -14.766 -16.403
    8    HD3  ARG 826           HD3      ARG 826  29.221 -16.327 -16.869
    9    HE   ARG 826           HE       ARG 826  26.664 -16.948 -16.547
   10   HH11  ARG 826          HH11      ARG 826  28.174 -14.344 -18.400
   11   HH12  ARG 826          HH12      ARG 826  26.885 -14.202 -19.496
   12   HH21  ARG 826          HH21      ARG 826  24.906 -16.735 -18.010
   13   HH22  ARG 826          HH22      ARG 826  24.968 -15.589 -19.273

  No H/Q in entry =          13
  In of MODEL   46
    1    H    GLY 827           H        GLY 827  27.988 -18.156 -11.614
    2    HA3  GLY 827           HA2      GLY 827  27.071 -20.272 -11.216
    3    HA2  GLY 827           HA3      GLY 827  25.720 -19.838 -12.256

  No H/Q in entry =           3
  In of MODEL   46
    1    H    GLN 828           H        GLN 828  28.662 -19.140 -13.695
    2    HA   GLN 828           HA       GLN 828  28.392 -21.191 -15.667
    3    HB2  GLN 828           HB2      GLN 828  29.475 -18.971 -16.082
    4    HB3  GLN 828           HB3      GLN 828  30.787 -19.445 -15.026
    5    HG2  GLN 828           HG2      GLN 828  31.538 -19.709 -17.287
    6    HG3  GLN 828           HG3      GLN 828  31.301 -21.302 -16.596
    7   HE21  GLN 828          HE21      GLN 828  28.584 -19.332 -17.681
    8   HE22  GLN 828          HE22      GLN 828  28.215 -20.321 -19.035

  No H/Q in entry =           8
  In of MODEL   46
    1    H    SER 829           H        SER 829  29.870 -23.035 -15.995
    2    HA   SER 829           HA       SER 829  30.723 -24.101 -13.448
    3    HB2  SER 829           HB2      SER 829  30.744 -25.461 -16.153
    4    HB3  SER 829           HB3      SER 829  30.762 -26.216 -14.556
    5    HG   SER 829           HG       SER 829  28.683 -25.045 -15.970

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ILE 830           H        ILE 830  32.680 -23.529 -12.837
    2    HA   ILE 830           HA       ILE 830  35.041 -23.787 -14.585
    3    HB   ILE 830           HB       ILE 830  35.958 -21.685 -13.887
    4   HG12  ILE 830          HG12      ILE 830  35.060 -21.625 -11.547
    5   HG13  ILE 830          HG13      ILE 830  35.007 -20.072 -12.359
    6   HG21  ILE 830          HG21      ILE 830  33.145 -21.119 -14.763
    7   HG23  ILE 830          HG22      ILE 830  34.550 -21.409 -15.789
    8   HG22  ILE 830          HG23      ILE 830  34.477 -19.960 -14.788
    9   HD12  ILE 830          HD11      ILE 830  33.041 -20.457 -11.016
   10   HD11  ILE 830          HD12      ILE 830  32.670 -21.923 -11.932
   11   HD13  ILE 830          HD13      ILE 830  32.626 -20.343 -12.723

  No H/Q in entry =          11
  In of MODEL   46
    1    H    SER 831           H        SER 831  36.884 -24.294 -13.255
    2    HA   SER 831           HA       SER 831  36.319 -24.646 -10.426
    3    HB2  SER 831           HB2      SER 831  37.569 -26.536 -12.368
    4    HB3  SER 831           HB3      SER 831  37.663 -26.718 -10.621
    5    HG   SER 831           HG       SER 831  35.145 -26.242 -11.286

  No H/Q in entry =           5
  In of MODEL   46
    1    H    VAL 832           H        VAL 832  37.695 -23.189  -9.493
    2    HA   VAL 832           HA       VAL 832  40.099 -22.424 -10.835
    3    HB   VAL 832           HB       VAL 832  38.929 -20.740  -9.479
    4   HG13  VAL 832          HG11      VAL 832  38.003 -22.074  -7.713
    5   HG12  VAL 832          HG12      VAL 832  38.967 -20.769  -7.023
    6   HG11  VAL 832          HG13      VAL 832  39.613 -22.409  -7.078
    7   HG23  VAL 832          HG21      VAL 832  40.836 -19.817  -8.225
    8   HG22  VAL 832          HG22      VAL 832  41.304 -20.404  -9.819
    9   HG21  VAL 832          HG23      VAL 832  41.670 -21.363  -8.386

  No H/Q in entry =           9
  In of MODEL   46
    1    H    THR 833           H        THR 833  41.929 -23.473 -10.879
    2    HA   THR 833           HA       THR 833  42.245 -25.723  -9.090
    3    HB   THR 833           HB       THR 833  44.168 -26.245 -10.589
    4    HG1  THR 833           HG1      THR 833  44.270 -24.948 -12.553
    5   HG23  THR 833          HG21      THR 833  41.952 -27.169 -11.069
    6   HG22  THR 833          HG22      THR 833  42.798 -26.785 -12.572
    7   HG21  THR 833          HG23      THR 833  41.534 -25.714 -11.972

  No H/Q in entry =           7
  In of MODEL   46
    1    H    SER 834           H        SER 834  43.564 -22.576  -9.790
    2    HA   SER 834           HA       SER 834  45.125 -22.606  -7.430
    3    HB2  SER 834           HB2      SER 834  47.251 -22.295  -8.699
    4    HB3  SER 834           HB3      SER 834  46.582 -23.927  -8.734
    5    HG   SER 834           HG       SER 834  45.577 -23.323 -10.738

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ILE 835           H        ILE 835  46.277 -20.628  -7.229
    2    HA   ILE 835           HA       ILE 835  44.827 -18.347  -8.358
    3    HB   ILE 835           HB       ILE 835  45.673 -17.075  -6.577
    4   HG12  ILE 835          HG12      ILE 835  48.025 -17.837  -6.444
    5   HG13  ILE 835          HG13      ILE 835  47.274 -17.804  -4.866
    6   HG21  ILE 835          HG21      ILE 835  44.829 -19.737  -5.589
    7   HG23  ILE 835          HG22      ILE 835  43.828 -18.328  -5.959
    8   HG22  ILE 835          HG23      ILE 835  44.943 -18.289  -4.588
    9   HD13  ILE 835          HD11      ILE 835  48.659 -19.716  -5.023
   10   HD12  ILE 835          HD12      ILE 835  47.933 -20.181  -6.554
   11   HD11  ILE 835          HD13      ILE 835  46.975 -20.263  -5.061

  No H/Q in entry =          11
  In of MODEL   46
    1    H    ARG 836           H        ARG 836  47.131 -20.014  -9.600
    2    HA   ARG 836           HA       ARG 836  48.886 -17.761 -10.270
    3    HB2  ARG 836           HB2      ARG 836  50.614 -19.507 -10.869
    4    HB3  ARG 836           HB3      ARG 836  50.210 -19.480  -9.166
    5    HG2  ARG 836           HG2      ARG 836  50.390 -21.768  -9.730
    6    HG3  ARG 836           HG3      ARG 836  48.664 -21.432  -9.660
    7    HD2  ARG 836           HD2      ARG 836  48.686 -21.151 -12.122
    8    HD3  ARG 836           HD3      ARG 836  50.362 -21.684 -12.142
    9    HE   ARG 836           HE       ARG 836  48.739 -23.573 -10.807
   10   HH11  ARG 836          HH11      ARG 836  49.588 -22.497 -14.058
   11   HH12  ARG 836          HH12      ARG 836  48.941 -23.872 -14.842
   12   HH21  ARG 836          HH21      ARG 836  47.764 -25.434 -11.887
   13   HH22  ARG 836          HH22      ARG 836  47.804 -25.551 -13.570

  No H/Q in entry =          13
  In of MODEL   46
    1    HA   PRO 837           HA       PRO 837  47.258 -18.137 -14.380
    2    HB2  PRO 837           HB2      PRO 837  49.372 -17.333 -15.902
    3    HB3  PRO 837           HB3      PRO 837  48.409 -16.206 -14.943
    4    HG2  PRO 837           HG2      PRO 837  51.049 -17.454 -14.297
    5    HG3  PRO 837           HG3      PRO 837  50.521 -15.775 -14.072
    6    HD2  PRO 837           HD2      PRO 837  50.587 -17.560 -12.046
    7    HD3  PRO 837           HD3      PRO 837  49.374 -16.266 -12.137

  No H/Q in entry =           7
  In of MODEL   46
    1    H    CYS 838           H        CYS 838  47.363 -19.515 -16.308
    2    HA   CYS 838           HA       CYS 838  49.296 -21.644 -15.937
    3    HB2  CYS 838           HB2      CYS 838  47.746 -23.053 -17.314
    4    HB3  CYS 838           HB3      CYS 838  47.079 -22.569 -15.770

  No H/Q in entry =           4
  In of MODEL   46
    1    H    ALA 839           H        ALA 839  49.990 -22.745 -17.936
    2    HA   ALA 839           HA       ALA 839  50.622 -20.891 -20.061
    3    HB2  ALA 839           HB1      ALA 839  51.999 -22.761 -20.897
    4    HB3  ALA 839           HB2      ALA 839  51.332 -23.807 -19.640
    5    HB1  ALA 839           HB3      ALA 839  52.343 -22.430 -19.198

  No H/Q in entry =           5
  In of MODEL   46
    1    H    ALA 840           H        ALA 840  47.983 -21.207 -19.858
    2    HA   ALA 840           HA       ALA 840  46.765 -23.218 -21.400
    3    HB3  ALA 840           HB1      ALA 840  44.812 -21.789 -21.364
    4    HB2  ALA 840           HB2      ALA 840  45.818 -20.407 -20.920
    5    HB1  ALA 840           HB3      ALA 840  45.631 -21.747 -19.792

  No H/Q in entry =           5
  In of MODEL   46
    1    H    GLU 841           H        GLU 841  48.467 -20.416 -22.180
    2    HA   GLU 841           HA       GLU 841  47.530 -20.202 -24.890
    3    HB2  GLU 841           HB2      GLU 841  49.676 -18.738 -23.369
    4    HB3  GLU 841           HB3      GLU 841  49.086 -18.327 -24.984
    5    HG2  GLU 841           HG2      GLU 841  47.008 -17.679 -24.202
    6    HG3  GLU 841           HG3      GLU 841  47.238 -18.537 -22.678

  No H/Q in entry =           6
  In of MODEL   46
    1    H    THR 842           H        THR 842  48.198 -22.457 -25.098
    2    HA   THR 842           HA       THR 842  50.794 -22.578 -26.403
    3    HB   THR 842           HB       THR 842  49.590 -24.797 -24.767
    4    HG1  THR 842           HG1      THR 842  50.365 -23.568 -23.144
    5   HG22  THR 842          HG21      THR 842  52.383 -24.515 -25.913
    6   HG21  THR 842          HG22      THR 842  51.101 -25.518 -26.580
    7   HG23  THR 842          HG23      THR 842  51.782 -25.899 -24.999

  No H/Q in entry =           7
  In of MODEL   46
    1    H    GLN 843           H        GLN 843  49.460 -22.129 -28.107
    2    HA   GLN 843           HA       GLN 843  47.755 -24.306 -29.072
    3    HB2  GLN 843           HB2      GLN 843  46.986 -21.378 -28.984
    4    HB3  GLN 843           HB3      GLN 843  46.070 -22.627 -29.817
    5    HG2  GLN 843           HG2      GLN 843  45.533 -23.707 -27.770
    6    HG3  GLN 843           HG3      GLN 843  46.651 -22.688 -26.870
    7   HE21  GLN 843          HE21      GLN 843  43.564 -22.871 -28.415
    8   HE22  GLN 843          HE22      GLN 843  42.927 -21.418 -27.727

  No H/Q in entry =           8
  In of MODEL   47
    1    H1   GLY 689           H2       GLY 689  47.062  -2.163 -16.481
    2    H2   GLY 689           H1       GLY 689  47.066  -0.531 -16.083
    3    H3   GLY 689           H3       GLY 689  46.075  -1.594 -15.222
    4    HA2  GLY 689           HA2      GLY 689  44.789  -0.333 -16.780
    5    HA3  GLY 689           HA3      GLY 689  44.793  -2.044 -17.195

  No H/Q in entry =           5
  In of MODEL   47
    1    H    SER 690           H        SER 690  44.483   0.440 -18.812
    2    HA   SER 690           HA       SER 690  46.372  -0.320 -20.890
    3    HB2  SER 690           HB2      SER 690  43.926   1.457 -21.014
    4    HB3  SER 690           HB3      SER 690  44.848   0.834 -22.390
    5    HG   SER 690           HG       SER 690  44.177  -1.175 -20.774

  No H/Q in entry =           5
  In of MODEL   47
    1    H    HIS 691           H        HIS 691  48.036   0.930 -21.393
    2    HA   HIS 691           HA       HIS 691  48.344   3.501 -20.060
    3    HB2  HIS 691           HB2      HIS 691  50.290   1.656 -21.434
    4    HB3  HIS 691           HB3      HIS 691  50.738   3.290 -20.993
    5    HD1  HIS 691           HD1      HIS 691  51.622   3.587 -18.635
    6    HD2  HIS 691           HD2      HIS 691  49.514   0.023 -19.070
    7    HE1  HIS 691           HE1      HIS 691  51.906   2.372 -16.492
    8    HE2  HIS 691           HE2      HIS 691  50.748   0.178 -16.801

  No H/Q in entry =           8
  In of MODEL   47
    1    H    MET 692           H        MET 692  49.855   5.038 -21.571
    2    HA   MET 692           HA       MET 692  48.031   6.136 -23.421
    3    HB2  MET 692           HB2      MET 692  50.991   6.663 -23.139
    4    HB3  MET 692           HB3      MET 692  49.860   7.650 -24.047
    5    HG2  MET 692           HG2      MET 692  48.675   8.214 -22.023
    6    HG3  MET 692           HG3      MET 692  49.745   7.174 -21.085
    7    HE3  MET 692           HE1      MET 692  49.235  10.183 -20.315
    8    HE2  MET 692           HE2      MET 692  50.878  10.700 -19.929
    9    HE1  MET 692           HE3      MET 692  50.320   9.100 -19.445

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ASN 693           H        ASN 693  50.967   4.262 -23.891
    2    HA   ASN 693           HA       ASN 693  50.104   3.024 -26.242
    3    HB2  ASN 693           HB2      ASN 693  51.764   3.961 -27.821
    4    HB3  ASN 693           HB3      ASN 693  50.703   5.244 -27.263
    5   HD21  ASN 693          HD21      ASN 693  51.557   6.901 -26.047
    6   HD22  ASN 693          HD22      ASN 693  53.251   7.131 -25.838

  No H/Q in entry =           6
  In of MODEL   47
    1    HA   PRO 694           HA       PRO 694  53.445   0.433 -24.723
    2    HB2  PRO 694           HB2      PRO 694  54.373   0.062 -27.519
    3    HB3  PRO 694           HB3      PRO 694  53.871  -1.160 -26.346
    4    HG2  PRO 694           HG2      PRO 694  52.309  -0.544 -28.418
    5    HG3  PRO 694           HG3      PRO 694  51.619  -0.885 -26.823
    6    HD2  PRO 694           HD2      PRO 694  52.082   1.745 -28.169
    7    HD3  PRO 694           HD3      PRO 694  50.688   1.197 -27.210

  No H/Q in entry =           7
  In of MODEL   47
    1    H    LEU 695           H        LEU 695  54.912   1.737 -23.750
    2    HA   LEU 695           HA       LEU 695  56.860   3.137 -25.449
    3    HB2  LEU 695           HB2      LEU 695  54.914   4.511 -24.359
    4    HB3  LEU 695           HB3      LEU 695  55.766   4.240 -22.864
    5    HG   LEU 695           HG       LEU 695  56.805   5.792 -25.256
    6   HD13  LEU 695          HD11      LEU 695  56.545   7.744 -23.826
    7   HD12  LEU 695          HD12      LEU 695  55.858   6.724 -22.562
    8   HD11  LEU 695          HD13      LEU 695  55.005   6.922 -24.092
    9   HD23  LEU 695          HD21      LEU 695  58.029   5.474 -22.508
   10   HD22  LEU 695          HD22      LEU 695  58.638   6.506 -23.801
   11   HD21  LEU 695          HD23      LEU 695  58.648   4.752 -23.992

  No H/Q in entry =          11
  In of MODEL   47
    1    H    THR 696           H        THR 696  58.919   2.708 -24.779
    2    HA   THR 696           HA       THR 696  59.304   1.000 -22.529
    3    HB   THR 696           HB       THR 696  61.397   2.319 -24.295
    4    HG1  THR 696           HG1      THR 696  59.614   0.329 -24.747
    5   HG23  THR 696          HG21      THR 696  62.847   0.505 -23.518
    6   HG22  THR 696          HG22      THR 696  61.529  -0.138 -22.540
    7   HG21  THR 696          HG23      THR 696  62.241   1.423 -22.135

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLN 697           H        GLN 697  58.689   2.202 -20.775
    2    HA   GLN 697           HA       GLN 697  59.984   4.746 -20.189
    3    HB2  GLN 697           HB2      GLN 697  57.973   3.140 -18.645
    4    HB3  GLN 697           HB3      GLN 697  58.557   4.744 -18.207
    5    HG2  GLN 697           HG2      GLN 697  57.692   5.576 -20.373
    6    HG3  GLN 697           HG3      GLN 697  56.966   3.986 -20.635
    7   HE21  GLN 697          HE21      GLN 697  56.905   6.894 -18.837
    8   HE22  GLN 697          HE22      GLN 697  55.386   6.628 -18.081

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ALA 698           H        ALA 698  60.416   1.509 -19.774
    2    HA   ALA 698           HA       ALA 698  61.709   0.125 -18.663
    3    HB1  ALA 698           HB1      ALA 698  63.589   1.745 -19.124
    4    HB2  ALA 698           HB2      ALA 698  63.804   0.786 -17.660
    5    HB3  ALA 698           HB3      ALA 698  63.271   2.466 -17.543

  No H/Q in entry =           5
  In of MODEL   47
    1    H    VAL 699           H        VAL 699  59.648  -0.019 -17.925
    2    HA   VAL 699           HA       VAL 699  59.692   0.166 -15.076
    3    HB   VAL 699           HB       VAL 699  57.293  -0.409 -15.401
    4   HG13  VAL 699          HG11      VAL 699  58.025   1.845 -14.696
    5   HG12  VAL 699          HG12      VAL 699  56.670   2.025 -15.811
    6   HG11  VAL 699          HG13      VAL 699  58.321   2.287 -16.378
    7   HG22  VAL 699          HG21      VAL 699  56.195   0.337 -17.508
    8   HG21  VAL 699          HG22      VAL 699  57.277  -1.038 -17.742
    9   HG23  VAL 699          HG23      VAL 699  57.794   0.583 -18.206

  No H/Q in entry =           9
  In of MODEL   47
    1    HA   PRO 700           HA       PRO 700  60.524  -4.175 -15.650
    2    HB2  PRO 700           HB2      PRO 700  60.837  -4.746 -12.976
    3    HB3  PRO 700           HB3      PRO 700  62.122  -4.131 -14.015
    4    HG2  PRO 700           HG2      PRO 700  60.486  -2.725 -11.994
    5    HG3  PRO 700           HG3      PRO 700  62.144  -2.411 -12.516
    6    HD2  PRO 700           HD2      PRO 700  59.933  -0.938 -13.282
    7    HD3  PRO 700           HD3      PRO 700  61.470  -0.982 -14.163

  No H/Q in entry =           7
  In of MODEL   47
    1    H    LYS 701           H        LYS 701  59.360  -5.993 -15.477
    2    HA   LYS 701           HA       LYS 701  56.583  -5.699 -14.839
    3    HB2  LYS 701           HB2      LYS 701  58.147  -8.102 -15.763
    4    HB3  LYS 701           HB3      LYS 701  56.395  -7.980 -15.690
    5    HG2  LYS 701           HG2      LYS 701  56.412  -6.238 -17.367
    6    HG3  LYS 701           HG3      LYS 701  58.178  -6.268 -17.402
    7    HD2  LYS 701           HD2      LYS 701  58.072  -8.626 -18.067
    8    HD3  LYS 701           HD3      LYS 701  56.315  -8.505 -18.149
    9    HE2  LYS 701           HE2      LYS 701  58.276  -6.900 -19.817
   10    HE3  LYS 701           HE3      LYS 701  57.339  -8.279 -20.384
   11    HZ2  LYS 701           HZ1      LYS 701  56.327  -6.199 -21.036
   12    HZ1  LYS 701           HZ2      LYS 701  56.199  -5.690 -19.441
   13    HZ3  LYS 701           HZ3      LYS 701  55.320  -7.022 -19.986

  No H/Q in entry =          13
  In of MODEL   47
    1    H    CYS 702           H        CYS 702  55.615  -6.411 -13.006
    2    HA   CYS 702           HA       CYS 702  57.246  -7.980 -11.120
    3    HB2  CYS 702           HB2      CYS 702  54.888  -6.191 -10.440
    4    HB3  CYS 702           HB3      CYS 702  56.043  -6.920  -9.349

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLN 703           H        GLN 703  56.149  -9.758 -10.096
    2    HA   GLN 703           HA       GLN 703  53.956 -10.808 -11.610
    3    HB2  GLN 703           HB2      GLN 703  55.056 -11.720  -8.939
    4    HB3  GLN 703           HB3      GLN 703  53.965 -12.632  -9.967
    5    HG2  GLN 703           HG2      GLN 703  56.805 -11.873 -10.609
    6    HG3  GLN 703           HG3      GLN 703  56.246 -13.464 -10.115
    7   HE21  GLN 703          HE21      GLN 703  53.833 -13.319 -11.828
    8   HE22  GLN 703          HE22      GLN 703  54.403 -13.522 -13.435

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ARG 704           H        ARG 704  52.007 -11.605 -10.114
    2    HA   ARG 704           HA       ARG 704  50.717  -9.164  -9.589
    3    HB2  ARG 704           HB2      ARG 704  49.814 -11.970  -9.152
    4    HB3  ARG 704           HB3      ARG 704  48.785 -10.574  -8.882
    5    HG2  ARG 704           HG2      ARG 704  50.137 -11.259 -11.449
    6    HG3  ARG 704           HG3      ARG 704  48.459 -11.632 -11.130
    7    HD2  ARG 704           HD2      ARG 704  48.336  -9.626 -12.336
    8    HD3  ARG 704           HD3      ARG 704  48.266  -9.090 -10.657
    9    HE   ARG 704           HE       ARG 704  50.743  -9.065 -12.248
   10   HH11  ARG 704          HH11      ARG 704  48.536  -7.470 -10.009
   11   HH12  ARG 704          HH12      ARG 704  49.469  -6.087  -9.740
   12   HH21  ARG 704          HH21      ARG 704  52.127  -7.116 -11.915
   13   HH22  ARG 704          HH22      ARG 704  51.585  -5.900 -10.870

  No H/Q in entry =          13
  In of MODEL   47
    1    H    TRP 705           H        TRP 705  52.333 -11.251  -7.443
    2    HA   TRP 705           HA       TRP 705  51.174 -10.010  -5.068
    3    HB2  TRP 705           HB2      TRP 705  52.620 -11.766  -3.918
    4    HB3  TRP 705           HB3      TRP 705  51.300 -12.351  -4.923
    5    HD1  TRP 705           HD1      TRP 705  55.084 -12.395  -4.681
    6    HE1  TRP 705           HE1      TRP 705  56.021 -13.983  -6.473
    7    HE3  TRP 705           HE3      TRP 705  50.806 -13.300  -7.333
    8    HZ2  TRP 705           HZ2      TRP 705  55.087 -15.454  -8.685
    9    HZ3  TRP 705           HZ3      TRP 705  50.923 -14.800  -9.280
   10    HH2  TRP 705           HH2      TRP 705  53.016 -15.854  -9.935

  No H/Q in entry =          10
  In of MODEL   47
    1    H    GLU 706           H        GLU 706  53.276  -9.162  -7.236
    2    HA   GLU 706           HA       GLU 706  55.146  -7.937  -5.371
    3    HB2  GLU 706           HB2      GLU 706  55.535  -8.748  -8.266
    4    HB3  GLU 706           HB3      GLU 706  56.719  -7.868  -7.283
    5    HG2  GLU 706           HG2      GLU 706  56.900  -9.863  -5.862
    6    HG3  GLU 706           HG3      GLU 706  55.744 -10.690  -6.913

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LYS 707           H        LYS 707  55.776  -5.786  -6.137
    2    HA   LYS 707           HA       LYS 707  54.118  -4.633  -8.144
    3    HB2  LYS 707           HB2      LYS 707  53.066  -2.916  -6.777
    4    HB3  LYS 707           HB3      LYS 707  52.590  -4.511  -6.256
    5    HG2  LYS 707           HG2      LYS 707  52.882  -3.479  -4.231
    6    HG3  LYS 707           HG3      LYS 707  54.488  -4.156  -4.465
    7    HD2  LYS 707           HD2      LYS 707  54.603  -1.838  -3.675
    8    HD3  LYS 707           HD3      LYS 707  55.282  -1.990  -5.294
    9    HE2  LYS 707           HE2      LYS 707  53.839   0.022  -4.972
   10    HE3  LYS 707           HE3      LYS 707  53.301  -1.011  -6.286
   11    HZ3  LYS 707           HZ1      LYS 707  51.428  -0.290  -4.958
   12    HZ2  LYS 707           HZ2      LYS 707  52.104  -0.899  -3.542
   13    HZ1  LYS 707           HZ3      LYS 707  51.610  -1.938  -4.750

  No H/Q in entry =          13
  In of MODEL   47
    1    H    LEU 708           H        LEU 708  54.682  -2.513  -8.721
    2    HA   LEU 708           HA       LEU 708  57.543  -2.221  -8.581
    3    HB2  LEU 708           HB2      LEU 708  56.437  -2.162 -10.737
    4    HB3  LEU 708           HB3      LEU 708  55.422  -0.839 -10.215
    5    HG   LEU 708           HG       LEU 708  57.387   0.627 -10.108
    6   HD13  LEU 708          HD11      LEU 708  59.102  -1.008  -9.610
    7   HD12  LEU 708          HD12      LEU 708  59.515  -0.126 -11.084
    8   HD11  LEU 708          HD13      LEU 708  58.858  -1.760 -11.185
    9   HD22  LEU 708          HD21      LEU 708  56.071   0.541 -12.148
   10   HD21  LEU 708          HD22      LEU 708  57.046  -0.805 -12.739
   11   HD23  LEU 708          HD23      LEU 708  57.775   0.786 -12.522

  No H/Q in entry =          11
  In of MODEL   47
    1    H    GLN 709           H        GLN 709  58.401  -1.024  -7.035
    2    HA   GLN 709           HA       GLN 709  57.429   1.671  -6.675
    3    HB2  GLN 709           HB2      GLN 709  57.326   1.625  -4.279
    4    HB3  GLN 709           HB3      GLN 709  56.337   0.286  -4.832
    5    HG2  GLN 709           HG2      GLN 709  58.232  -1.247  -4.351
    6    HG3  GLN 709           HG3      GLN 709  59.136   0.124  -3.747
    7   HE21  GLN 709          HE21      GLN 709  59.323  -0.744  -1.707
    8   HE22  GLN 709          HE22      GLN 709  58.015  -0.830  -0.598

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ASN 710           H        ASN 710  59.120   3.057  -6.216
    2    HA   ASN 710           HA       ASN 710  61.254   3.820  -5.922
    3    HB2  ASN 710           HB2      ASN 710  60.904   2.196  -3.850
    4    HB3  ASN 710           HB3      ASN 710  62.004   1.161  -4.723
    5   HD21  ASN 710          HD21      ASN 710  62.321   2.457  -2.154
    6   HD22  ASN 710          HD22      ASN 710  63.756   3.408  -2.240

  No H/Q in entry =           6
  In of MODEL   47
    1    H    SER 711           H        SER 711  60.393   2.257  -8.249
    2    HA   SER 711           HA       SER 711  61.151   1.610 -10.253
    3    HB2  SER 711           HB2      SER 711  63.832   2.410  -9.145
    4    HB3  SER 711           HB3      SER 711  63.517   2.043 -10.851
    5    HG   SER 711           HG       SER 711  61.871   3.896  -9.604

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ARG 712           H        ARG 712  61.124  -0.290  -7.862
    2    HA   ARG 712           HA       ARG 712  62.616  -2.401  -9.212
    3    HB2  ARG 712           HB2      ARG 712  63.287  -3.337  -7.021
    4    HB3  ARG 712           HB3      ARG 712  64.044  -1.791  -7.381
    5    HG2  ARG 712           HG2      ARG 712  62.494  -0.673  -5.898
    6    HG3  ARG 712           HG3      ARG 712  61.678  -2.207  -5.587
    7    HD2  ARG 712           HD2      ARG 712  63.656  -3.103  -4.559
    8    HD3  ARG 712           HD3      ARG 712  64.598  -1.681  -4.994
    9    HE   ARG 712           HE       ARG 712  62.430  -1.763  -2.989
   10   HH11  ARG 712          HH11      ARG 712  65.349  -0.214  -4.293
   11   HH12  ARG 712          HH12      ARG 712  65.580   0.798  -2.958
   12   HH21  ARG 712          HH21      ARG 712  62.734  -0.331  -1.172
   13   HH22  ARG 712          HH22      ARG 712  64.052   0.747  -1.151

  No H/Q in entry =          13
  In of MODEL   47
    1    H    CYS 713           H        CYS 713  61.947  -4.571  -8.462
    2    HA   CYS 713           HA       CYS 713  59.045  -4.657  -8.172
    3    HB2  CYS 713           HB2      CYS 713  61.019  -6.874  -8.791
    4    HB3  CYS 713           HB3      CYS 713  59.270  -6.961  -8.931

  No H/Q in entry =           4
  In of MODEL   47
    1    H    VAL 714           H        VAL 714  58.345  -4.924  -6.152
    2    HA   VAL 714           HA       VAL 714  59.968  -6.517  -4.274
    3    HB   VAL 714           HB       VAL 714  59.175  -5.112  -2.444
    4   HG11  VAL 714          HG11      VAL 714  60.347  -3.521  -4.693
    5   HG13  VAL 714          HG12      VAL 714  61.224  -4.399  -3.428
    6   HG12  VAL 714          HG13      VAL 714  60.258  -2.972  -3.026
    7   HG22  VAL 714          HG21      VAL 714  56.986  -4.486  -3.330
    8   HG21  VAL 714          HG22      VAL 714  57.753  -3.473  -4.549
    9   HG23  VAL 714          HG23      VAL 714  57.890  -3.050  -2.842

  No H/Q in entry =           9
  In of MODEL   47
    1    H    CYS 715           H        CYS 715  58.507  -7.367  -2.478
    2    HA   CYS 715           HA       CYS 715  56.111  -8.434  -3.742
    3    HB2  CYS 715           HB2      CYS 715  57.293  -9.039  -0.985
    4    HB3  CYS 715           HB3      CYS 715  55.984  -9.914  -1.732

  No H/Q in entry =           4
  In of MODEL   47
    1    H    LYS 716           H        LYS 716  54.049  -7.828  -3.090
    2    HA   LYS 716           HA       LYS 716  53.968  -5.378  -1.599
    3    HB2  LYS 716           HB2      LYS 716  51.503  -5.432  -1.941
    4    HB3  LYS 716           HB3      LYS 716  52.411  -5.554  -3.439
    5    HG2  LYS 716           HG2      LYS 716  51.924  -7.865  -3.639
    6    HG3  LYS 716           HG3      LYS 716  51.278  -7.922  -2.000
    7    HD2  LYS 716           HD2      LYS 716  49.473  -7.919  -3.646
    8    HD3  LYS 716           HD3      LYS 716  49.434  -6.459  -2.666
    9    HE2  LYS 716           HE2      LYS 716  50.559  -5.245  -4.490
   10    HE3  LYS 716           HE3      LYS 716  50.519  -6.711  -5.474
   11    HZ2  LYS 716           HZ1      LYS 716  48.632  -5.216  -5.998
   12    HZ1  LYS 716           HZ2      LYS 716  48.152  -5.294  -4.393
   13    HZ3  LYS 716           HZ3      LYS 716  48.098  -6.676  -5.330

  No H/Q in entry =          13
  In of MODEL   47
    1    H    MET 717           H        MET 717  51.839  -5.439   0.018
    2    HA   MET 717           HA       MET 717  52.857  -7.331   1.985
    3    HB2  MET 717           HB2      MET 717  51.665  -4.602   2.388
    4    HB3  MET 717           HB3      MET 717  52.070  -5.699   3.701
    5    HG2  MET 717           HG2      MET 717  54.009  -4.564   1.687
    6    HG3  MET 717           HG3      MET 717  53.797  -4.025   3.353
    7    HE1  MET 717           HE1      MET 717  54.602  -5.372   5.472
    8    HE3  MET 717           HE2      MET 717  55.212  -7.026   5.416
    9    HE2  MET 717           HE3      MET 717  53.525  -6.701   5.036

  No H/Q in entry =           9
  In of MODEL   47
    1    HA   PRO 718           HA       PRO 718  49.103  -9.540   2.152
    2    HB2  PRO 718           HB2      PRO 718  49.230  -9.765   5.075
    3    HB3  PRO 718           HB3      PRO 718  49.381 -11.020   3.847
    4    HG2  PRO 718           HG2      PRO 718  51.472 -10.136   5.321
    5    HG3  PRO 718           HG3      PRO 718  51.655 -10.750   3.667
    6    HD2  PRO 718           HD2      PRO 718  51.668  -7.957   4.695
    7    HD3  PRO 718           HD3      PRO 718  52.605  -8.689   3.375

  No H/Q in entry =           7
  In of MODEL   47
    1    H    TYR 719           H        TYR 719  49.321  -6.729   4.055
    2    HA   TYR 719           HA       TYR 719  46.534  -6.861   4.855
    3    HB2  TYR 719           HB2      TYR 719  47.023  -4.684   6.051
    4    HB3  TYR 719           HB3      TYR 719  47.947  -6.073   6.602
    5    HD1  TYR 719           HD1      TYR 719  50.356  -6.188   6.228
    6    HD2  TYR 719           HD2      TYR 719  48.097  -2.849   4.883
    7    HE1  TYR 719           HE1      TYR 719  52.423  -4.906   5.953
    8    HE2  TYR 719           HE2      TYR 719  50.175  -1.569   4.580
    9    HH   TYR 719           HH       TYR 719  52.443  -1.546   5.413

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLU 720           H        GLU 720  48.198  -5.946   2.219
    2    HA   GLU 720           HA       GLU 720  46.398  -3.779   1.450
    3    HB2  GLU 720           HB2      GLU 720  48.900  -4.952   0.274
    4    HB3  GLU 720           HB3      GLU 720  47.967  -3.690  -0.543
    5    HG2  GLU 720           HG2      GLU 720  49.370  -3.481   2.123
    6    HG3  GLU 720           HG3      GLU 720  49.928  -2.790   0.601

  No H/Q in entry =           6
  In of MODEL   47
    1    H    CYS 721           H        CYS 721  46.305  -6.985   1.571
    2    HA   CYS 721           HA       CYS 721  45.559  -7.550  -1.162
    3    HB2  CYS 721           HB2      CYS 721  45.700  -9.375   1.227
    4    HB3  CYS 721           HB3      CYS 721  45.493  -9.865  -0.450

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLY 722           H        GLY 722  43.660  -6.281  -1.205
    2    HA3  GLY 722           HA2      GLY 722  41.426  -7.294   0.411
    3    HA2  GLY 722           HA3      GLY 722  41.421  -5.792  -0.506

  No H/Q in entry =           3
  In of MODEL   47
    1    HA   PRO 723           HA       PRO 723  39.287  -7.668  -3.907
    2    HB2  PRO 723           HB2      PRO 723  40.825  -6.753  -6.027
    3    HB3  PRO 723           HB3      PRO 723  39.532  -5.826  -5.251
    4    HG2  PRO 723           HG2      PRO 723  42.488  -5.712  -4.802
    5    HG3  PRO 723           HG3      PRO 723  41.322  -4.381  -4.882
    6    HD2  PRO 723           HD2      PRO 723  42.253  -5.224  -2.547
    7    HD3  PRO 723           HD3      PRO 723  40.541  -4.784  -2.727

  No H/Q in entry =           7
  In of MODEL   47
    1    H    SER 724           H        SER 724  39.542  -9.908  -3.954
    2    HA   SER 724           HA       SER 724  41.297 -11.066  -5.764
    3    HB2  SER 724           HB2      SER 724  42.431 -12.465  -3.939
    4    HB3  SER 724           HB3      SER 724  43.041 -10.837  -4.229
    5    HG   SER 724           HG       SER 724  41.447 -10.282  -2.455

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU 725           H        LEU 725  40.929 -13.291  -5.889
    2    HA   LEU 725           HA       LEU 725  38.217 -14.048  -5.209
    3    HB2  LEU 725           HB2      LEU 725  40.415 -15.358  -6.725
    4    HB3  LEU 725           HB3      LEU 725  39.003 -16.281  -6.245
    5    HG   LEU 725           HG       LEU 725  38.857 -13.763  -7.906
    6   HD12  LEU 725          HD11      LEU 725  38.585 -15.264  -9.822
    7   HD11  LEU 725          HD12      LEU 725  38.868 -16.661  -8.782
    8   HD13  LEU 725          HD13      LEU 725  40.166 -15.506  -9.080
    9   HD21  LEU 725          HD21      LEU 725  36.947 -16.009  -7.350
   10   HD23  LEU 725          HD22      LEU 725  36.664 -14.678  -8.475
   11   HD22  LEU 725          HD23      LEU 725  36.813 -14.354  -6.750

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ASP 726           H        ASP 726  37.531 -15.282  -3.623
    2    HA   ASP 726           HA       ASP 726  39.319 -16.117  -1.571
    3    HB2  ASP 726           HB2      ASP 726  36.362 -16.661  -1.939
    4    HB3  ASP 726           HB3      ASP 726  37.287 -17.075  -0.506

  No H/Q in entry =           4
  In of MODEL   47
    1    H    VAL 727           H        VAL 727  40.089 -18.037  -1.111
    2    HA   VAL 727           HA       VAL 727  39.226 -20.432  -2.518
    3    HB   VAL 727           HB       VAL 727  41.616 -21.078  -2.959
    4   HG13  VAL 727          HG11      VAL 727  40.193 -20.317  -4.776
    5   HG12  VAL 727          HG12      VAL 727  41.845 -19.756  -5.016
    6   HG11  VAL 727          HG13      VAL 727  40.612 -18.642  -4.423
    7   HG22  VAL 727          HG21      VAL 727  43.328 -19.325  -3.054
    8   HG21  VAL 727          HG22      VAL 727  42.683 -19.486  -1.421
    9   HG23  VAL 727          HG23      VAL 727  42.160 -18.151  -2.447

  No H/Q in entry =           9
  In of MODEL   47
    1    H    CYS 728           H        CYS 728  40.161 -22.414  -1.520
    2    HA   CYS 728           HA       CYS 728  40.400 -22.044   1.373
    3    HB2  CYS 728           HB2      CYS 728  39.938 -24.616  -0.164
    4    HB3  CYS 728           HB3      CYS 728  39.724 -24.337   1.552

  No H/Q in entry =           4
  In of MODEL   47
    1    H    ALA 729           H        ALA 729  42.344 -22.369   2.331
    2    HA   ALA 729           HA       ALA 729  44.333 -23.894   0.837
    3    HB2  ALA 729           HB1      ALA 729  46.032 -22.291   1.511
    4    HB1  ALA 729           HB2      ALA 729  44.795 -21.304   2.295
    5    HB3  ALA 729           HB3      ALA 729  44.779 -21.515   0.541

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLN 730           H        GLN 730  45.923 -24.795   2.139
    2    HA   GLN 730           HA       GLN 730  45.044 -25.311   4.882
    3    HB2  GLN 730           HB2      GLN 730  45.186 -27.314   3.417
    4    HB3  GLN 730           HB3      GLN 730  46.874 -26.950   3.130
    5    HG2  GLN 730           HG2      GLN 730  47.398 -27.254   5.458
    6    HG3  GLN 730           HG3      GLN 730  45.712 -27.561   5.835
    7   HE21  GLN 730          HE21      GLN 730  46.125 -29.607   6.643
    8   HE22  GLN 730          HE22      GLN 730  46.666 -30.915   5.653

  No H/Q in entry =           8
  In of MODEL   47
    1    H    ASP 731           H        ASP 731  46.276 -24.786   6.457
    2    HA   ASP 731           HA       ASP 731  48.693 -23.241   6.048
    3    HB2  ASP 731           HB2      ASP 731  47.019 -22.607   7.774
    4    HB3  ASP 731           HB3      ASP 731  47.276 -24.154   8.540

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLU 732           H        GLU 732  50.705 -24.166   6.038
    2    HA   GLU 732           HA       GLU 732  50.930 -26.958   6.512
    3    HB2  GLU 732           HB2      GLU 732  52.984 -24.878   5.829
    4    HB3  GLU 732           HB3      GLU 732  53.392 -26.567   6.108
    5    HG2  GLU 732           HG2      GLU 732  51.515 -25.511   4.014
    6    HG3  GLU 732           HG3      GLU 732  53.142 -26.141   3.745

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ARG 733           H        ARG 733  50.977 -24.456   8.700
    2    HA   ARG 733           HA       ARG 733  52.953 -25.687  10.398
    3    HB2  ARG 733           HB2      ARG 733  52.832 -23.222  10.136
    4    HB3  ARG 733           HB3      ARG 733  51.235 -23.246  10.862
    5    HG2  ARG 733           HG2      ARG 733  52.940 -22.549  12.458
    6    HG3  ARG 733           HG3      ARG 733  52.193 -24.078  12.944
    7    HD2  ARG 733           HD2      ARG 733  54.644 -24.099  13.220
    8    HD3  ARG 733           HD3      ARG 733  54.070 -25.312  12.075
    9    HE   ARG 733           HE       ARG 733  54.927 -22.764  10.978
   10   HH11  ARG 733          HH11      ARG 733  55.765 -26.154  11.606
   11   HH12  ARG 733          HH12      ARG 733  57.035 -26.197  10.479
   12   HH21  ARG 733          HH21      ARG 733  56.685 -22.831   9.431
   13   HH22  ARG 733          HH22      ARG 733  57.566 -24.264   9.214

  No H/Q in entry =          13
  In of MODEL   47
    1    H    SER 734           H        SER 734  49.496 -24.961  10.438
    2    HA   SER 734           HA       SER 734  49.136 -26.648  12.807
    3    HB2  SER 734           HB2      SER 734  46.833 -25.657  12.782
    4    HB3  SER 734           HB3      SER 734  48.126 -24.465  12.928
    5    HG   SER 734           HG       SER 734  47.904 -23.980  10.756

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LYS 735           H        LYS 735  48.772 -26.797   9.380
    2    HA   LYS 735           HA       LYS 735  47.962 -28.168   7.949
    3    HB2  LYS 735           HB2      LYS 735  47.718 -30.013  10.309
    4    HB3  LYS 735           HB3      LYS 735  47.269 -30.499   8.680
    5    HG2  LYS 735           HG2      LYS 735  49.991 -29.615   9.610
    6    HG3  LYS 735           HG3      LYS 735  49.497 -31.262   9.203
    7    HD2  LYS 735           HD2      LYS 735  48.864 -30.207   6.902
    8    HD3  LYS 735           HD3      LYS 735  49.900 -28.899   7.415
    9    HE2  LYS 735           HE2      LYS 735  51.784 -30.303   7.686
   10    HE3  LYS 735           HE3      LYS 735  50.825 -31.755   7.409
   11    HZ1  LYS 735           HZ1      LYS 735  50.451 -30.913   5.107
   12    HZ3  LYS 735           HZ2      LYS 735  52.029 -31.294   5.458
   13    HZ2  LYS 735           HZ3      LYS 735  51.593 -29.693   5.370

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ARG 736           H        ARG 736  46.173 -26.307   9.478
    2    HA   ARG 736           HA       ARG 736  43.615 -27.681   9.154
    3    HB2  ARG 736           HB2      ARG 736  42.588 -25.796  10.171
    4    HB3  ARG 736           HB3      ARG 736  44.012 -26.200  11.121
    5    HG2  ARG 736           HG2      ARG 736  45.158 -24.330  10.463
    6    HG3  ARG 736           HG3      ARG 736  44.198 -24.137   8.992
    7    HD2  ARG 736           HD2      ARG 736  43.205 -23.728  11.800
    8    HD3  ARG 736           HD3      ARG 736  43.668 -22.477  10.634
    9    HE   ARG 736           HE       ARG 736  41.825 -23.824   9.255
   10   HH11  ARG 736          HH11      ARG 736  41.708 -22.462  12.523
   11   HH12  ARG 736          HH12      ARG 736  40.009 -22.261  12.493
   12   HH21  ARG 736          HH21      ARG 736  39.543 -23.567   9.250
   13   HH22  ARG 736          HH22      ARG 736  38.757 -22.926  10.618

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ILE 737           H        ILE 737  41.946 -26.705   7.881
    2    HA   ILE 737           HA       ILE 737  42.971 -25.425   5.481
    3    HB   ILE 737           HB       ILE 737  40.113 -26.220   6.063
    4   HG12  ILE 737          HG12      ILE 737  41.583 -28.220   6.351
    5   HG13  ILE 737          HG13      ILE 737  40.482 -28.375   4.994
    6   HG21  ILE 737          HG21      ILE 737  40.522 -24.706   4.174
    7   HG23  ILE 737          HG22      ILE 737  39.914 -26.269   3.640
    8   HG22  ILE 737          HG23      ILE 737  41.626 -25.893   3.467
    9   HD12  ILE 737          HD11      ILE 737  43.405 -27.688   4.859
   10   HD11  ILE 737          HD12      ILE 737  42.290 -27.777   3.492
   11   HD13  ILE 737          HD13      ILE 737  42.655 -29.233   4.425

  No H/Q in entry =          11
  In of MODEL   47
    1    H    LEU 738           H        LEU 738  42.708 -23.272   5.256
    2    HA   LEU 738           HA       LEU 738  40.566 -22.022   6.732
    3    HB2  LEU 738           HB2      LEU 738  41.878 -20.096   7.392
    4    HB3  LEU 738           HB3      LEU 738  42.595 -21.542   8.058
    5    HG   LEU 738           HG       LEU 738  43.649 -20.075   5.632
    6   HD11  LEU 738          HD11      LEU 738  44.527 -19.996   8.511
    7   HD13  LEU 738          HD12      LEU 738  43.751 -18.674   7.635
    8   HD12  LEU 738          HD13      LEU 738  45.362 -19.217   7.169
    9   HD22  LEU 738          HD21      LEU 738  44.211 -22.393   5.761
   10   HD21  LEU 738          HD22      LEU 738  44.788 -22.188   7.415
   11   HD23  LEU 738          HD23      LEU 738  45.655 -21.408   6.065

  No H/Q in entry =          11
  In of MODEL   47
    1    HA   PRO 739           HA       PRO 739  39.772 -20.053   2.907
    2    HB2  PRO 739           HB2      PRO 739  38.284 -17.975   3.795
    3    HB3  PRO 739           HB3      PRO 739  37.687 -19.648   3.856
    4    HG2  PRO 739           HG2      PRO 739  38.917 -18.005   6.030
    5    HG3  PRO 739           HG3      PRO 739  37.471 -19.036   6.090
    6    HD2  PRO 739           HD2      PRO 739  39.951 -19.898   6.956
    7    HD3  PRO 739           HD3      PRO 739  38.713 -20.972   6.250

  No H/Q in entry =           7
  In of MODEL   47
    1    H    LEU 740           H        LEU 740  41.108 -18.870   1.750
    2    HA   LEU 740           HA       LEU 740  42.293 -16.368   2.775
    3    HB2  LEU 740           HB2      LEU 740  43.637 -18.574   1.237
    4    HB3  LEU 740           HB3      LEU 740  44.260 -16.941   1.338
    5    HG   LEU 740           HG       LEU 740  43.894 -18.826   3.669
    6   HD12  LEU 740          HD11      LEU 740  46.357 -17.790   2.299
    7   HD11  LEU 740          HD12      LEU 740  45.711 -19.421   2.137
    8   HD13  LEU 740          HD13      LEU 740  46.313 -18.856   3.701
    9   HD22  LEU 740          HD21      LEU 740  43.577 -16.529   4.372
   10   HD21  LEU 740          HD22      LEU 740  45.025 -16.037   3.505
   11   HD23  LEU 740          HD23      LEU 740  45.158 -17.095   4.913

  No H/Q in entry =          11
  In of MODEL   47
    1    H    THR 741           H        THR 741  43.234 -15.256   0.687
    2    HA   THR 741           HA       THR 741  41.432 -15.726  -1.547
    3    HB   THR 741           HB       THR 741  42.147 -13.153  -1.860
    4    HG1  THR 741           HG1      THR 741  41.648 -12.411   0.444
    5   HG21  THR 741          HG21      THR 741  39.871 -14.116  -0.159
    6   HG23  THR 741          HG22      THR 741  39.925 -13.997  -1.930
    7   HG22  THR 741          HG23      THR 741  40.007 -12.527  -0.942

  No H/Q in entry =           7
  In of MODEL   47
    1    H    VAL 742           H        VAL 742  42.388 -15.010  -3.593
    2    HA   VAL 742           HA       VAL 742  44.751 -16.275  -4.131
    3    HB   VAL 742           HB       VAL 742  43.726 -13.910  -5.658
    4   HG11  VAL 742          HG11      VAL 742  45.507 -16.135  -6.536
    5   HG13  VAL 742          HG12      VAL 742  45.863 -14.402  -6.390
    6   HG12  VAL 742          HG13      VAL 742  44.708 -14.964  -7.591
    7   HG22  VAL 742          HG21      VAL 742  41.975 -15.448  -5.372
    8   HG21  VAL 742          HG22      VAL 742  43.010 -16.791  -5.930
    9   HG23  VAL 742          HG23      VAL 742  42.554 -15.477  -7.041

  No H/Q in entry =           9
  In of MODEL   47
    1    H    CYS 743           H        CYS 743  44.305 -12.760  -4.089
    2    HA   CYS 743           HA       CYS 743  46.967 -12.037  -4.246
    3    HB2  CYS 743           HB2      CYS 743  45.099 -10.462  -4.608
    4    HB3  CYS 743           HB3      CYS 743  44.724 -10.514  -2.888

  No H/Q in entry =           4
  In of MODEL   47
    1    H    LYS 744           H        LYS 744  44.937 -12.620  -1.387
    2    HA   LYS 744           HA       LYS 744  46.811 -11.751   0.505
    3    HB2  LYS 744           HB2      LYS 744  44.320 -12.119   0.749
    4    HB3  LYS 744           HB3      LYS 744  44.674 -13.818   0.876
    5    HG2  LYS 744           HG2      LYS 744  45.746 -13.552   2.971
    6    HG3  LYS 744           HG3      LYS 744  45.796 -11.787   2.796
    7    HD2  LYS 744           HD2      LYS 744  43.316 -11.753   2.752
    8    HD3  LYS 744           HD3      LYS 744  43.311 -13.490   3.022
    9    HE2  LYS 744           HE2      LYS 744  44.559 -11.514   4.917
   10    HE3  LYS 744           HE3      LYS 744  42.880 -12.027   5.043
   11    HZ2  LYS 744           HZ1      LYS 744  45.291 -13.756   5.308
   12    HZ1  LYS 744           HZ2      LYS 744  43.672 -14.303   5.328
   13    HZ3  LYS 744           HZ3      LYS 744  44.213 -13.301   6.521

  No H/Q in entry =          13
  In of MODEL   47
    1    H    MET 745           H        MET 745  45.957 -15.048  -0.584
    2    HA   MET 745           HA       MET 745  47.866 -16.396   1.046
    3    HB2  MET 745           HB2      MET 745  46.912 -18.257   0.310
    4    HB3  MET 745           HB3      MET 745  45.671 -17.185  -0.291
    5    HG2  MET 745           HG2      MET 745  45.986 -18.499  -2.158
    6    HG3  MET 745           HG3      MET 745  47.136 -17.217  -2.471
    7    HE2  MET 745           HE1      MET 745  48.336 -21.387  -0.844
    8    HE1  MET 745           HE2      MET 745  46.683 -20.902  -1.201
    9    HE3  MET 745           HE3      MET 745  47.535 -20.189   0.168

  No H/Q in entry =           9
  In of MODEL   47
    1    H    HIS 746           H        HIS 746  48.071 -14.959  -2.147
    2    HA   HIS 746           HA       HIS 746  50.503 -16.327  -2.849
    3    HB2  HIS 746           HB2      HIS 746  48.916 -14.179  -4.008
    4    HB3  HIS 746           HB3      HIS 746  50.655 -14.043  -4.303
    5    HD1  HIS 746           HD1      HIS 746  51.658 -16.465  -5.358
    6    HD2  HIS 746           HD2      HIS 746  47.639 -15.553  -5.856
    7    HE1  HIS 746           HE1      HIS 746  50.926 -17.748  -7.374
    8    HE2  HIS 746           HE2      HIS 746  48.449 -17.274  -7.579

  No H/Q in entry =           8
  In of MODEL   47
    1    H    VAL 747           H        VAL 747  49.796 -13.088  -1.602
    2    HA   VAL 747           HA       VAL 747  52.488 -12.293  -1.406
    3    HB   VAL 747           HB       VAL 747  49.984 -11.367   0.020
    4   HG12  VAL 747          HG11      VAL 747  52.701 -10.031  -0.059
    5   HG11  VAL 747          HG12      VAL 747  51.988 -10.806   1.355
    6   HG13  VAL 747          HG13      VAL 747  51.242  -9.370   0.681
    7   HG21  VAL 747          HG21      VAL 747  50.013 -11.072  -2.392
    8   HG23  VAL 747          HG22      VAL 747  51.538 -10.203  -2.282
    9   HG22  VAL 747          HG23      VAL 747  50.075  -9.529  -1.548

  No H/Q in entry =           9
  In of MODEL   47
    1    H    LEU 748           H        LEU 748  50.220 -13.615   0.834
    2    HA   LEU 748           HA       LEU 748  51.518 -14.138   3.183
    3    HB2  LEU 748           HB2      LEU 748  49.198 -14.550   2.576
    4    HB3  LEU 748           HB3      LEU 748  49.690 -15.660   1.355
    5    HG   LEU 748           HG       LEU 748  48.518 -16.770   2.966
    6   HD11  LEU 748          HD11      LEU 748  51.346 -17.481   3.148
    7   HD13  LEU 748          HD12      LEU 748  50.047 -18.120   2.126
    8   HD12  LEU 748          HD13      LEU 748  50.033 -18.420   3.861
    9   HD22  LEU 748          HD21      LEU 748  48.567 -15.327   4.764
   10   HD21  LEU 748          HD22      LEU 748  50.289 -15.639   5.104
   11   HD23  LEU 748          HD23      LEU 748  49.061 -16.919   5.303

  No H/Q in entry =          11
  In of MODEL   47
    1    H    HIS 749           H        HIS 749  51.587 -15.991   0.181
    2    HA   HIS 749           HA       HIS 749  53.308 -18.072   1.009
    3    HB2  HIS 749           HB2      HIS 749  51.569 -17.995  -0.884
    4    HB3  HIS 749           HB3      HIS 749  52.828 -17.226  -1.832
    5    HD1  HIS 749           HD1      HIS 749  54.508 -18.772  -2.937
    6    HD2  HIS 749           HD2      HIS 749  52.131 -20.640  -0.108
    7    HE1  HIS 749           HE1      HIS 749  54.957 -21.195  -3.200
    8    HE2  HIS 749           HE2      HIS 749  53.793 -22.245  -1.244

  No H/Q in entry =           8
  In of MODEL   47
    1    H    CYS 750           H        CYS 750  53.900 -15.004  -0.772
    2    HA   CYS 750           HA       CYS 750  56.631 -15.795  -1.274
    3    HB2  CYS 750           HB2      CYS 750  56.869 -13.622  -2.424
    4    HB3  CYS 750           HB3      CYS 750  55.498 -14.540  -3.022

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLN 751           H        GLN 751  54.945 -14.017   1.140
    2    HA   GLN 751           HA       GLN 751  57.101 -12.503   2.116
    3    HB2  GLN 751           HB2      GLN 751  54.546 -13.493   3.353
    4    HB3  GLN 751           HB3      GLN 751  55.670 -12.531   4.287
    5    HG2  GLN 751           HG2      GLN 751  54.414 -11.668   1.697
    6    HG3  GLN 751           HG3      GLN 751  53.774 -11.259   3.286
    7   HE21  GLN 751          HE21      GLN 751  54.657  -9.468   1.177
    8   HE22  GLN 751          HE22      GLN 751  55.942  -8.549   1.835

  No H/Q in entry =           8
  In of MODEL   47
    1    H    GLY 752           H        GLY 752  56.281 -15.801   2.297
    2    HA3  GLY 752           HA2      GLY 752  58.130 -17.302   2.907
    3    HA2  GLY 752           HA3      GLY 752  58.428 -16.238   4.272

  No H/Q in entry =           3
  In of MODEL   47
    1    H    ARG 753           H        ARG 753  55.228 -17.288   3.208
    2    HA   ARG 753           HA       ARG 753  55.106 -18.995   5.590
    3    HB2  ARG 753           HB2      ARG 753  52.827 -17.464   4.325
    4    HB3  ARG 753           HB3      ARG 753  52.718 -18.480   5.757
    5    HG2  ARG 753           HG2      ARG 753  54.206 -15.885   5.468
    6    HG3  ARG 753           HG3      ARG 753  52.713 -16.145   6.367
    7    HD2  ARG 753           HD2      ARG 753  53.893 -17.692   7.866
    8    HD3  ARG 753           HD3      ARG 753  55.386 -17.408   6.975
    9    HE   ARG 753           HE       ARG 753  53.925 -15.351   8.456
   10   HH11  ARG 753          HH11      ARG 753  56.997 -16.758   7.338
   11   HH12  ARG 753          HH12      ARG 753  57.966 -15.718   8.265
   12   HH21  ARG 753          HH21      ARG 753  55.289 -13.893   9.722
   13   HH22  ARG 753          HH22      ARG 753  56.974 -14.036   9.624

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ASN 754           H        ASN 754  54.442 -21.028   5.263
    2    HA   ASN 754           HA       ASN 754  54.084 -21.785   2.474
    3    HB2  ASN 754           HB2      ASN 754  54.759 -23.501   4.864
    4    HB3  ASN 754           HB3      ASN 754  54.580 -24.084   3.215
    5   HD21  ASN 754          HD21      ASN 754  56.523 -22.407   5.430
    6   HD22  ASN 754          HD22      ASN 754  57.943 -22.257   4.456

  No H/Q in entry =           6
  In of MODEL   47
    1    H    TYR 755           H        TYR 755  52.193 -22.057   1.776
    2    HA   TYR 755           HA       TYR 755  50.186 -23.386   3.400
    3    HB2  TYR 755           HB2      TYR 755  49.906 -20.811   1.900
    4    HB3  TYR 755           HB3      TYR 755  48.513 -21.845   2.133
    5    HD1  TYR 755           HD1      TYR 755  51.301 -20.708   4.400
    6    HD2  TYR 755           HD2      TYR 755  47.133 -20.868   3.701
    7    HE1  TYR 755           HE1      TYR 755  50.922 -19.494   6.482
    8    HE2  TYR 755           HE2      TYR 755  46.734 -19.647   5.780
    9    HH   TYR 755           HH       TYR 755  47.909 -19.241   7.937

  No H/Q in entry =           9
  In of MODEL   47
    1    H    THR 756           H        THR 756  48.968 -24.687   2.298
    2    HA   THR 756           HA       THR 756  49.723 -25.312  -0.473
    3    HB   THR 756           HB       THR 756  48.585 -26.916   1.811
    4    HG1  THR 756           HG1      THR 756  50.505 -27.330   2.287
    5   HG23  THR 756          HG21      THR 756  47.764 -27.734  -0.283
    6   HG22  THR 756          HG22      THR 756  48.910 -28.892   0.410
    7   HG21  THR 756          HG23      THR 756  49.401 -27.831  -0.941

  No H/Q in entry =           7
  In of MODEL   47
    1    H    LEU 757           H        LEU 757  47.872 -25.766  -1.932
    2    HA   LEU 757           HA       LEU 757  45.428 -24.707  -0.817
    3    HB2  LEU 757           HB2      LEU 757  46.187 -25.201  -3.662
    4    HB3  LEU 757           HB3      LEU 757  44.561 -24.773  -3.166
    5    HG   LEU 757           HG       LEU 757  45.972 -22.824  -1.996
    6   HD13  LEU 757          HD11      LEU 757  47.610 -21.965  -3.576
    7   HD12  LEU 757          HD12      LEU 757  47.447 -23.439  -4.536
    8   HD11  LEU 757          HD13      LEU 757  48.084 -23.521  -2.890
    9   HD21  LEU 757          HD21      LEU 757  43.978 -22.649  -3.299
   10   HD23  LEU 757          HD22      LEU 757  44.896 -22.833  -4.804
   11   HD22  LEU 757          HD23      LEU 757  45.144 -21.416  -3.760

  No H/Q in entry =          11
  In of MODEL   47
    1    H    THR 758           H        THR 758  43.517 -25.772  -0.942
    2    HA   THR 758           HA       THR 758  43.789 -28.653  -1.345
    3    HB   THR 758           HB       THR 758  42.058 -28.806   0.531
    4    HG1  THR 758           HG1      THR 758  41.390 -26.703   0.609
    5   HG23  THR 758          HG21      THR 758  43.760 -28.627   2.295
    6   HG22  THR 758          HG22      THR 758  44.784 -27.681   1.217
    7   HG21  THR 758          HG23      THR 758  44.444 -29.370   0.850

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLY 759           H        GLY 759  41.104 -29.273  -0.949
    2    HA3  GLY 759           HA2      GLY 759  39.988 -28.463  -3.437
    3    HA2  GLY 759           HA3      GLY 759  39.234 -29.476  -2.202

  No H/Q in entry =           3
  In of MODEL   47
    1    H    ARG 760           H        ARG 760  37.738 -27.620  -3.526
    2    HA   ARG 760           HA       ARG 760  37.674 -25.136  -2.076
    3    HB2  ARG 760           HB2      ARG 760  35.978 -24.449  -3.601
    4    HB3  ARG 760           HB3      ARG 760  37.034 -25.476  -4.550
    5    HG2  ARG 760           HG2      ARG 760  35.045 -26.331  -5.232
    6    HG3  ARG 760           HG3      ARG 760  35.249 -27.316  -3.776
    7    HD2  ARG 760           HD2      ARG 760  34.071 -25.236  -2.653
    8    HD3  ARG 760           HD3      ARG 760  33.437 -25.014  -4.283
    9    HE   ARG 760           HE       ARG 760  33.182 -27.656  -3.201
   10   HH11  ARG 760          HH11      ARG 760  31.579 -24.554  -3.778
   11   HH12  ARG 760          HH12      ARG 760  30.076 -25.026  -3.159
   12   HH21  ARG 760          HH21      ARG 760  31.171 -28.303  -2.242
   13   HH22  ARG 760          HH22      ARG 760  29.830 -27.232  -2.211

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ASP 761           H        ASP 761  36.363 -28.236  -1.693
    2    HA   ASP 761           HA       ASP 761  34.186 -27.412   0.067
    3    HB2  ASP 761           HB2      ASP 761  35.144 -30.102  -0.896
    4    HB3  ASP 761           HB3      ASP 761  33.937 -29.951   0.372

  No H/Q in entry =           4
  In of MODEL   47
    1    H    SER 762           H        SER 762  37.352 -27.461   0.498
    2    HA   SER 762           HA       SER 762  37.516 -29.122   2.814
    3    HB2  SER 762           HB2      SER 762  39.519 -27.178   1.682
    4    HB3  SER 762           HB3      SER 762  39.842 -28.338   2.972
    5    HG   SER 762           HG       SER 762  38.714 -29.687   1.055

  No H/Q in entry =           5
  In of MODEL   47
    1    H    CYS 763           H        CYS 763  36.716 -25.748   2.385
    2    HA   CYS 763           HA       CYS 763  36.112 -25.708   5.191
    3    HB2  CYS 763           HB2      CYS 763  37.306 -23.642   5.722
    4    HB3  CYS 763           HB3      CYS 763  38.444 -24.862   5.156

  No H/Q in entry =           4
  In of MODEL   47
    1    H    THR 764           H        THR 764  35.119 -23.371   5.675
    2    HA   THR 764           HA       THR 764  33.083 -23.040   3.660
    3    HB   THR 764           HB       THR 764  33.382 -21.660   6.342
    4    HG1  THR 764           HG1      THR 764  32.145 -24.100   5.593
    5   HG22  THR 764          HG21      THR 764  30.938 -21.388   6.161
    6   HG21  THR 764          HG22      THR 764  30.961 -22.201   4.596
    7   HG23  THR 764          HG23      THR 764  31.755 -20.635   4.790

  No H/Q in entry =           7
  In of MODEL   47
    1    H    LEU 765           H        LEU 765  33.546 -21.816   2.062
    2    HA   LEU 765           HA       LEU 765  35.447 -19.678   2.344
    3    HB2  LEU 765           HB2      LEU 765  35.344 -21.540   0.556
    4    HB3  LEU 765           HB3      LEU 765  34.065 -20.565  -0.138
    5    HG   LEU 765           HG       LEU 765  35.634 -18.688  -0.348
    6   HD12  LEU 765          HD11      LEU 765  38.043 -19.196  -0.036
    7   HD11  LEU 765          HD12      LEU 765  37.561 -20.752   0.665
    8   HD13  LEU 765          HD13      LEU 765  37.123 -19.259   1.470
    9   HD21  LEU 765          HD21      LEU 765  36.538 -21.275  -1.611
   10   HD23  LEU 765          HD22      LEU 765  36.935 -19.648  -2.172
   11   HD22  LEU 765          HD23      LEU 765  35.264 -20.212  -2.219

  No H/Q in entry =          11
  In of MODEL   47
    1    HA   PRO 766           HA       PRO 766  32.175 -16.660   2.507
    2    HB2  PRO 766           HB2      PRO 766  33.768 -14.599   1.353
    3    HB3  PRO 766           HB3      PRO 766  33.388 -14.834   3.053
    4    HG2  PRO 766           HG2      PRO 766  35.857 -15.301   1.680
    5    HG3  PRO 766           HG3      PRO 766  35.526 -15.452   3.411
    6    HD2  PRO 766           HD2      PRO 766  35.966 -17.507   1.493
    7    HD3  PRO 766           HD3      PRO 766  35.577 -17.703   3.206

  No H/Q in entry =           7
  In of MODEL   47
    1    H    ALA 767           H        ALA 767  34.206 -16.148  -0.410
    2    HA   ALA 767           HA       ALA 767  31.759 -15.694  -1.886
    3    HB2  ALA 767           HB1      ALA 767  33.692 -14.207  -2.289
    4    HB3  ALA 767           HB2      ALA 767  33.099 -15.018  -3.745
    5    HB1  ALA 767           HB3      ALA 767  34.569 -15.590  -2.948

  No H/Q in entry =           5
  In of MODEL   47
    1    H    SER 768           H        SER 768  30.844 -17.433  -1.735
    2    HA   SER 768           HA       SER 768  31.368 -19.262  -3.902
    3    HB2  SER 768           HB2      SER 768  30.945 -20.203  -1.047
    4    HB3  SER 768           HB3      SER 768  30.980 -21.218  -2.493
    5    HG   SER 768           HG       SER 768  33.125 -19.608  -2.373

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA 769           H        ALA 769  29.314 -18.414  -1.115
    2    HA   ALA 769           HA       ALA 769  27.004 -18.744  -2.854
    3    HB3  ALA 769           HB1      ALA 769  26.826 -19.980  -0.782
    4    HB1  ALA 769           HB2      ALA 769  25.714 -18.584  -0.809
    5    HB2  ALA 769           HB3      ALA 769  27.194 -18.504   0.133

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLU 770           H        GLU 770  25.853 -17.108  -3.368
    2    HA   GLU 770           HA       GLU 770  25.106 -15.151  -3.748
    3    HB2  GLU 770           HB2      GLU 770  25.206 -15.121  -0.790
    4    HB3  GLU 770           HB3      GLU 770  24.456 -13.820  -1.710
    5    HG2  GLU 770           HG2      GLU 770  22.819 -15.472  -1.002
    6    HG3  GLU 770           HG3      GLU 770  22.970 -15.431  -2.783

  No H/Q in entry =           6
  In of MODEL   47
    1    H    LYS 771           H        LYS 771  25.671 -13.506  -4.718
    2    HA   LYS 771           HA       LYS 771  28.215 -12.302  -4.003
    3    HB2  LYS 771           HB2      LYS 771  26.723 -11.440  -6.446
    4    HB3  LYS 771           HB3      LYS 771  28.440 -11.648  -6.161
    5    HG2  LYS 771           HG2      LYS 771  26.469 -13.893  -6.553
    6    HG3  LYS 771           HG3      LYS 771  27.576 -13.294  -7.783
    7    HD2  LYS 771           HD2      LYS 771  29.371 -14.360  -6.840
    8    HD3  LYS 771           HD3      LYS 771  28.761 -14.131  -5.200
    9    HE2  LYS 771           HE2      LYS 771  28.713 -16.488  -5.806
   10    HE3  LYS 771           HE3      LYS 771  27.101 -15.840  -5.540
   11    HZ1  LYS 771           HZ1      LYS 771  28.319 -16.254  -8.243
   12    HZ3  LYS 771           HZ2      LYS 771  26.733 -15.754  -7.936
   13    HZ2  LYS 771           HZ3      LYS 771  27.226 -17.284  -7.517

  No H/Q in entry =          13
  In of MODEL   47
    1    H    ALA 772           H        ALA 772  28.127 -10.345  -3.031
    2    HA   ALA 772           HA       ALA 772  25.675  -8.813  -3.222
    3    HB2  ALA 772           HB1      ALA 772  26.800  -9.728  -0.580
    4    HB3  ALA 772           HB2      ALA 772  25.311 -10.313  -1.326
    5    HB1  ALA 772           HB3      ALA 772  25.437  -8.631  -0.807

  No H/Q in entry =           5
  In of MODEL   47
    1    H    CYS 773           H        CYS 773  25.895  -6.768  -2.057
    2    HA   CYS 773           HA       CYS 773  28.276  -5.462  -2.886
    3    HB2  CYS 773           HB2      CYS 773  26.069  -4.388  -2.967
    4    HB3  CYS 773           HB3      CYS 773  25.946  -4.494  -1.218

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLY 774           H        GLY 774  29.993  -4.896  -1.700
    2    HA3  GLY 774           HA2      GLY 774  30.655  -4.100   0.572
    3    HA2  GLY 774           HA3      GLY 774  30.007  -5.638   1.137

  No H/Q in entry =           3
  In of MODEL   47
    1    H    ALA 775           H        ALA 775  30.983  -6.982  -1.336
    2    HA   ALA 775           HA       ALA 775  33.815  -6.562  -1.417
    3    HB3  ALA 775           HB1      ALA 775  33.640  -7.935   0.620
    4    HB1  ALA 775           HB2      ALA 775  34.476  -8.794  -0.674
    5    HB2  ALA 775           HB3      ALA 775  32.797  -9.182  -0.300

  No H/Q in entry =           5
  In of MODEL   47
    1    H    CYS 776           H        CYS 776  33.679  -6.342  -3.563
    2    HA   CYS 776           HA       CYS 776  34.129  -8.508  -5.236
    3    HB2  CYS 776           HB2      CYS 776  32.062  -8.599  -6.626
    4    HB3  CYS 776           HB3      CYS 776  31.761  -9.125  -4.979

  No H/Q in entry =           4
  In of MODEL   47
    1    HA   PRO 777           HA       PRO 777  33.767  -3.833  -6.831
    2    HB2  PRO 777           HB2      PRO 777  36.079  -2.638  -6.281
    3    HB3  PRO 777           HB3      PRO 777  34.803  -2.773  -5.063
    4    HG2  PRO 777           HG2      PRO 777  37.227  -4.503  -5.449
    5    HG3  PRO 777           HG3      PRO 777  36.641  -3.736  -3.960
    6    HD2  PRO 777           HD2      PRO 777  36.125  -6.319  -4.519
    7    HD3  PRO 777           HD3      PRO 777  34.957  -5.270  -3.677

  No H/Q in entry =           7
  In of MODEL   47
    1    H    LEU 778           H        LEU 778  35.988  -6.263  -7.376
    2    HA   LEU 778           HA       LEU 778  37.183  -4.872  -9.632
    3    HB2  LEU 778           HB2      LEU 778  38.816  -6.620  -9.812
    4    HB3  LEU 778           HB3      LEU 778  38.730  -5.931  -8.198
    5    HG   LEU 778           HG       LEU 778  37.476  -8.592  -8.875
    6   HD12  LEU 778          HD11      LEU 778  40.286  -8.100  -7.858
    7   HD11  LEU 778          HD12      LEU 778  39.849  -8.731  -9.445
    8   HD13  LEU 778          HD13      LEU 778  39.511  -9.678  -8.011
    9   HD22  LEU 778          HD21      LEU 778  36.732  -7.614  -6.759
   10   HD21  LEU 778          HD22      LEU 778  38.405  -7.351  -6.277
   11   HD23  LEU 778          HD23      LEU 778  37.787  -8.992  -6.451

  No H/Q in entry =          11
  In of MODEL   47
    1    H    TRP 779           H        TRP 779  34.914  -7.389  -9.048
    2    HA   TRP 779           HA       TRP 779  34.788  -7.818 -11.956
    3    HB2  TRP 779           HB2      TRP 779  33.935 -10.118 -11.450
    4    HB3  TRP 779           HB3      TRP 779  35.610  -9.852 -11.017
    5    HD1  TRP 779           HD1      TRP 779  32.159  -9.827  -9.183
    6    HE1  TRP 779           HE1      TRP 779  32.521 -10.841  -6.845
    7    HE3  TRP 779           HE3      TRP 779  37.191 -10.642  -9.412
    8    HZ2  TRP 779           HZ2      TRP 779  34.661 -11.859  -5.306
    9    HZ3  TRP 779           HZ3      TRP 779  38.308 -11.640  -7.474
   10    HH2  TRP 779           HH2      TRP 779  37.067 -12.232  -5.468

  No H/Q in entry =          10
  In of MODEL   47
    1    H    GLY 780           H        GLY 780  33.351  -6.481  -9.446
    2    HA3  GLY 780           HA2      GLY 780  30.726  -6.687 -10.694
    3    HA2  GLY 780           HA3      GLY 780  30.879  -7.059  -8.978

  No H/Q in entry =           3
  In of MODEL   47
    1    H    LYS 781           H        LYS 781  29.416  -4.970 -10.276
    2    HA   LYS 781           HA       LYS 781  30.821  -2.672  -9.131
    3    HB2  LYS 781           HB2      LYS 781  30.399  -2.677 -11.669
    4    HB3  LYS 781           HB3      LYS 781  28.697  -2.587 -11.270
    5    HG2  LYS 781           HG2      LYS 781  29.538  -0.376 -11.813
    6    HG3  LYS 781           HG3      LYS 781  29.073  -0.452 -10.114
    7    HD2  LYS 781           HD2      LYS 781  31.188   0.760 -10.444
    8    HD3  LYS 781           HD3      LYS 781  31.418  -0.687  -9.471
    9    HE2  LYS 781           HE2      LYS 781  32.293  -1.872 -11.436
   10    HE3  LYS 781           HE3      LYS 781  32.024  -0.435 -12.426
   11    HZ2  LYS 781           HZ1      LYS 781  34.358  -0.662 -11.673
   12    HZ1  LYS 781           HZ2      LYS 781  33.844  -0.552 -10.079
   13    HZ3  LYS 781           HZ3      LYS 781  33.636   0.745 -11.119

  No H/Q in entry =          13
  In of MODEL   47
    1    H    CYS 782           H        CYS 782  29.790  -1.858  -7.414
    2    HA   CYS 782           HA       CYS 782  27.127  -2.893  -6.950
    3    HB2  CYS 782           HB2      CYS 782  27.535  -2.300  -4.548
    4    HB3  CYS 782           HB3      CYS 782  28.593  -3.548  -5.191

  No H/Q in entry =           4
  In of MODEL   47
    1    H    ASP 783           H        ASP 783  26.077  -1.440  -8.237
    2    HA   ASP 783           HA       ASP 783  25.316   0.891  -6.808
    3    HB2  ASP 783           HB2      ASP 783  27.215   1.825  -8.076
    4    HB3  ASP 783           HB3      ASP 783  26.481   1.285  -9.584

  No H/Q in entry =           4
  In of MODEL   47
    1    H    ALA 784           H        ALA 784  23.674  -0.467  -6.685
    2    HA   ALA 784           HA       ALA 784  21.374   0.058  -8.013
    3    HB2  ALA 784           HB1      ALA 784  22.562  -2.585  -8.951
    4    HB3  ALA 784           HB2      ALA 784  22.257  -1.184  -9.979
    5    HB1  ALA 784           HB3      ALA 784  20.909  -2.046  -9.238

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLU 785           H        GLU 785  20.272  -0.130  -6.167
    2    HA   GLU 785           HA       GLU 785  19.144  -1.014  -4.472
    3    HB2  GLU 785           HB2      GLU 785  20.252  -3.603  -5.491
    4    HB3  GLU 785           HB3      GLU 785  19.332  -3.556  -3.997
    5    HG2  GLU 785           HG2      GLU 785  17.931  -4.241  -5.836
    6    HG3  GLU 785           HG3      GLU 785  17.405  -2.678  -5.239

  No H/Q in entry =           6
  In of MODEL   47
    1    H    SER 786           H        SER 786  22.520  -1.782  -4.560
    2    HA   SER 786           HA       SER 786  24.189  -1.660  -3.055
    3    HB2  SER 786           HB2      SER 786  22.156  -0.308  -1.261
    4    HB3  SER 786           HB3      SER 786  23.880  -0.427  -0.901
    5    HG   SER 786           HG       SER 786  24.287   0.673  -2.836

  No H/Q in entry =           5
  In of MODEL   47
    1    H    SER 787           H        SER 787  21.627  -3.625  -2.596
    2    HA   SER 787           HA       SER 787  22.739  -5.000  -0.307
    3    HB2  SER 787           HB2      SER 787  20.714  -6.507  -0.885
    4    HB3  SER 787           HB3      SER 787  20.368  -4.868  -0.318
    5    HG   SER 787           HG       SER 787  19.148  -5.282  -2.175

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LYS 788           H        LYS 788  21.729  -5.704  -3.543
    2    HA   LYS 788           HA       LYS 788  23.438  -7.985  -3.931
    3    HB2  LYS 788           HB2      LYS 788  22.487  -7.981  -6.174
    4    HB3  LYS 788           HB3      LYS 788  21.227  -7.882  -4.948
    5    HG2  LYS 788           HG2      LYS 788  21.001  -5.504  -5.317
    6    HG3  LYS 788           HG3      LYS 788  22.320  -5.530  -6.488
    7    HD2  LYS 788           HD2      LYS 788  19.790  -7.096  -6.745
    8    HD3  LYS 788           HD3      LYS 788  20.012  -5.493  -7.457
    9    HE2  LYS 788           HE2      LYS 788  21.903  -6.390  -8.797
   10    HE3  LYS 788           HE3      LYS 788  21.633  -7.979  -8.086
   11    HZ3  LYS 788           HZ1      LYS 788  19.442  -8.047  -9.069
   12    HZ2  LYS 788           HZ2      LYS 788  20.571  -7.733 -10.284
   13    HZ1  LYS 788           HZ3      LYS 788  19.621  -6.494  -9.683

  No H/Q in entry =          13
  In of MODEL   47
    1    H    CYS 789           H        CYS 789  24.774  -7.968  -5.999
    2    HA   CYS 789           HA       CYS 789  25.852  -5.337  -6.574
    3    HB2  CYS 789           HB2      CYS 789  28.034  -6.434  -6.978
    4    HB3  CYS 789           HB3      CYS 789  27.522  -6.605  -5.304

  No H/Q in entry =           4
  In of MODEL   47
    1    H    VAL 790           H        VAL 790  26.518  -5.171  -8.815
    2    HA   VAL 790           HA       VAL 790  25.024  -7.018 -10.503
    3    HB   VAL 790           HB       VAL 790  25.999  -4.195 -10.877
    4   HG13  VAL 790          HG11      VAL 790  25.057  -4.207 -13.154
    5   HG12  VAL 790          HG12      VAL 790  24.626  -5.900 -12.955
    6   HG11  VAL 790          HG13      VAL 790  26.326  -5.431 -13.015
    7   HG21  VAL 790          HG21      VAL 790  23.930  -4.402  -9.656
    8   HG23  VAL 790          HG22      VAL 790  23.232  -5.366 -10.956
    9   HG22  VAL 790          HG23      VAL 790  23.633  -3.673 -11.233

  No H/Q in entry =           9
  In of MODEL   47
    1    H    CYS 791           H        CYS 791  26.083  -8.087 -12.081
    2    HA   CYS 791           HA       CYS 791  28.952  -8.251 -11.600
    3    HB2  CYS 791           HB2      CYS 791  28.833 -10.468 -12.696
    4    HB3  CYS 791           HB3      CYS 791  27.813 -10.360 -11.270

  No H/Q in entry =           4
  In of MODEL   47
    1    H    ARG 792           H        ARG 792  30.344  -7.757 -13.034
    2    HA   ARG 792           HA       ARG 792  29.327  -6.853 -15.579
    3    HB2  ARG 792           HB2      ARG 792  31.545  -5.861 -13.839
    4    HB3  ARG 792           HB3      ARG 792  31.469  -5.468 -15.550
    5    HG2  ARG 792           HG2      ARG 792  29.368  -4.801 -13.481
    6    HG3  ARG 792           HG3      ARG 792  30.504  -3.671 -14.225
    7    HD2  ARG 792           HD2      ARG 792  28.236  -5.158 -15.583
    8    HD3  ARG 792           HD3      ARG 792  28.436  -3.422 -15.370
    9    HE   ARG 792           HE       ARG 792  30.585  -3.870 -16.745
   10   HH11  ARG 792          HH11      ARG 792  27.277  -4.955 -17.487
   11   HH12  ARG 792          HH12      ARG 792  27.653  -5.392 -19.079
   12   HH21  ARG 792          HH21      ARG 792  31.110  -4.558 -18.855
   13   HH22  ARG 792          HH22      ARG 792  29.916  -5.169 -19.909

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLU 793           H        GLU 793  31.479  -6.679 -17.110
    2    HA   GLU 793           HA       GLU 793  32.025  -9.504 -17.474
    3    HB2  GLU 793           HB2      GLU 793  32.332  -7.148 -19.321
    4    HB3  GLU 793           HB3      GLU 793  32.659  -8.818 -19.758
    5    HG2  GLU 793           HG2      GLU 793  30.290  -9.350 -19.277
    6    HG3  GLU 793           HG3      GLU 793  30.009  -7.636 -18.984

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ALA 794           H        ALA 794  34.229  -9.528 -18.897
    2    HA   ALA 794           HA       ALA 794  36.271  -9.046 -16.951
    3    HB2  ALA 794           HB1      ALA 794  36.214 -11.064 -18.322
    4    HB3  ALA 794           HB2      ALA 794  37.725 -10.163 -18.521
    5    HB1  ALA 794           HB3      ALA 794  36.465 -10.068 -19.760

  No H/Q in entry =           5
  In of MODEL   47
    1    H    SER 795           H        SER 795  34.876  -7.178 -19.313
    2    HA   SER 795           HA       SER 795  37.024  -5.785 -20.453
    3    HB2  SER 795           HB2      SER 795  34.246  -4.784 -19.847
    4    HB3  SER 795           HB3      SER 795  35.332  -4.203 -21.118
    5    HG   SER 795           HG       SER 795  35.196  -6.680 -21.635

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLU 796           H        GLU 796  35.115  -5.343 -17.540
    2    HA   GLU 796           HA       GLU 796  36.705  -3.031 -16.876
    3    HB2  GLU 796           HB2      GLU 796  35.138  -2.980 -14.795
    4    HB3  GLU 796           HB3      GLU 796  34.576  -2.412 -16.355
    5    HG2  GLU 796           HG2      GLU 796  34.093  -5.235 -15.623
    6    HG3  GLU 796           HG3      GLU 796  33.126  -3.975 -14.849

  No H/Q in entry =           6
  In of MODEL   47
    1    H    CYS 797           H        CYS 797  38.238  -5.033 -16.924
    2    HA   CYS 797           HA       CYS 797  38.693  -6.022 -14.238
    3    HB2  CYS 797           HB2      CYS 797  39.114  -7.437 -16.158
    4    HB3  CYS 797           HB3      CYS 797  40.280  -6.278 -16.814

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLU 798           H        GLU 798  38.537  -3.752 -13.749
    2    HA   GLU 798           HA       GLU 798  40.561  -1.855 -14.389
    3    HB2  GLU 798           HB2      GLU 798  39.353  -0.417 -12.729
    4    HB3  GLU 798           HB3      GLU 798  38.369  -1.040 -14.043
    5    HG2  GLU 798           HG2      GLU 798  37.493  -2.785 -12.538
    6    HG3  GLU 798           HG3      GLU 798  38.459  -2.113 -11.226

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU 799           H        GLU 799  40.034  -3.936 -11.650
    2    HA   GLU 799           HA       GLU 799  42.089  -2.648 -10.086
    3    HB2  GLU 799           HB2      GLU 799  40.057  -3.659  -9.048
    4    HB3  GLU 799           HB3      GLU 799  40.576  -5.236  -9.616
    5    HG2  GLU 799           HG2      GLU 799  40.992  -4.827  -7.210
    6    HG3  GLU 799           HG3      GLU 799  42.441  -5.226  -8.130

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLU 800           H        GLU 800  43.915  -4.215  -9.189
    2    HA   GLU 800           HA       GLU 800  45.515  -4.868 -11.332
    3    HB2  GLU 800           HB2      GLU 800  45.724  -5.855  -8.492
    4    HB3  GLU 800           HB3      GLU 800  46.931  -6.197  -9.719
    5    HG2  GLU 800           HG2      GLU 800  47.121  -3.687 -10.031
    6    HG3  GLU 800           HG3      GLU 800  46.170  -3.542  -8.553

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLY 801           H        GLY 801  43.965  -7.409  -9.202
    2    HA3  GLY 801           HA2      GLY 801  43.074  -9.287  -9.761
    3    HA2  GLY 801           HA3      GLY 801  43.079  -8.803 -11.448

  No H/Q in entry =           3
  In of MODEL   47
    1    H    PHE 802           H        PHE 802  44.161 -11.050  -9.411
    2    HA   PHE 802           HA       PHE 802  46.735 -11.478 -10.517
    3    HB2  PHE 802           HB2      PHE 802  44.977 -13.064  -8.703
    4    HB3  PHE 802           HB3      PHE 802  46.446 -13.763  -9.371
    5    HD1  PHE 802           HD1      PHE 802  47.814 -13.981  -7.586
    6    HD2  PHE 802           HD2      PHE 802  45.828 -10.297  -8.189
    7    HE1  PHE 802           HE1      PHE 802  49.125 -13.022  -5.833
    8    HE2  PHE 802           HE2      PHE 802  47.136  -9.279  -6.428
    9    HZ   PHE 802           HZ       PHE 802  48.818 -10.633  -5.198

  No H/Q in entry =           9
  In of MODEL   47
    1    H    SER 803           H        SER 803  47.212 -13.737 -11.409
    2    HA   SER 803           HA       SER 803  45.161 -14.407 -13.362
    3    HB2  SER 803           HB2      SER 803  48.135 -14.977 -13.528
    4    HB3  SER 803           HB3      SER 803  46.914 -15.119 -14.803
    5    HG   SER 803           HG       SER 803  46.660 -12.692 -14.151

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ILE 804           H        ILE 804  44.159 -16.205 -12.785
    2    HA   ILE 804           HA       ILE 804  45.641 -18.229 -11.254
    3    HB   ILE 804           HB       ILE 804  43.655 -18.920 -10.079
    4   HG12  ILE 804          HG12      ILE 804  41.965 -18.398 -11.892
    5   HG13  ILE 804          HG13      ILE 804  41.453 -17.964 -10.272
    6   HG23  ILE 804          HG21      ILE 804  43.182 -16.976  -8.689
    7   HG22  ILE 804          HG22      ILE 804  43.909 -15.938  -9.908
    8   HG21  ILE 804          HG23      ILE 804  44.903 -17.125  -9.057
    9   HD13  ILE 804          HD11      ILE 804  40.777 -16.276 -11.830
   10   HD12  ILE 804          HD12      ILE 804  42.405 -16.099 -12.446
   11   HD11  ILE 804          HD13      ILE 804  42.030 -15.601 -10.791

  No H/Q in entry =          11
  In of MODEL   47
    1    H    CYS 805           H        CYS 805  44.660 -20.439 -11.487
    2    HA   CYS 805           HA       CYS 805  43.947 -20.862 -14.323
    3    HB2  CYS 805           HB2      CYS 805  46.060 -21.931 -13.566
    4    HB3  CYS 805           HB3      CYS 805  45.173 -22.723 -12.270

  No H/Q in entry =           4
  In of MODEL   47
    1    H    VAL 806           H        VAL 806  42.062 -21.401 -14.772
    2    HA   VAL 806           HA       VAL 806  40.520 -22.703 -12.692
    3    HB   VAL 806           HB       VAL 806  39.964 -20.324 -12.646
    4   HG11  VAL 806          HG11      VAL 806  39.273 -20.620 -15.514
    5   HG13  VAL 806          HG12      VAL 806  40.610 -19.708 -14.816
    6   HG12  VAL 806          HG13      VAL 806  38.941 -19.205 -14.513
    7   HG21  VAL 806          HG21      VAL 806  38.147 -21.900 -12.203
    8   HG23  VAL 806          HG22      VAL 806  37.727 -21.884 -13.916
    9   HG22  VAL 806          HG23      VAL 806  37.584 -20.407 -12.947

  No H/Q in entry =           9
  In of MODEL   47
    1    H    GLU 807           H        GLU 807  39.435 -24.418 -13.293
    2    HA   GLU 807           HA       GLU 807  39.556 -25.306 -16.025
    3    HB2  GLU 807           HB2      GLU 807  39.951 -26.885 -14.173
    4    HB3  GLU 807           HB3      GLU 807  38.344 -26.551 -13.546
    5    HG2  GLU 807           HG2      GLU 807  37.448 -27.377 -15.756
    6    HG3  GLU 807           HG3      GLU 807  39.087 -27.932 -16.098

  No H/Q in entry =           6
  In of MODEL   47
    1    H    VAL 808           H        VAL 808  38.131 -24.592 -17.309
    2    HA   VAL 808           HA       VAL 808  35.336 -24.356 -16.470
    3    HB   VAL 808           HB       VAL 808  36.811 -22.473 -18.296
    4   HG12  VAL 808          HG11      VAL 808  34.012 -22.303 -17.303
    5   HG11  VAL 808          HG12      VAL 808  34.576 -22.709 -18.935
    6   HG13  VAL 808          HG13      VAL 808  34.880 -21.093 -18.271
    7   HG23  VAL 808          HG21      VAL 808  36.468 -20.737 -16.581
    8   HG22  VAL 808          HG22      VAL 808  37.618 -21.992 -16.172
    9   HG21  VAL 808          HG23      VAL 808  36.003 -22.020 -15.454

  No H/Q in entry =           9
  In of MODEL   47
    1    H    ASN 809           H        ASN 809  34.071 -25.447 -17.895
    2    HA   ASN 809           HA       ASN 809  33.368 -26.606 -19.715
    3    HB2  ASN 809           HB2      ASN 809  35.452 -24.872 -20.932
    4    HB3  ASN 809           HB3      ASN 809  34.913 -26.234 -21.882
    5   HD21  ASN 809          HD21      ASN 809  32.768 -24.473 -19.692
    6   HD22  ASN 809          HD22      ASN 809  31.834 -23.727 -20.918

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLY 810           H        GLY 810  35.701 -27.359 -17.913
    2    HA3  GLY 810           HA2      GLY 810  36.718 -29.433 -17.577
    3    HA2  GLY 810           HA3      GLY 810  36.278 -29.854 -19.237

  No H/Q in entry =           3
  In of MODEL   47
    1    H    LYS 811           H        LYS 811  37.666 -26.823 -19.137
    2    HA   LYS 811           HA       LYS 811  40.332 -27.900 -19.765
    3    HB2  LYS 811           HB2      LYS 811  38.864 -25.582 -21.005
    4    HB3  LYS 811           HB3      LYS 811  40.518 -26.046 -21.368
    5    HG2  LYS 811           HG2      LYS 811  39.746 -28.177 -22.227
    6    HG3  LYS 811           HG3      LYS 811  38.083 -27.743 -21.832
    7    HD2  LYS 811           HD2      LYS 811  38.518 -27.398 -24.174
    8    HD3  LYS 811           HD3      LYS 811  38.232 -25.852 -23.370
    9    HE2  LYS 811           HE2      LYS 811  40.612 -25.423 -23.295
   10    HE3  LYS 811           HE3      LYS 811  40.960 -26.994 -23.995
   11    HZ2  LYS 811           HZ1      LYS 811  39.517 -24.749 -25.302
   12    HZ1  LYS 811           HZ2      LYS 811  39.713 -26.260 -25.993
   13    HZ3  LYS 811           HZ3      LYS 811  41.068 -25.286 -25.676

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLU 812           H        GLU 812  42.043 -26.641 -19.048
    2    HA   GLU 812           HA       GLU 812  41.252 -24.762 -16.954
    3    HB2  GLU 812           HB2      GLU 812  43.816 -26.284 -17.349
    4    HB3  GLU 812           HB3      GLU 812  43.616 -25.021 -16.139
    5    HG2  GLU 812           HG2      GLU 812  41.875 -26.265 -15.055
    6    HG3  GLU 812           HG3      GLU 812  41.926 -27.500 -16.311

  No H/Q in entry =           6
  In of MODEL   47
    1    H    GLN 813           H        GLN 813  41.129 -22.796 -17.561
    2    HA   GLN 813           HA       GLN 813  43.244 -21.771 -19.318
    3    HB2  GLN 813           HB2      GLN 813  41.119 -21.570 -20.390
    4    HB3  GLN 813           HB3      GLN 813  40.375 -20.862 -18.955
    5    HG2  GLN 813           HG2      GLN 813  41.755 -18.891 -19.219
    6    HG3  GLN 813           HG3      GLN 813  42.560 -19.593 -20.617
    7   HE21  GLN 813          HE21      GLN 813  39.139 -19.952 -20.077
    8   HE22  GLN 813          HE22      GLN 813  38.618 -18.927 -21.352

  No H/Q in entry =           8
  In of MODEL   47
    1    H    THR 814           H        THR 814  44.383 -19.986 -18.676
    2    HA   THR 814           HA       THR 814  44.297 -19.233 -15.912
    3    HB   THR 814           HB       THR 814  45.710 -17.805 -18.178
    4    HG1  THR 814           HG1      THR 814  47.315 -19.117 -18.047
    5   HG22  THR 814          HG21      THR 814  47.324 -17.203 -16.423
    6   HG21  THR 814          HG22      THR 814  46.350 -18.070 -15.236
    7   HG23  THR 814          HG23      THR 814  45.697 -16.640 -16.036

  No H/Q in entry =           7
  In of MODEL   47
    1    H    MET 815           H        MET 815  43.121 -17.532 -15.132
    2    HA   MET 815           HA       MET 815  42.152 -15.568 -17.085
    3    HB2  MET 815           HB2      MET 815  40.525 -16.564 -14.757
    4    HB3  MET 815           HB3      MET 815  40.039 -15.334 -15.918
    5    HG2  MET 815           HG2      MET 815  40.317 -17.201 -17.673
    6    HG3  MET 815           HG3      MET 815  40.405 -18.217 -16.232
    7    HE2  MET 815           HE1      MET 815  37.056 -19.134 -17.699
    8    HE1  MET 815           HE2      MET 815  38.711 -19.614 -17.232
    9    HE3  MET 815           HE3      MET 815  38.469 -18.555 -18.604

  No H/Q in entry =           9
  In of MODEL   47
    1    H    SER 816           H        SER 816  41.740 -13.577 -16.234
    2    HA   SER 816           HA       SER 816  43.425 -12.836 -14.054
    3    HB2  SER 816           HB2      SER 816  41.430 -11.311 -15.735
    4    HB3  SER 816           HB3      SER 816  42.602 -10.579 -14.639
    5    HG   SER 816           HG       SER 816  43.230 -12.225 -16.889

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLU 817           H        GLU 817  42.642 -12.102 -12.051
    2    HA   GLU 817           HA       GLU 817  40.582 -13.372 -10.828
    3    HB2  GLU 817           HB2      GLU 817  42.118 -11.001 -10.257
    4    HB3  GLU 817           HB3      GLU 817  40.716 -11.137  -9.230
    5    HG2  GLU 817           HG2      GLU 817  41.512 -13.472  -8.769
    6    HG3  GLU 817           HG3      GLU 817  43.015 -13.018  -9.612

  No H/Q in entry =           6
  In of MODEL   47
    1    H    CYS 818           H        CYS 818  40.327 -10.186 -12.312
    2    HA   CYS 818           HA       CYS 818  37.678  -9.759 -11.470
    3    HB2  CYS 818           HB2      CYS 818  39.014  -8.588 -13.909
    4    HB3  CYS 818           HB3      CYS 818  37.655  -7.915 -13.007

  No H/Q in entry =           4
  In of MODEL   47
    1    H    GLU 819           H        GLU 819  38.998 -11.720 -13.989
    2    HA   GLU 819           HA       GLU 819  36.582 -11.753 -15.603
    3    HB2  GLU 819           HB2      GLU 819  38.780 -11.857 -16.668
    4    HB3  GLU 819           HB3      GLU 819  39.135 -13.344 -15.793
    5    HG2  GLU 819           HG2      GLU 819  37.453 -14.490 -17.047
    6    HG3  GLU 819           HG3      GLU 819  36.970 -12.989 -17.848

  No H/Q in entry =           6
  In of MODEL   47
    1    H    ALA 820           H        ALA 820  38.583 -14.182 -13.941
    2    HA   ALA 820           HA       ALA 820  36.842 -16.299 -14.021
    3    HB3  ALA 820           HB1      ALA 820  38.840 -15.596 -11.891
    4    HB1  ALA 820           HB2      ALA 820  39.125 -16.565 -13.343
    5    HB2  ALA 820           HB3      ALA 820  38.079 -17.174 -12.061

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLY 821           H        GLY 821  37.153 -13.600 -11.774
    2    HA3  GLY 821           HA2      GLY 821  35.255 -14.494  -9.859
    3    HA2  GLY 821           HA3      GLY 821  35.965 -12.883  -9.964

  No H/Q in entry =           3
  In of MODEL   47
    1    H    ALA 822           H        ALA 822  35.096 -12.285 -12.658
    2    HA   ALA 822           HA       ALA 822  32.472 -11.403 -12.160
    3    HB3  ALA 822           HB1      ALA 822  32.441 -10.733 -14.524
    4    HB1  ALA 822           HB2      ALA 822  33.852 -11.744 -14.841
    5    HB2  ALA 822           HB3      ALA 822  34.014 -10.326 -13.830

  No H/Q in entry =           5
  In of MODEL   47
    1    H    LEU 823           H        LEU 823  33.804 -14.103 -13.817
    2    HA   LEU 823           HA       LEU 823  31.408 -15.200 -14.713
    3    HB2  LEU 823           HB2      LEU 823  34.054 -16.490 -14.063
    4    HB3  LEU 823           HB3      LEU 823  32.761 -17.287 -14.940
    5    HG   LEU 823           HG       LEU 823  34.136 -14.762 -15.867
    6   HD12  LEU 823          HD11      LEU 823  34.564 -17.572 -16.844
    7   HD11  LEU 823          HD12      LEU 823  35.700 -16.573 -15.907
    8   HD13  LEU 823          HD13      LEU 823  35.252 -16.088 -17.522
    9   HD21  LEU 823          HD21      LEU 823  32.141 -16.564 -17.298
   10   HD23  LEU 823          HD22      LEU 823  33.055 -15.248 -18.024
   11   HD22  LEU 823          HD23      LEU 823  31.900 -14.904 -16.750

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ARG 824           H        ARG 824  33.240 -15.829 -11.659
    2    HA   ARG 824           HA       ARG 824  31.346 -17.585 -10.523
    3    HB2  ARG 824           HB2      ARG 824  33.213 -15.620  -9.206
    4    HB3  ARG 824           HB3      ARG 824  32.161 -16.693  -8.300
    5    HG2  ARG 824           HG2      ARG 824  33.304 -18.608  -9.260
    6    HG3  ARG 824           HG3      ARG 824  34.392 -17.512 -10.145
    7    HD2  ARG 824           HD2      ARG 824  35.169 -16.611  -8.045
    8    HD3  ARG 824           HD3      ARG 824  33.973 -17.593  -7.195
    9    HE   ARG 824           HE       ARG 824  35.565 -19.232  -8.744
   10   HH11  ARG 824          HH11      ARG 824  35.807 -17.280  -5.778
   11   HH12  ARG 824          HH12      ARG 824  36.951 -18.282  -5.000
   12   HH21  ARG 824          HH21      ARG 824  37.099 -20.643  -7.631
   13   HH22  ARG 824          HH22      ARG 824  37.699 -20.256  -6.084

  No H/Q in entry =          13
  In of MODEL   47
    1    H    CYS 825           H        CYS 825  31.424 -14.119 -10.703
    2    HA   CYS 825           HA       CYS 825  29.365 -13.684  -8.827
    3    HB2  CYS 825           HB2      CYS 825  31.123 -12.016  -9.500
    4    HB3  CYS 825           HB3      CYS 825  30.275 -11.824 -11.028

  No H/Q in entry =           4
  In of MODEL   47
    1    H    ARG 826           H        ARG 826  29.381 -13.956 -12.376
    2    HA   ARG 826           HA       ARG 826  26.590 -13.353 -12.587
    3    HB2  ARG 826           HB2      ARG 826  26.778 -14.116 -14.928
    4    HB3  ARG 826           HB3      ARG 826  27.924 -12.838 -14.504
    5    HG2  ARG 826           HG2      ARG 826  29.684 -14.388 -14.461
    6    HG3  ARG 826           HG3      ARG 826  28.577 -15.761 -14.587
    7    HD2  ARG 826           HD2      ARG 826  28.964 -13.629 -16.689
    8    HD3  ARG 826           HD3      ARG 826  29.682 -15.242 -16.734
    9    HE   ARG 826           HE       ARG 826  26.851 -15.337 -16.418
   10   HH11  ARG 826          HH11      ARG 826  29.366 -14.936 -18.910
   11   HH12  ARG 826          HH12      ARG 826  28.389 -15.542 -20.140
   12   HH21  ARG 826          HH21      ARG 826  25.553 -16.145 -18.120
   13   HH22  ARG 826          HH22      ARG 826  26.171 -16.253 -19.699

  No H/Q in entry =          13
  In of MODEL   47
    1    H    GLY 827           H        GLY 827  28.247 -16.227 -11.840
    2    HA3  GLY 827           HA2      GLY 827  27.062 -18.146 -11.073
    3    HA2  GLY 827           HA3      GLY 827  25.708 -17.681 -12.094

  No H/Q in entry =           3
  In of MODEL   47
    1    H    GLN 828           H        GLN 828  28.772 -17.415 -13.476
    2    HA   GLN 828           HA       GLN 828  28.370 -19.350 -15.535
    3    HB2  GLN 828           HB2      GLN 828  29.818 -17.272 -15.607
    4    HB3  GLN 828           HB3      GLN 828  30.935 -18.105 -14.545
    5    HG2  GLN 828           HG2      GLN 828  31.929 -18.445 -16.584
    6    HG3  GLN 828           HG3      GLN 828  30.930 -19.883 -16.468
    7   HE21  GLN 828          HE21      GLN 828  29.174 -20.081 -17.787
    8   HE22  GLN 828          HE22      GLN 828  28.922 -19.010 -19.129

  No H/Q in entry =           8
  In of MODEL   47
    1    H    SER 829           H        SER 829  29.485 -21.415 -15.689
    2    HA   SER 829           HA       SER 829  30.264 -22.516 -13.130
    3    HB2  SER 829           HB2      SER 829  29.977 -23.865 -15.819
    4    HB3  SER 829           HB3      SER 829  30.091 -24.661 -14.246
    5    HG   SER 829           HG       SER 829  27.999 -23.085 -15.297

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ILE 830           H        ILE 830  32.258 -22.171 -12.571
    2    HA   ILE 830           HA       ILE 830  34.531 -22.710 -14.374
    3    HB   ILE 830           HB       ILE 830  35.739 -20.743 -13.610
    4   HG12  ILE 830          HG12      ILE 830  34.651 -20.532 -11.330
    5   HG13  ILE 830          HG13      ILE 830  34.896 -18.983 -12.084
    6   HG22  ILE 830          HG21      ILE 830  34.496 -18.905 -14.669
    7   HG21  ILE 830          HG22      ILE 830  33.061 -19.940 -14.677
    8   HG23  ILE 830          HG23      ILE 830  34.486 -20.403 -15.603
    9   HD13  ILE 830          HD11      ILE 830  32.763 -18.999 -11.047
   10   HD12  ILE 830          HD12      ILE 830  32.323 -20.513 -11.830
   11   HD11  ILE 830          HD13      ILE 830  32.502 -19.042 -12.789

  No H/Q in entry =          11
  In of MODEL   47
    1    H    SER 831           H        SER 831  36.152 -23.771 -13.248
    2    HA   SER 831           HA       SER 831  35.745 -24.131 -10.373
    3    HB2  SER 831           HB2      SER 831  36.697 -26.041 -12.479
    4    HB3  SER 831           HB3      SER 831  36.620 -26.375 -10.754
    5    HG   SER 831           HG       SER 831  34.717 -26.550 -12.623

  No H/Q in entry =           5
  In of MODEL   47
    1    H    VAL 832           H        VAL 832  37.340 -22.711  -9.627
    2    HA   VAL 832           HA       VAL 832  39.874 -22.437 -10.872
    3    HB   VAL 832           HB       VAL 832  38.983 -21.653  -8.078
    4   HG12  VAL 832          HG11      VAL 832  41.537 -20.896  -9.533
    5   HG11  VAL 832          HG12      VAL 832  41.435 -21.951  -8.123
    6   HG13  VAL 832          HG13      VAL 832  41.012 -20.246  -7.981
    7   HG22  VAL 832          HG21      VAL 832  38.924 -19.389  -8.988
    8   HG21  VAL 832          HG22      VAL 832  37.870 -20.467  -9.910
    9   HG23  VAL 832          HG23      VAL 832  39.439 -19.999 -10.559

  No H/Q in entry =           9
  In of MODEL   47
    1    H    THR 833           H        THR 833  41.439 -23.884 -10.968
    2    HA   THR 833           HA       THR 833  41.410 -26.082  -9.130
    3    HB   THR 833           HB       THR 833  43.281 -26.936 -10.621
    4    HG1  THR 833           HG1      THR 833  43.339 -25.843 -12.708
    5   HG23  THR 833          HG21      THR 833  40.965 -27.668 -10.937
    6   HG22  THR 833          HG22      THR 833  41.766 -27.485 -12.499
    7   HG21  THR 833          HG23      THR 833  40.644 -26.251 -11.936

  No H/Q in entry =           7
  In of MODEL   47
    1    H    SER 834           H        SER 834  43.451 -23.328  -9.947
    2    HA   SER 834           HA       SER 834  44.613 -23.480  -7.345
    3    HB2  SER 834           HB2      SER 834  46.054 -25.009  -8.712
    4    HB3  SER 834           HB3      SER 834  46.459 -23.633  -9.743
    5    HG   SER 834           HG       SER 834  47.358 -24.336  -7.285

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ILE 835           H        ILE 835  45.977 -21.633  -6.980
    2    HA   ILE 835           HA       ILE 835  44.792 -19.367  -8.324
    3    HB   ILE 835           HB       ILE 835  45.679 -18.022  -6.394
    4   HG12  ILE 835          HG12      ILE 835  46.045 -19.425  -4.276
    5   HG13  ILE 835          HG13      ILE 835  46.366 -20.768  -5.363
    6   HG21  ILE 835          HG21      ILE 835  43.387 -18.766  -6.572
    7   HG23  ILE 835          HG22      ILE 835  43.957 -18.768  -4.894
    8   HG22  ILE 835          HG23      ILE 835  43.840 -20.288  -5.792
    9   HD11  ILE 835          HD11      ILE 835  47.828 -18.192  -5.248
   10   HD13  ILE 835          HD12      ILE 835  48.230 -19.558  -6.299
   11   HD12  ILE 835          HD13      ILE 835  48.386 -19.708  -4.532

  No H/Q in entry =          11
  In of MODEL   47
    1    H    ARG 836           H        ARG 836  47.320 -21.080  -8.870
    2    HA   ARG 836           HA       ARG 836  48.935 -18.801  -9.651
    3    HB2  ARG 836           HB2      ARG 836  50.737 -20.501 -10.063
    4    HB3  ARG 836           HB3      ARG 836  50.294 -20.213  -8.393
    5    HG2  ARG 836           HG2      ARG 836  48.973 -22.282  -8.429
    6    HG3  ARG 836           HG3      ARG 836  49.531 -22.566 -10.087
    7    HD2  ARG 836           HD2      ARG 836  51.777 -22.472  -9.396
    8    HD3  ARG 836           HD3      ARG 836  51.307 -22.087  -7.750
    9    HE   ARG 836           HE       ARG 836  50.049 -24.467  -8.311
   10   HH11  ARG 836          HH11      ARG 836  53.470 -23.441  -8.181
   11   HH12  ARG 836          HH12      ARG 836  54.039 -24.931  -7.604
   12   HH21  ARG 836          HH21      ARG 836  50.852 -26.507  -7.491
   13   HH22  ARG 836          HH22      ARG 836  52.516 -26.735  -7.233

  No H/Q in entry =          13
  In of MODEL   47
    1    HA   PRO 837           HA       PRO 837  47.549 -19.070 -13.715
    2    HB2  PRO 837           HB2      PRO 837  49.830 -18.495 -15.137
    3    HB3  PRO 837           HB3      PRO 837  48.833 -17.290 -14.314
    4    HG2  PRO 837           HG2      PRO 837  51.343 -18.627 -13.380
    5    HG3  PRO 837           HG3      PRO 837  50.881 -16.918 -13.262
    6    HD2  PRO 837           HD2      PRO 837  50.674 -18.542 -11.162
    7    HD3  PRO 837           HD3      PRO 837  49.442 -17.305 -11.481

  No H/Q in entry =           7
  In of MODEL   47
    1    H    CYS 838           H        CYS 838  47.464 -20.301 -15.559
    2    HA   CYS 838           HA       CYS 838  48.835 -22.862 -15.470
    3    HB2  CYS 838           HB2      CYS 838  46.354 -22.748 -15.696
    4    HB3  CYS 838           HB3      CYS 838  46.544 -21.792 -17.154

  No H/Q in entry =           4
  In of MODEL   47
    1    H    ALA 839           H        ALA 839  49.474 -23.602 -17.791
    2    HA   ALA 839           HA       ALA 839  50.962 -21.461 -19.092
    3    HB3  ALA 839           HB1      ALA 839  52.048 -23.275 -20.341
    4    HB1  ALA 839           HB2      ALA 839  50.954 -24.444 -19.604
    5    HB2  ALA 839           HB3      ALA 839  52.117 -23.577 -18.603

  No H/Q in entry =           5
  In of MODEL   47
    1    H    ALA 840           H        ALA 840  48.118 -21.603 -19.176
    2    HA   ALA 840           HA       ALA 840  47.294 -22.401 -21.857
    3    HB3  ALA 840           HB1      ALA 840  45.073 -21.699 -21.100
    4    HB1  ALA 840           HB2      ALA 840  45.772 -21.082 -19.603
    5    HB2  ALA 840           HB3      ALA 840  45.810 -22.811 -19.947

  No H/Q in entry =           5
  In of MODEL   47
    1    H    GLU 841           H        GLU 841  49.255 -20.291 -21.404
    2    HA   GLU 841           HA       GLU 841  47.999 -17.763 -21.951
    3    HB2  GLU 841           HB2      GLU 841  50.911 -18.483 -22.124
    4    HB3  GLU 841           HB3      GLU 841  50.212 -16.893 -21.892
    5    HG2  GLU 841           HG2      GLU 841  50.137 -19.137 -19.891
    6    HG3  GLU 841           HG3      GLU 841  51.235 -17.758 -19.936

  No H/Q in entry =           6
  In of MODEL   47
    1    H    THR 842           H        THR 842  47.161 -17.848 -23.797
    2    HA   THR 842           HA       THR 842  48.815 -18.352 -26.163
    3    HB   THR 842           HB       THR 842  47.648 -20.392 -25.567
    4    HG1  THR 842           HG1      THR 842  47.976 -19.495 -27.864
    5   HG21  THR 842          HG21      THR 842  45.602 -19.534 -24.596
    6   HG23  THR 842          HG22      THR 842  45.193 -20.618 -25.925
    7   HG22  THR 842          HG23      THR 842  45.100 -18.871 -26.152

  No H/Q in entry =           7
  In of MODEL   47
    1    H    GLN 843           H        GLN 843  47.398 -16.198 -24.692
    2    HA   GLN 843           HA       GLN 843  46.284 -14.911 -27.074
    3    HB2  GLN 843           HB2      GLN 843  44.499 -15.523 -25.390
    4    HB3  GLN 843           HB3      GLN 843  45.281 -14.414 -24.266
    5    HG2  GLN 843           HG2      GLN 843  43.460 -13.276 -25.281
    6    HG3  GLN 843           HG3      GLN 843  44.957 -12.602 -25.916
    7   HE21  GLN 843          HE21      GLN 843  43.988 -11.846 -27.761
    8   HE22  GLN 843          HE22      GLN 843  43.456 -12.889 -29.035

  No H/Q in entry =           8
  In of MODEL   48
    1    H1   GLY 689           H3       GLY 689  64.656 -16.627 -20.543
    2    H2   GLY 689           H2       GLY 689  63.546 -17.916 -20.547
    3    H3   GLY 689           H1       GLY 689  63.051 -16.344 -20.154
    4    HA2  GLY 689           HA2      GLY 689  64.912 -18.012 -18.590
    5    HA3  GLY 689           HA3      GLY 689  63.258 -17.603 -18.151

  No H/Q in entry =           5
  In of MODEL   48
    1    H    SER 690           H        SER 690  64.433 -16.777 -16.186
    2    HA   SER 690           HA       SER 690  64.780 -13.948 -16.537
    3    HB2  SER 690           HB2      SER 690  64.877 -15.633 -14.020
    4    HB3  SER 690           HB3      SER 690  64.804 -13.875 -14.093
    5    HG   SER 690           HG       SER 690  62.829 -15.260 -15.470

  No H/Q in entry =           5
  In of MODEL   48
    1    H    HIS 691           H        HIS 691  66.752 -13.733 -17.592
    2    HA   HIS 691           HA       HIS 691  69.155 -14.880 -16.502
    3    HB2  HIS 691           HB2      HIS 691  68.939 -14.215 -18.930
    4    HB3  HIS 691           HB3      HIS 691  68.868 -12.530 -18.424
    5    HD1  HIS 691           HD1      HIS 691  71.244 -15.393 -18.878
    6    HD2  HIS 691           HD2      HIS 691  71.353 -11.421 -17.677
    7    HE1  HIS 691           HE1      HIS 691  73.660 -14.753 -18.887
    8    HE2  HIS 691           HE2      HIS 691  73.593 -12.276 -18.584

  No H/Q in entry =           8
  In of MODEL   48
    1    H    MET 692           H        MET 692  70.018 -14.199 -14.651
    2    HA   MET 692           HA       MET 692  69.001 -11.705 -13.560
    3    HB2  MET 692           HB2      MET 692  70.345 -14.011 -12.174
    4    HB3  MET 692           HB3      MET 692  69.785 -12.553 -11.371
    5    HG2  MET 692           HG2      MET 692  68.100 -14.588 -12.820
    6    HG3  MET 692           HG3      MET 692  68.166 -14.316 -11.081
    7    HE1  MET 692           HE1      MET 692  67.254 -12.096  -9.907
    8    HE3  MET 692           HE2      MET 692  66.510 -10.756 -10.777
    9    HE2  MET 692           HE3      MET 692  68.231 -11.086 -10.975

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ASN 693           H        ASN 693  71.785 -12.689 -15.072
    2    HA   ASN 693           HA       ASN 693  73.570 -11.057 -13.515
    3    HB2  ASN 693           HB2      ASN 693  73.930 -12.164 -16.320
    4    HB3  ASN 693           HB3      ASN 693  75.165 -11.263 -15.458
    5   HD21  ASN 693          HD21      ASN 693  76.140 -12.255 -13.619
    6   HD22  ASN 693          HD22      ASN 693  76.112 -13.962 -13.450

  No H/Q in entry =           6
  In of MODEL   48
    1    HA   PRO 694           HA       PRO 694  72.112  -7.046 -14.337
    2    HB2  PRO 694           HB2      PRO 694  75.014  -6.585 -14.841
    3    HB3  PRO 694           HB3      PRO 694  73.865  -5.600 -13.930
    4    HG2  PRO 694           HG2      PRO 694  75.534  -7.271 -12.687
    5    HG3  PRO 694           HG3      PRO 694  73.875  -7.027 -12.117
    6    HD2  PRO 694           HD2      PRO 694  75.082  -9.375 -13.419
    7    HD3  PRO 694           HD3      PRO 694  73.626  -9.258 -12.408

  No H/Q in entry =           7
  In of MODEL   48
    1    H    LEU 695           H        LEU 695  70.993  -6.842 -16.182
    2    HA   LEU 695           HA       LEU 695  72.442  -6.543 -18.714
    3    HB2  LEU 695           HB2      LEU 695  69.447  -6.501 -18.204
    4    HB3  LEU 695           HB3      LEU 695  70.200  -6.359 -19.764
    5    HG   LEU 695           HG       LEU 695  69.350  -8.486 -19.728
    6   HD11  LEU 695          HD11      LEU 695  71.564  -8.534 -20.566
    7   HD13  LEU 695          HD12      LEU 695  71.202 -10.037 -19.717
    8   HD12  LEU 695          HD13      LEU 695  72.213  -8.814 -18.948
    9   HD23  LEU 695          HD21      LEU 695  70.437  -8.903 -16.948
   10   HD22  LEU 695          HD22      LEU 695  69.574 -10.108 -17.908
   11   HD21  LEU 695          HD23      LEU 695  68.749  -8.642 -17.385

  No H/Q in entry =          11
  In of MODEL   48
    1    H    THR 696           H        THR 696  71.937  -4.575 -19.981
    2    HA   THR 696           HA       THR 696  71.751  -2.249 -18.313
    3    HB   THR 696           HB       THR 696  71.834  -1.157 -20.652
    4    HG1  THR 696           HG1      THR 696  72.901  -3.070 -22.007
    5   HG23  THR 696          HG21      THR 696  74.231  -1.629 -20.888
    6   HG22  THR 696          HG22      THR 696  74.065  -3.017 -19.813
    7   HG21  THR 696          HG23      THR 696  73.806  -1.386 -19.193

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLN 697           H        GLN 697  70.090  -3.326 -21.177
    2    HA   GLN 697           HA       GLN 697  67.642  -2.047 -20.403
    3    HB2  GLN 697           HB2      GLN 697  66.792  -2.995 -22.464
    4    HB3  GLN 697           HB3      GLN 697  68.125  -1.868 -22.654
    5    HG2  GLN 697           HG2      GLN 697  69.639  -3.737 -23.054
    6    HG3  GLN 697           HG3      GLN 697  68.300  -4.873 -22.828
    7   HE21  GLN 697          HE21      GLN 697  66.396  -3.110 -24.027
    8   HE22  GLN 697          HE22      GLN 697  66.695  -3.112 -25.692

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ALA 698           H        ALA 698  67.026  -3.045 -18.606
    2    HA   ALA 698           HA       ALA 698  66.220  -5.847 -18.891
    3    HB3  ALA 698           HB1      ALA 698  67.944  -5.538 -17.168
    4    HB2  ALA 698           HB2      ALA 698  66.406  -6.023 -16.456
    5    HB1  ALA 698           HB3      ALA 698  66.926  -4.340 -16.369

  No H/Q in entry =           5
  In of MODEL   48
    1    H    VAL 699           H        VAL 699  64.126  -6.025 -19.096
    2    HA   VAL 699           HA       VAL 699  62.367  -3.881 -18.232
    3    HB   VAL 699           HB       VAL 699  61.698  -6.479 -19.665
    4   HG11  VAL 699          HG11      VAL 699  59.778  -5.547 -18.489
    5   HG13  VAL 699          HG12      VAL 699  59.573  -5.385 -20.234
    6   HG12  VAL 699          HG13      VAL 699  60.041  -3.985 -19.268
    7   HG23  VAL 699          HG21      VAL 699  62.072  -3.709 -20.803
    8   HG22  VAL 699          HG22      VAL 699  61.527  -5.124 -21.703
    9   HG21  VAL 699          HG23      VAL 699  63.157  -5.079 -21.025

  No H/Q in entry =           9
  In of MODEL   48
    1    HA   PRO 700           HA       PRO 700  61.849  -6.494 -14.603
    2    HB2  PRO 700           HB2      PRO 700  60.579  -4.346 -13.238
    3    HB3  PRO 700           HB3      PRO 700  62.216  -4.961 -12.986
    4    HG2  PRO 700           HG2      PRO 700  61.607  -2.452 -14.031
    5    HG3  PRO 700           HG3      PRO 700  63.157  -3.286 -14.228
    6    HD2  PRO 700           HD2      PRO 700  60.879  -3.035 -16.141
    7    HD3  PRO 700           HD3      PRO 700  62.630  -3.104 -16.447

  No H/Q in entry =           7
  In of MODEL   48
    1    H    LYS 701           H        LYS 701  60.345  -7.795 -14.470
    2    HA   LYS 701           HA       LYS 701  57.642  -6.973 -15.182
    3    HB2  LYS 701           HB2      LYS 701  59.021  -9.598 -15.494
    4    HB3  LYS 701           HB3      LYS 701  57.335  -9.310 -15.902
    5    HG2  LYS 701           HG2      LYS 701  57.978  -7.650 -17.541
    6    HG3  LYS 701           HG3      LYS 701  59.674  -7.865 -17.116
    7    HD2  LYS 701           HD2      LYS 701  57.850  -9.952 -18.206
    8    HD3  LYS 701           HD3      LYS 701  59.040  -8.984 -19.121
    9    HE2  LYS 701           HE2      LYS 701  60.855  -9.946 -17.771
   10    HE3  LYS 701           HE3      LYS 701  59.684 -10.881 -16.850
   11    HZ2  LYS 701           HZ1      LYS 701  60.285 -11.223 -19.742
   12    HZ1  LYS 701           HZ2      LYS 701  59.138 -12.105 -18.881
   13    HZ3  LYS 701           HZ3      LYS 701  60.767 -12.226 -18.481

  No H/Q in entry =          13
  In of MODEL   48
    1    H    CYS 702           H        CYS 702  56.421  -6.948 -13.474
    2    HA   CYS 702           HA       CYS 702  57.157  -8.666 -11.200
    3    HB2  CYS 702           HB2      CYS 702  55.287  -6.297 -10.871
    4    HB3  CYS 702           HB3      CYS 702  56.245  -7.145  -9.720

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLN 703           H        GLN 703  55.750 -10.140 -10.534
    2    HA   GLN 703           HA       GLN 703  53.357 -10.599 -12.077
    3    HB2  GLN 703           HB2      GLN 703  54.410 -11.935  -9.576
    4    HB3  GLN 703           HB3      GLN 703  53.142 -12.564 -10.612
    5    HG2  GLN 703           HG2      GLN 703  56.036 -12.176 -11.372
    6    HG3  GLN 703           HG3      GLN 703  55.255 -13.710 -11.004
    7   HE21  GLN 703          HE21      GLN 703  53.951 -14.653 -12.545
    8   HE22  GLN 703          HE22      GLN 703  53.867 -14.122 -14.178

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ARG 704           H        ARG 704  51.422 -11.206 -10.614
    2    HA   ARG 704           HA       ARG 704  50.382  -8.704  -9.870
    3    HB2  ARG 704           HB2      ARG 704  49.353 -11.468  -9.411
    4    HB3  ARG 704           HB3      ARG 704  48.436 -10.019  -9.033
    5    HG2  ARG 704           HG2      ARG 704  49.576 -10.497 -11.737
    6    HG3  ARG 704           HG3      ARG 704  48.012 -11.168 -11.276
    7    HD2  ARG 704           HD2      ARG 704  47.741  -9.088 -12.480
    8    HD3  ARG 704           HD3      ARG 704  47.216  -8.889 -10.795
    9    HE   ARG 704           HE       ARG 704  49.906  -8.036 -11.528
   10   HH11  ARG 704          HH11      ARG 704  46.526  -7.034 -10.871
   11   HH12  ARG 704          HH12      ARG 704  46.921  -5.415 -10.618
   12   HH21  ARG 704          HH21      ARG 704  50.430  -5.796 -11.108
   13   HH22  ARG 704          HH22      ARG 704  49.183  -4.698 -10.716

  No H/Q in entry =          13
  In of MODEL   48
    1    H    TRP 705           H        TRP 705  52.094 -10.954  -7.971
    2    HA   TRP 705           HA       TRP 705  51.205  -9.694  -5.491
    3    HB2  TRP 705           HB2      TRP 705  52.394 -11.660  -4.404
    4    HB3  TRP 705           HB3      TRP 705  50.974 -12.060  -5.356
    5    HD1  TRP 705           HD1      TRP 705  54.703 -12.779  -5.095
    6    HE1  TRP 705           HE1      TRP 705  55.359 -14.465  -6.881
    7    HE3  TRP 705           HE3      TRP 705  50.362 -12.861  -7.849
    8    HZ2  TRP 705           HZ2      TRP 705  54.234 -15.711  -9.141
    9    HZ3  TRP 705           HZ3      TRP 705  50.250 -14.349  -9.803
   10    HH2  TRP 705           HH2      TRP 705  52.148 -15.746 -10.435

  No H/Q in entry =          10
  In of MODEL   48
    1    H    GLU 706           H        GLU 706  53.331  -8.953  -7.701
    2    HA   GLU 706           HA       GLU 706  55.443  -8.266  -5.805
    3    HB2  GLU 706           HB2      GLU 706  55.777  -9.240  -8.635
    4    HB3  GLU 706           HB3      GLU 706  57.070  -8.507  -7.683
    5    HG2  GLU 706           HG2      GLU 706  56.820 -10.328  -6.047
    6    HG3  GLU 706           HG3      GLU 706  55.579 -11.046  -7.072

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LYS 707           H        LYS 707  56.581  -6.440  -6.161
    2    HA   LYS 707           HA       LYS 707  55.465  -4.522  -8.037
    3    HB2  LYS 707           HB2      LYS 707  55.375  -2.765  -6.303
    4    HB3  LYS 707           HB3      LYS 707  54.274  -4.081  -5.950
    5    HG2  LYS 707           HG2      LYS 707  55.941  -4.960  -4.325
    6    HG3  LYS 707           HG3      LYS 707  56.924  -3.521  -4.632
    7    HD2  LYS 707           HD2      LYS 707  54.995  -2.118  -3.938
    8    HD3  LYS 707           HD3      LYS 707  54.111  -3.587  -3.534
    9    HE2  LYS 707           HE2      LYS 707  55.046  -2.695  -1.516
   10    HE3  LYS 707           HE3      LYS 707  55.929  -4.161  -1.932
   11    HZ2  LYS 707           HZ1      LYS 707  56.834  -1.378  -2.427
   12    HZ1  LYS 707           HZ2      LYS 707  57.685  -2.730  -2.894
   13    HZ3  LYS 707           HZ3      LYS 707  57.450  -2.423  -1.262

  No H/Q in entry =          13
  In of MODEL   48
    1    H    LEU 708           H        LEU 708  56.901  -2.655  -8.298
    2    HA   LEU 708           HA       LEU 708  59.643  -3.639  -8.424
    3    HB2  LEU 708           HB2      LEU 708  58.602  -2.926 -10.494
    4    HB3  LEU 708           HB3      LEU 708  58.258  -1.353  -9.812
    5    HG   LEU 708           HG       LEU 708  60.707  -0.924  -9.672
    6   HD11  LEU 708          HD11      LEU 708  60.908  -3.507 -11.193
    7   HD13  LEU 708          HD12      LEU 708  61.522  -3.188  -9.569
    8   HD12  LEU 708          HD13      LEU 708  62.218  -2.355 -10.957
    9   HD21  LEU 708          HD21      LEU 708  59.395  -0.098 -11.554
   10   HD23  LEU 708          HD22      LEU 708  59.669  -1.613 -12.416
   11   HD22  LEU 708          HD23      LEU 708  61.024  -0.544 -12.062

  No H/Q in entry =          11
  In of MODEL   48
    1    H    GLN 709           H        GLN 709  61.008  -3.027  -6.891
    2    HA   GLN 709           HA       GLN 709  61.225  -0.206  -6.261
    3    HB2  GLN 709           HB2      GLN 709  61.241  -0.444  -3.895
    4    HB3  GLN 709           HB3      GLN 709  59.867  -1.416  -4.390
    5    HG2  GLN 709           HG2      GLN 709  61.278  -3.436  -4.200
    6    HG3  GLN 709           HG3      GLN 709  62.597  -2.414  -3.634
    7   HE21  GLN 709          HE21      GLN 709  62.722  -3.416  -1.671
    8   HE22  GLN 709          HE22      GLN 709  61.551  -3.248  -0.430

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ASN 710           H        ASN 710  63.381   0.329  -5.874
    2    HA   ASN 710           HA       ASN 710  65.674   0.158  -5.950
    3    HB2  ASN 710           HB2      ASN 710  65.011  -1.397  -3.940
    4    HB3  ASN 710           HB3      ASN 710  65.410  -2.712  -5.030
    5   HD21  ASN 710          HD21      ASN 710  66.556  -0.175  -3.111
    6   HD22  ASN 710          HD22      ASN 710  68.247  -0.530  -3.180

  No H/Q in entry =           6
  In of MODEL   48
    1    H    SER 711           H        SER 711  64.008  -0.639  -8.232
    2    HA   SER 711           HA       SER 711  64.151  -1.444 -10.315
    3    HB2  SER 711           HB2      SER 711  67.085  -1.675  -9.639
    4    HB3  SER 711           HB3      SER 711  66.422  -1.768 -11.283
    5    HG   SER 711           HG       SER 711  65.385   0.350 -10.276

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ARG 712           H        ARG 712  63.822  -3.327  -7.954
    2    HA   ARG 712           HA       ARG 712  64.140  -5.764  -9.524
    3    HB2  ARG 712           HB2      ARG 712  64.609  -7.025  -7.475
    4    HB3  ARG 712           HB3      ARG 712  65.848  -5.816  -7.773
    5    HG2  ARG 712           HG2      ARG 712  64.847  -4.363  -6.110
    6    HG3  ARG 712           HG3      ARG 712  63.576  -5.554  -5.831
    7    HD2  ARG 712           HD2      ARG 712  65.317  -5.685  -4.116
    8    HD3  ARG 712           HD3      ARG 712  65.239  -7.162  -5.075
    9    HE   ARG 712           HE       ARG 712  67.134  -5.288  -6.090
   10   HH11  ARG 712          HH11      ARG 712  66.696  -7.866  -3.717
   11   HH12  ARG 712          HH12      ARG 712  68.343  -8.223  -3.571
   12   HH21  ARG 712          HH21      ARG 712  69.373  -5.715  -5.896
   13   HH22  ARG 712          HH22      ARG 712  69.933  -6.980  -4.906

  No H/Q in entry =          13
  In of MODEL   48
    1    H    CYS 713           H        CYS 713  62.657  -7.468  -8.718
    2    HA   CYS 713           HA       CYS 713  60.059  -6.249  -8.195
    3    HB2  CYS 713           HB2      CYS 713  60.736  -9.046  -9.135
    4    HB3  CYS 713           HB3      CYS 713  59.148  -8.283  -9.144

  No H/Q in entry =           4
  In of MODEL   48
    1    H    VAL 714           H        VAL 714  59.407  -6.345  -6.149
    2    HA   VAL 714           HA       VAL 714  60.326  -8.586  -4.474
    3    HB   VAL 714           HB       VAL 714  60.086  -7.138  -2.513
    4   HG11  VAL 714          HG11      VAL 714  62.265  -7.217  -3.570
    5   HG13  VAL 714          HG12      VAL 714  61.962  -5.615  -2.892
    6   HG12  VAL 714          HG13      VAL 714  61.810  -5.884  -4.630
    7   HG23  VAL 714          HG21      VAL 714  59.684  -4.721  -2.750
    8   HG22  VAL 714          HG22      VAL 714  58.310  -5.676  -3.313
    9   HG21  VAL 714          HG23      VAL 714  59.415  -4.950  -4.480

  No H/Q in entry =           9
  In of MODEL   48
    1    H    CYS 715           H        CYS 715  58.741  -9.147  -2.768
    2    HA   CYS 715           HA       CYS 715  56.107  -9.203  -3.975
    3    HB2  CYS 715           HB2      CYS 715  57.111 -10.562  -1.467
    4    HB3  CYS 715           HB3      CYS 715  55.613 -10.904  -2.323

  No H/Q in entry =           4
  In of MODEL   48
    1    H    LYS 716           H        LYS 716  54.291  -8.476  -2.962
    2    HA   LYS 716           HA       LYS 716  54.394  -6.115  -1.357
    3    HB2  LYS 716           HB2      LYS 716  52.119  -7.999  -1.971
    4    HB3  LYS 716           HB3      LYS 716  51.954  -6.392  -1.288
    5    HG2  LYS 716           HG2      LYS 716  52.666  -5.375  -3.326
    6    HG3  LYS 716           HG3      LYS 716  53.158  -6.933  -3.995
    7    HD2  LYS 716           HD2      LYS 716  50.993  -6.187  -4.910
    8    HD3  LYS 716           HD3      LYS 716  50.848  -7.694  -4.012
    9    HE2  LYS 716           HE2      LYS 716  50.050  -6.400  -2.049
   10    HE3  LYS 716           HE3      LYS 716  50.115  -4.935  -3.030
   11    HZ1  LYS 716           HZ1      LYS 716  48.410  -7.309  -3.613
   12    HZ3  LYS 716           HZ2      LYS 716  48.437  -5.850  -4.470
   13    HZ2  LYS 716           HZ3      LYS 716  47.887  -5.874  -2.925

  No H/Q in entry =          13
  In of MODEL   48
    1    H    MET 717           H        MET 717  52.839  -6.116   0.733
    2    HA   MET 717           HA       MET 717  53.528  -8.454   2.331
    3    HB2  MET 717           HB2      MET 717  52.894  -5.609   3.060
    4    HB3  MET 717           HB3      MET 717  52.715  -6.888   4.242
    5    HG2  MET 717           HG2      MET 717  54.839  -5.746   4.453
    6    HG3  MET 717           HG3      MET 717  55.059  -7.454   4.056
    7    HE2  MET 717           HE1      MET 717  55.730  -3.948   1.144
    8    HE1  MET 717           HE2      MET 717  55.258  -3.761   2.847
    9    HE3  MET 717           HE3      MET 717  54.127  -4.464   1.688

  No H/Q in entry =           9
  In of MODEL   48
    1    HA   PRO 718           HA       PRO 718  49.576 -10.234   2.067
    2    HB2  PRO 718           HB2      PRO 718  49.150 -10.998   4.709
    3    HB3  PRO 718           HB3      PRO 718  50.034 -11.908   3.487
    4    HG2  PRO 718           HG2      PRO 718  51.084 -10.082   5.608
    5    HG3  PRO 718           HG3      PRO 718  51.742 -11.626   5.036
    6    HD2  PRO 718           HD2      PRO 718  52.829  -9.317   4.282
    7    HD3  PRO 718           HD3      PRO 718  52.663 -10.655   3.126

  No H/Q in entry =           7
  In of MODEL   48
    1    H    TYR 719           H        TYR 719  49.871  -7.642   4.356
    2    HA   TYR 719           HA       TYR 719  47.009  -7.543   4.788
    3    HB2  TYR 719           HB2      TYR 719  47.405  -5.652   6.260
    4    HB3  TYR 719           HB3      TYR 719  48.521  -6.946   6.650
    5    HD1  TYR 719           HD1      TYR 719  50.964  -6.696   5.847
    6    HD2  TYR 719           HD2      TYR 719  48.146  -3.506   5.742
    7    HE1  TYR 719           HE1      TYR 719  52.781  -5.101   5.753
    8    HE2  TYR 719           HE2      TYR 719  49.980  -1.889   5.634
    9    HH   TYR 719           HH       TYR 719  53.272  -2.876   5.150

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLU 720           H        GLU 720  49.040  -6.576   2.430
    2    HA   GLU 720           HA       GLU 720  47.550  -4.211   1.567
    3    HB2  GLU 720           HB2      GLU 720  50.104  -5.565   0.756
    4    HB3  GLU 720           HB3      GLU 720  49.401  -4.247  -0.177
    5    HG2  GLU 720           HG2      GLU 720  50.107  -4.022   2.733
    6    HG3  GLU 720           HG3      GLU 720  51.238  -3.632   1.437

  No H/Q in entry =           6
  In of MODEL   48
    1    H    CYS 721           H        CYS 721  46.508  -6.964   1.567
    2    HA   CYS 721           HA       CYS 721  46.156  -7.406  -1.318
    3    HB2  CYS 721           HB2      CYS 721  46.244  -9.465   0.868
    4    HB3  CYS 721           HB3      CYS 721  46.118  -9.756  -0.862

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLY 722           H        GLY 722  44.046  -6.875  -1.776
    2    HA3  GLY 722           HA2      GLY 722  42.047  -7.623   0.242
    3    HA2  GLY 722           HA3      GLY 722  41.965  -6.140  -0.690

  No H/Q in entry =           3
  In of MODEL   48
    1    HA   PRO 723           HA       PRO 723  39.200  -8.122  -3.452
    2    HB2  PRO 723           HB2      PRO 723  39.801  -6.764  -5.778
    3    HB3  PRO 723           HB3      PRO 723  38.752  -6.153  -4.494
    4    HG2  PRO 723           HG2      PRO 723  41.626  -5.574  -5.041
    5    HG3  PRO 723           HG3      PRO 723  40.345  -4.474  -4.503
    6    HD2  PRO 723           HD2      PRO 723  42.195  -5.444  -2.817
    7    HD3  PRO 723           HD3      PRO 723  40.523  -5.150  -2.299

  No H/Q in entry =           7
  In of MODEL   48
    1    H    SER 724           H        SER 724  39.694 -10.208  -3.765
    2    HA   SER 724           HA       SER 724  40.902 -11.120  -6.161
    3    HB2  SER 724           HB2      SER 724  42.222 -11.366  -3.483
    4    HB3  SER 724           HB3      SER 724  42.341 -12.686  -4.647
    5    HG   SER 724           HG       SER 724  43.003 -10.922  -6.106

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU 725           H        LEU 725  40.786 -13.527  -6.068
    2    HA   LEU 725           HA       LEU 725  38.155 -14.346  -5.322
    3    HB2  LEU 725           HB2      LEU 725  40.564 -15.610  -6.499
    4    HB3  LEU 725           HB3      LEU 725  39.268 -16.674  -5.990
    5    HG   LEU 725           HG       LEU 725  38.840 -14.443  -7.981
    6   HD11  LEU 725          HD11      LEU 725  40.674 -15.964  -8.779
    7   HD13  LEU 725          HD12      LEU 725  39.206 -16.136  -9.738
    8   HD12  LEU 725          HD13      LEU 725  39.602 -17.337  -8.512
    9   HD23  LEU 725          HD21      LEU 725  37.432 -17.061  -7.484
   10   HD22  LEU 725          HD22      LEU 725  37.017 -15.854  -8.706
   11   HD21  LEU 725          HD23      LEU 725  36.866 -15.461  -6.994

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ASP 726           H        ASP 726  37.564 -15.062  -3.359
    2    HA   ASP 726           HA       ASP 726  39.569 -15.592  -1.414
    3    HB2  ASP 726           HB2      ASP 726  36.561 -15.818  -1.266
    4    HB3  ASP 726           HB3      ASP 726  37.599 -16.340   0.054

  No H/Q in entry =           4
  In of MODEL   48
    1    H    VAL 727           H        VAL 727  40.444 -17.366  -0.837
    2    HA   VAL 727           HA       VAL 727  39.414 -19.895  -1.863
    3    HB   VAL 727           HB       VAL 727  41.748 -20.610  -2.428
    4   HG12  VAL 727          HG11      VAL 727  41.990 -19.367  -4.546
    5   HG11  VAL 727          HG12      VAL 727  40.824 -18.181  -3.968
    6   HG13  VAL 727          HG13      VAL 727  40.322 -19.849  -4.243
    7   HG23  VAL 727          HG21      VAL 727  42.454 -17.694  -2.019
    8   HG22  VAL 727          HG22      VAL 727  43.531 -18.922  -2.685
    9   HG21  VAL 727          HG23      VAL 727  42.985 -19.041  -1.012

  No H/Q in entry =           9
  In of MODEL   48
    1    H    CYS 728           H        CYS 728  40.348 -21.727  -0.572
    2    HA   CYS 728           HA       CYS 728  41.085 -20.606   2.000
    3    HB2  CYS 728           HB2      CYS 728  38.899 -21.795   1.963
    4    HB3  CYS 728           HB3      CYS 728  39.776 -23.302   1.685

  No H/Q in entry =           4
  In of MODEL   48
    1    H    ALA 729           H        ALA 729  42.609 -21.622   3.260
    2    HA   ALA 729           HA       ALA 729  44.315 -23.427   1.785
    3    HB3  ALA 729           HB1      ALA 729  45.094 -21.150   1.374
    4    HB2  ALA 729           HB2      ALA 729  46.239 -22.104   2.316
    5    HB1  ALA 729           HB3      ALA 729  45.220 -20.910   3.118

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLN 730           H        GLN 730  45.675 -24.508   3.049
    2    HA   GLN 730           HA       GLN 730  44.868 -24.765   5.830
    3    HB2  GLN 730           HB2      GLN 730  44.872 -26.829   4.466
    4    HB3  GLN 730           HB3      GLN 730  46.572 -26.567   4.130
    5    HG2  GLN 730           HG2      GLN 730  47.150 -26.789   6.414
    6    HG3  GLN 730           HG3      GLN 730  45.481 -26.940   6.910
    7   HE21  GLN 730          HE21      GLN 730  45.665 -28.985   7.737
    8   HE22  GLN 730          HE22      GLN 730  46.013 -30.372   6.791

  No H/Q in entry =           8
  In of MODEL   48
    1    H    ASP 731           H        ASP 731  46.080 -23.877   7.233
    2    HA   ASP 731           HA       ASP 731  48.594 -22.653   6.698
    3    HB2  ASP 731           HB2      ASP 731  47.042 -21.834   8.427
    4    HB3  ASP 731           HB3      ASP 731  47.245 -23.316   9.339

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLU 732           H        GLU 732  50.546 -23.640   6.616
    2    HA   GLU 732           HA       GLU 732  50.588 -26.420   7.171
    3    HB2  GLU 732           HB2      GLU 732  52.746 -24.600   6.169
    4    HB3  GLU 732           HB3      GLU 732  52.993 -26.331   6.418
    5    HG2  GLU 732           HG2      GLU 732  50.969 -26.654   4.885
    6    HG3  GLU 732           HG3      GLU 732  51.161 -24.939   4.516

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ARG 733           H        ARG 733  51.048 -23.896   9.271
    2    HA   ARG 733           HA       ARG 733  52.962 -25.392  10.875
    3    HB2  ARG 733           HB2      ARG 733  53.191 -22.895  10.670
    4    HB3  ARG 733           HB3      ARG 733  51.629 -22.726  11.460
    5    HG2  ARG 733           HG2      ARG 733  53.247 -22.357  13.137
    6    HG3  ARG 733           HG3      ARG 733  52.626 -23.986  13.417
    7    HD2  ARG 733           HD2      ARG 733  54.990 -24.117  13.644
    8    HD3  ARG 733           HD3      ARG 733  54.610 -24.827  12.073
    9    HE   ARG 733           HE       ARG 733  55.295 -22.005  12.157
   10   HH11  ARG 733          HH11      ARG 733  56.431 -25.288  11.334
   11   HH12  ARG 733          HH12      ARG 733  57.775 -24.704  10.471
   12   HH21  ARG 733          HH21      ARG 733  57.181 -21.276  11.008
   13   HH22  ARG 733          HH22      ARG 733  58.214 -22.433  10.283

  No H/Q in entry =          13
  In of MODEL   48
    1    H    SER 734           H        SER 734  49.751 -23.956  11.126
    2    HA   SER 734           HA       SER 734  49.165 -25.363  13.594
    3    HB2  SER 734           HB2      SER 734  47.408 -23.557  11.944
    4    HB3  SER 734           HB3      SER 734  47.173 -24.014  13.634
    5    HG   SER 734           HG       SER 734  49.270 -22.466  12.524

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LYS 735           H        LYS 735  48.670 -25.917  10.195
    2    HA   LYS 735           HA       LYS 735  47.678 -27.401   9.007
    3    HB2  LYS 735           HB2      LYS 735  47.448 -28.858  11.609
    4    HB3  LYS 735           HB3      LYS 735  46.790 -29.528  10.124
    5    HG2  LYS 735           HG2      LYS 735  49.663 -28.826  10.671
    6    HG3  LYS 735           HG3      LYS 735  48.974 -30.445  10.494
    7    HD2  LYS 735           HD2      LYS 735  48.196 -29.583   8.167
    8    HD3  LYS 735           HD3      LYS 735  49.366 -28.319   8.433
    9    HE2  LYS 735           HE2      LYS 735  51.178 -29.844   8.620
   10    HE3  LYS 735           HE3      LYS 735  50.088 -31.230   8.578
   11    HZ3  LYS 735           HZ1      LYS 735  51.133 -30.880   6.452
   12    HZ2  LYS 735           HZ2      LYS 735  50.553 -29.323   6.328
   13    HZ1  LYS 735           HZ3      LYS 735  49.489 -30.627   6.299

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ARG 736           H        ARG 736  46.081 -25.297  10.430
    2    HA   ARG 736           HA       ARG 736  43.423 -26.466  10.290
    3    HB2  ARG 736           HB2      ARG 736  42.573 -24.342  11.068
    4    HB3  ARG 736           HB3      ARG 736  43.852 -24.935  12.115
    5    HG2  ARG 736           HG2      ARG 736  45.381 -23.361  11.311
    6    HG3  ARG 736           HG3      ARG 736  44.350 -22.947   9.941
    7    HD2  ARG 736           HD2      ARG 736  44.311 -21.276  11.645
    8    HD3  ARG 736           HD3      ARG 736  42.714 -21.985  11.425
    9    HE   ARG 736           HE       ARG 736  43.969 -23.362  13.498
   10   HH11  ARG 736          HH11      ARG 736  42.615 -20.126  12.929
   11   HH12  ARG 736          HH12      ARG 736  42.366 -19.826  14.595
   12   HH21  ARG 736          HH21      ARG 736  43.563 -22.919  15.752
   13   HH22  ARG 736          HH22      ARG 736  42.900 -21.413  16.183

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ILE 737           H        ILE 737  41.795 -25.681   8.990
    2    HA   ILE 737           HA       ILE 737  42.654 -24.735   6.394
    3    HB   ILE 737           HB       ILE 737  39.900 -25.516   7.411
    4   HG12  ILE 737          HG12      ILE 737  41.554 -27.392   7.601
    5   HG13  ILE 737          HG13      ILE 737  40.227 -27.720   6.494
    6   HG23  ILE 737          HG21      ILE 737  39.351 -25.761   5.074
    7   HG22  ILE 737          HG22      ILE 737  41.022 -25.368   4.636
    8   HG21  ILE 737          HG23      ILE 737  40.009 -24.146   5.377
    9   HD13  ILE 737          HD11      ILE 737  42.312 -28.504   5.565
   10   HD12  ILE 737          HD12      ILE 737  43.012 -26.885   5.748
   11   HD11  ILE 737          HD13      ILE 737  41.660 -27.145   4.635

  No H/Q in entry =          11
  In of MODEL   48
    1    H    LEU 738           H        LEU 738  42.851 -22.490   6.362
    2    HA   LEU 738           HA       LEU 738  40.776 -21.034   7.801
    3    HB2  LEU 738           HB2      LEU 738  42.310 -19.317   8.425
    4    HB3  LEU 738           HB3      LEU 738  42.848 -20.853   9.088
    5    HG   LEU 738           HG       LEU 738  44.422 -20.742   6.895
    6   HD12  LEU 738          HD11      LEU 738  43.981 -17.872   7.552
    7   HD11  LEU 738          HD12      LEU 738  43.400 -18.713   6.116
    8   HD13  LEU 738          HD13      LEU 738  45.143 -18.558   6.406
    9   HD22  LEU 738          HD21      LEU 738  45.261 -20.930   9.164
   10   HD21  LEU 738          HD22      LEU 738  44.909 -19.213   9.423
   11   HD23  LEU 738          HD23      LEU 738  46.130 -19.693   8.233

  No H/Q in entry =          11
  In of MODEL   48
    1    HA   PRO 739           HA       PRO 739  39.806 -18.980   4.107
    2    HB2  PRO 739           HB2      PRO 739  38.789 -16.658   5.089
    3    HB3  PRO 739           HB3      PRO 739  37.953 -18.223   5.188
    4    HG2  PRO 739           HG2      PRO 739  39.543 -16.788   7.259
    5    HG3  PRO 739           HG3      PRO 739  37.993 -17.633   7.425
    6    HD2  PRO 739           HD2      PRO 739  40.348 -18.746   8.150
    7    HD3  PRO 739           HD3      PRO 739  38.990 -19.702   7.515

  No H/Q in entry =           7
  In of MODEL   48
    1    H    LEU 740           H        LEU 740  41.174 -18.134   2.689
    2    HA   LEU 740           HA       LEU 740  42.600 -15.662   3.312
    3    HB2  LEU 740           HB2      LEU 740  43.741 -18.119   1.971
    4    HB3  LEU 740           HB3      LEU 740  44.474 -16.537   1.831
    5    HG   LEU 740           HG       LEU 740  44.149 -18.094   4.411
    6   HD12  LEU 740          HD11      LEU 740  46.640 -17.447   2.865
    7   HD11  LEU 740          HD12      LEU 740  45.815 -19.002   2.848
    8   HD13  LEU 740          HD13      LEU 740  46.493 -18.389   4.363
    9   HD21  LEU 740          HD21      LEU 740  45.476 -15.443   3.841
   10   HD23  LEU 740          HD22      LEU 740  45.586 -16.337   5.354
   11   HD22  LEU 740          HD23      LEU 740  44.032 -15.705   4.824

  No H/Q in entry =          11
  In of MODEL   48
    1    H    THR 741           H        THR 741  43.615 -15.054   0.969
    2    HA   THR 741           HA       THR 741  41.484 -15.320  -0.994
    3    HB   THR 741           HB       THR 741  42.736 -12.635  -0.295
    4    HG1  THR 741           HG1      THR 741  40.161 -13.512   0.561
    5   HG21  THR 741          HG21      THR 741  41.583 -12.952  -2.469
    6   HG23  THR 741          HG22      THR 741  40.824 -11.737  -1.444
    7   HG22  THR 741          HG23      THR 741  40.108 -13.346  -1.590

  No H/Q in entry =           7
  In of MODEL   48
    1    H    VAL 742           H        VAL 742  42.368 -15.046  -3.164
    2    HA   VAL 742           HA       VAL 742  44.751 -16.203  -3.721
    3    HB   VAL 742           HB       VAL 742  43.344 -14.124  -5.402
    4   HG13  VAL 742          HG11      VAL 742  44.510 -14.968  -7.307
    5   HG12  VAL 742          HG12      VAL 742  45.479 -16.038  -6.285
    6   HG11  VAL 742          HG13      VAL 742  45.636 -14.277  -6.142
    7   HG22  VAL 742          HG21      VAL 742  42.029 -16.021  -4.942
    8   HG21  VAL 742          HG22      VAL 742  43.357 -17.099  -5.442
    9   HG23  VAL 742          HG23      VAL 742  42.568 -16.034  -6.627

  No H/Q in entry =           9
  In of MODEL   48
    1    H    CYS 743           H        CYS 743  44.418 -12.625  -3.889
    2    HA   CYS 743           HA       CYS 743  47.075 -12.086  -4.314
    3    HB2  CYS 743           HB2      CYS 743  45.274 -10.402  -4.499
    4    HB3  CYS 743           HB3      CYS 743  45.114 -10.378  -2.751

  No H/Q in entry =           4
  In of MODEL   48
    1    H    LYS 744           H        LYS 744  45.418 -12.522  -1.241
    2    HA   LYS 744           HA       LYS 744  47.549 -11.671   0.424
    3    HB2  LYS 744           HB2      LYS 744  45.071 -11.860   0.894
    4    HB3  LYS 744           HB3      LYS 744  45.343 -13.554   1.128
    5    HG2  LYS 744           HG2      LYS 744  46.829 -13.203   2.987
    6    HG3  LYS 744           HG3      LYS 744  46.767 -11.454   2.759
    7    HD2  LYS 744           HD2      LYS 744  44.357 -13.150   3.358
    8    HD3  LYS 744           HD3      LYS 744  45.304 -12.339   4.610
    9    HE2  LYS 744           HE2      LYS 744  43.940 -10.919   2.301
   10    HE3  LYS 744           HE3      LYS 744  43.226 -11.114   3.893
   11    HZ1  LYS 744           HZ1      LYS 744  45.818  -9.675   3.417
   12    HZ3  LYS 744           HZ2      LYS 744  44.935  -9.786   4.853
   13    HZ2  LYS 744           HZ3      LYS 744  44.298  -8.952   3.559

  No H/Q in entry =          13
  In of MODEL   48
    1    H    MET 745           H        MET 745  46.274 -14.849  -0.410
    2    HA   MET 745           HA       MET 745  48.137 -16.482   0.916
    3    HB2  MET 745           HB2      MET 745  46.557 -17.831   0.237
    4    HB3  MET 745           HB3      MET 745  46.003 -16.768  -1.044
    5    HG2  MET 745           HG2      MET 745  46.612 -18.770  -2.132
    6    HG3  MET 745           HG3      MET 745  47.948 -17.680  -2.404
    7    HE1  MET 745           HE1      MET 745  46.634 -20.755  -0.613
    8    HE3  MET 745           HE2      MET 745  47.105 -19.871   0.847
    9    HE2  MET 745           HE3      MET 745  47.979 -21.326   0.360

  No H/Q in entry =           9
  In of MODEL   48
    1    H    HIS 746           H        HIS 746  48.166 -15.187  -2.408
    2    HA   HIS 746           HA       HIS 746  50.554 -16.478  -3.204
    3    HB2  HIS 746           HB2      HIS 746  49.002 -14.220  -4.203
    4    HB3  HIS 746           HB3      HIS 746  50.703 -14.220  -4.688
    5    HD1  HIS 746           HD1      HIS 746  51.444 -16.484  -6.008
    6    HD2  HIS 746           HD2      HIS 746  47.379 -15.746  -5.636
    7    HE1  HIS 746           HE1      HIS 746  50.369 -17.806  -7.797
    8    HE2  HIS 746           HE2      HIS 746  47.932 -17.205  -7.697

  No H/Q in entry =           8
  In of MODEL   48
    1    H    VAL 747           H        VAL 747  50.064 -13.201  -2.046
    2    HA   VAL 747           HA       VAL 747  52.711 -12.392  -2.075
    3    HB   VAL 747           HB       VAL 747  50.285 -11.519  -0.528
    4   HG12  VAL 747          HG11      VAL 747  51.568  -9.603   0.270
    5   HG11  VAL 747          HG12      VAL 747  53.035 -10.293  -0.428
    6   HG13  VAL 747          HG13      VAL 747  52.226 -11.106   0.898
    7   HG23  VAL 747          HG21      VAL 747  51.958 -10.228  -2.661
    8   HG22  VAL 747          HG22      VAL 747  50.492  -9.551  -1.933
    9   HG21  VAL 747          HG23      VAL 747  50.404 -11.023  -2.902

  No H/Q in entry =           9
  In of MODEL   48
    1    H    LEU 748           H        LEU 748  50.804 -13.660   0.594
    2    HA   LEU 748           HA       LEU 748  52.850 -13.691   2.468
    3    HB2  LEU 748           HB2      LEU 748  50.891 -13.749   3.546
    4    HB3  LEU 748           HB3      LEU 748  50.063 -14.503   2.216
    5    HG   LEU 748           HG       LEU 748  51.657 -16.051   4.257
    6   HD11  LEU 748          HD11      LEU 748  49.874 -14.738   5.355
    7   HD13  LEU 748          HD12      LEU 748  49.492 -16.461   5.339
    8   HD12  LEU 748          HD13      LEU 748  48.709 -15.377   4.190
    9   HD23  LEU 748          HD21      LEU 748  49.434 -16.819   2.352
   10   HD22  LEU 748          HD22      LEU 748  50.239 -17.887   3.491
   11   HD21  LEU 748          HD23      LEU 748  51.142 -17.207   2.136

  No H/Q in entry =          11
  In of MODEL   48
    1    H    HIS 749           H        HIS 749  51.911 -16.040   0.083
    2    HA   HIS 749           HA       HIS 749  53.421 -18.263   0.990
    3    HB2  HIS 749           HB2      HIS 749  51.637 -17.766  -1.049
    4    HB3  HIS 749           HB3      HIS 749  53.149 -17.927  -1.921
    5    HD1  HIS 749           HD1      HIS 749  53.622 -20.269  -2.629
    6    HD2  HIS 749           HD2      HIS 749  51.181 -20.089   0.704
    7    HE1  HIS 749           HE1      HIS 749  52.944 -22.626  -2.189
    8    HE2  HIS 749           HE2      HIS 749  51.472 -22.527  -0.168

  No H/Q in entry =           8
  In of MODEL   48
    1    H    CYS 750           H        CYS 750  54.075 -15.536  -1.138
    2    HA   CYS 750           HA       CYS 750  56.654 -16.506  -1.877
    3    HB2  CYS 750           HB2      CYS 750  55.238 -13.935  -2.494
    4    HB3  CYS 750           HB3      CYS 750  56.808 -14.394  -3.157

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLN 751           H        GLN 751  55.409 -14.255   0.499
    2    HA   GLN 751           HA       GLN 751  57.933 -13.200   1.194
    3    HB2  GLN 751           HB2      GLN 751  55.336 -13.357   2.683
    4    HB3  GLN 751           HB3      GLN 751  56.764 -12.536   3.308
    5    HG2  GLN 751           HG2      GLN 751  55.593 -11.935   0.651
    6    HG3  GLN 751           HG3      GLN 751  55.021 -11.134   2.105
    7   HE21  GLN 751          HE21      GLN 751  55.704  -9.219   1.320
    8   HE22  GLN 751          HE22      GLN 751  57.299  -8.605   1.294

  No H/Q in entry =           8
  In of MODEL   48
    1    H    GLY 752           H        GLY 752  56.538 -16.240   1.776
    2    HA3  GLY 752           HA2      GLY 752  58.167 -17.921   2.503
    3    HA2  GLY 752           HA3      GLY 752  58.739 -16.746   3.670

  No H/Q in entry =           3
  In of MODEL   48
    1    H    ARG 753           H        ARG 753  55.304 -17.272   3.158
    2    HA   ARG 753           HA       ARG 753  55.256 -18.779   5.692
    3    HB2  ARG 753           HB2      ARG 753  52.920 -17.416   4.380
    4    HB3  ARG 753           HB3      ARG 753  53.007 -17.992   6.034
    5    HG2  ARG 753           HG2      ARG 753  54.442 -15.590   4.892
    6    HG3  ARG 753           HG3      ARG 753  53.092 -15.567   6.021
    7    HD2  ARG 753           HD2      ARG 753  54.448 -16.540   7.747
    8    HD3  ARG 753           HD3      ARG 753  55.772 -16.815   6.615
    9    HE   ARG 753           HE       ARG 753  54.806 -14.138   7.364
   10   HH11  ARG 753          HH11      ARG 753  57.486 -16.390   6.728
   11   HH12  ARG 753          HH12      ARG 753  58.714 -15.239   6.940
   12   HH21  ARG 753          HH21      ARG 753  56.530 -12.522   7.659
   13   HH22  ARG 753          HH22      ARG 753  58.152 -12.998   7.491

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ASN 754           H        ASN 754  54.307 -20.819   5.598
    2    HA   ASN 754           HA       ASN 754  53.856 -21.672   2.853
    3    HB2  ASN 754           HB2      ASN 754  54.539 -23.419   5.222
    4    HB3  ASN 754           HB3      ASN 754  54.249 -23.977   3.590
    5   HD21  ASN 754          HD21      ASN 754  56.473 -22.462   5.672
    6   HD22  ASN 754          HD22      ASN 754  57.806 -22.378   4.575

  No H/Q in entry =           6
  In of MODEL   48
    1    H    TYR 755           H        TYR 755  52.122 -22.423   2.138
    2    HA   TYR 755           HA       TYR 755  49.969 -23.274   3.877
    3    HB2  TYR 755           HB2      TYR 755  49.843 -20.897   2.073
    4    HB3  TYR 755           HB3      TYR 755  48.399 -21.848   2.344
    5    HD1  TYR 755           HD1      TYR 755  50.930 -19.725   3.930
    6    HD2  TYR 755           HD2      TYR 755  47.214 -21.683   4.374
    7    HE1  TYR 755           HE1      TYR 755  50.520 -18.445   5.957
    8    HE2  TYR 755           HE2      TYR 755  46.774 -20.430   6.416
    9    HH   TYR 755           HH       TYR 755  48.186 -19.354   8.156

  No H/Q in entry =           9
  In of MODEL   48
    1    H    THR 756           H        THR 756  48.620 -24.642   2.945
    2    HA   THR 756           HA       THR 756  49.235 -25.568   0.228
    3    HB   THR 756           HB       THR 756  47.982 -26.900   2.629
    4    HG1  THR 756           HG1      THR 756  50.501 -26.518   2.016
    5   HG21  THR 756          HG21      THR 756  48.663 -28.065  -0.071
    6   HG23  THR 756          HG22      THR 756  47.045 -27.772   0.575
    7   HG22  THR 756          HG23      THR 756  48.085 -28.987   1.327

  No H/Q in entry =           7
  In of MODEL   48
    1    H    LEU 757           H        LEU 757  47.300 -25.721  -1.173
    2    HA   LEU 757           HA       LEU 757  45.069 -24.345   0.048
    3    HB2  LEU 757           HB2      LEU 757  45.606 -24.916  -2.840
    4    HB3  LEU 757           HB3      LEU 757  44.095 -24.242  -2.256
    5    HG   LEU 757           HG       LEU 757  45.828 -22.575  -1.114
    6   HD12  LEU 757          HD11      LEU 757  47.530 -21.918  -2.731
    7   HD11  LEU 757          HD12      LEU 757  47.142 -23.344  -3.695
    8   HD13  LEU 757          HD13      LEU 757  47.789 -23.530  -2.066
    9   HD22  LEU 757          HD21      LEU 757  45.210 -20.996  -2.839
   10   HD21  LEU 757          HD22      LEU 757  43.865 -22.021  -2.336
   11   HD23  LEU 757          HD23      LEU 757  44.678 -22.333  -3.877

  No H/Q in entry =          11
  In of MODEL   48
    1    H    THR 758           H        THR 758  43.007 -25.026   0.046
    2    HA   THR 758           HA       THR 758  42.724 -27.897  -0.366
    3    HB   THR 758           HB       THR 758  41.152 -27.827   1.648
    4    HG1  THR 758           HG1      THR 758  42.134 -25.939   3.063
    5   HG23  THR 758          HG21      THR 758  43.020 -28.027   3.259
    6   HG22  THR 758          HG22      THR 758  44.094 -27.246   2.105
    7   HG21  THR 758          HG23      THR 758  43.411 -28.829   1.737

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLY 759           H        GLY 759  40.442 -25.492   0.648
    2    HA3  GLY 759           HA2      GLY 759  39.254 -24.767  -1.690
    3    HA2  GLY 759           HA3      GLY 759  38.600 -26.367  -1.385

  No H/Q in entry =           3
  In of MODEL   48
    1    H    ARG 760           H        ARG 760  36.800 -24.505  -1.538
    2    HA   ARG 760           HA       ARG 760  36.376 -22.987   0.865
    3    HB2  ARG 760           HB2      ARG 760  34.530 -22.018  -0.160
    4    HB3  ARG 760           HB3      ARG 760  35.542 -22.434  -1.528
    5    HG2  ARG 760           HG2      ARG 760  33.207 -24.070  -0.554
    6    HG3  ARG 760           HG3      ARG 760  33.111 -22.903  -1.875
    7    HD2  ARG 760           HD2      ARG 760  34.680 -24.270  -3.159
    8    HD3  ARG 760           HD3      ARG 760  34.821 -25.397  -1.801
    9    HE   ARG 760           HE       ARG 760  32.170 -24.923  -2.863
   10   HH11  ARG 760          HH11      ARG 760  34.938 -27.150  -2.737
   11   HH12  ARG 760          HH12      ARG 760  34.066 -28.453  -3.391
   12   HH21  ARG 760          HH21      ARG 760  31.030 -26.719  -3.775
   13   HH22  ARG 760          HH22      ARG 760  31.812 -28.207  -4.015

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ASP 761           H        ASP 761  35.743 -26.186   0.065
    2    HA   ASP 761           HA       ASP 761  33.304 -26.502   1.489
    3    HB2  ASP 761           HB2      ASP 761  33.816 -28.048  -0.290
    4    HB3  ASP 761           HB3      ASP 761  35.302 -28.539   0.517

  No H/Q in entry =           4
  In of MODEL   48
    1    H    SER 762           H        SER 762  36.641 -26.699   2.245
    2    HA   SER 762           HA       SER 762  36.303 -28.180   4.691
    3    HB2  SER 762           HB2      SER 762  38.711 -26.823   3.500
    4    HB3  SER 762           HB3      SER 762  38.739 -28.000   4.815
    5    HG   SER 762           HG       SER 762  37.960 -29.529   3.415

  No H/Q in entry =           5
  In of MODEL   48
    1    H    CYS 763           H        CYS 763  36.138 -24.895   3.817
    2    HA   CYS 763           HA       CYS 763  36.645 -24.028   6.608
    3    HB2  CYS 763           HB2      CYS 763  37.273 -21.913   5.641
    4    HB3  CYS 763           HB3      CYS 763  38.267 -23.225   5.000

  No H/Q in entry =           4
  In of MODEL   48
    1    H    THR 764           H        THR 764  35.641 -21.804   6.929
    2    HA   THR 764           HA       THR 764  33.082 -21.576   5.561
    3    HB   THR 764           HB       THR 764  33.930 -20.273   8.176
    4    HG1  THR 764           HG1      THR 764  33.373 -22.749   7.753
    5   HG22  THR 764          HG21      THR 764  31.520 -19.785   8.390
    6   HG21  THR 764          HG22      THR 764  31.232 -20.573   6.838
    7   HG23  THR 764          HG23      THR 764  32.181 -19.086   6.910

  No H/Q in entry =           7
  In of MODEL   48
    1    H    LEU 765           H        LEU 765  33.714 -20.602   3.819
    2    HA   LEU 765           HA       LEU 765  35.587 -18.399   3.956
    3    HB2  LEU 765           HB2      LEU 765  35.469 -20.468   2.284
    4    HB3  LEU 765           HB3      LEU 765  34.309 -19.406   1.509
    5    HG   LEU 765           HG       LEU 765  36.029 -17.696   1.218
    6   HD11  LEU 765          HD11      LEU 765  37.775 -19.794   2.475
    7   HD13  LEU 765          HD12      LEU 765  37.393 -18.219   3.150
    8   HD12  LEU 765          HD13      LEU 765  38.386 -18.336   1.687
    9   HD21  LEU 765          HD21      LEU 765  36.816 -20.433   0.222
   10   HD23  LEU 765          HD22      LEU 765  37.346 -18.892  -0.457
   11   HD22  LEU 765          HD23      LEU 765  35.646 -19.352  -0.536

  No H/Q in entry =          11
  In of MODEL   48
    1    HA   PRO 766           HA       PRO 766  32.178 -15.557   3.869
    2    HB2  PRO 766           HB2      PRO 766  33.548 -13.486   2.551
    3    HB3  PRO 766           HB3      PRO 766  33.438 -13.704   4.294
    4    HG2  PRO 766           HG2      PRO 766  35.665 -14.321   2.455
    5    HG3  PRO 766           HG3      PRO 766  35.700 -13.970   4.187
    6    HD2  PRO 766           HD2      PRO 766  36.040 -16.456   3.072
    7    HD3  PRO 766           HD3      PRO 766  35.508 -16.210   4.735

  No H/Q in entry =           7
  In of MODEL   48
    1    H    ALA 767           H        ALA 767  34.163 -15.174   0.920
    2    HA   ALA 767           HA       ALA 767  31.694 -15.203  -0.616
    3    HB3  ALA 767           HB1      ALA 767  32.967 -14.547  -2.505
    4    HB1  ALA 767           HB2      ALA 767  34.488 -14.788  -1.638
    5    HB2  ALA 767           HB3      ALA 767  33.389 -13.476  -1.164

  No H/Q in entry =           5
  In of MODEL   48
    1    H    SER 768           H        SER 768  31.083 -17.005  -0.200
    2    HA   SER 768           HA       SER 768  31.288 -18.870  -2.137
    3    HB2  SER 768           HB2      SER 768  32.774 -19.696   0.364
    4    HB3  SER 768           HB3      SER 768  32.034 -20.836  -0.747
    5    HG   SER 768           HG       SER 768  33.882 -18.875  -1.582

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA 769           H        ALA 769  30.425 -17.956   1.159
    2    HA   ALA 769           HA       ALA 769  28.109 -19.740   1.005
    3    HB2  ALA 769           HB1      ALA 769  29.727 -20.450   2.703
    4    HB3  ALA 769           HB2      ALA 769  28.184 -19.952   3.404
    5    HB1  ALA 769           HB3      ALA 769  29.571 -18.867   3.475

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLU 770           H        GLU 770  26.197 -18.914   1.230
    2    HA   GLU 770           HA       GLU 770  24.462 -17.633   1.441
    3    HB2  GLU 770           HB2      GLU 770  25.888 -16.634   3.885
    4    HB3  GLU 770           HB3      GLU 770  24.160 -16.477   3.567
    5    HG2  GLU 770           HG2      GLU 770  25.710 -19.034   3.932
    6    HG3  GLU 770           HG3      GLU 770  24.514 -18.354   5.028

  No H/Q in entry =           6
  In of MODEL   48
    1    H    LYS 771           H        LYS 771  26.608 -16.467  -0.087
    2    HA   LYS 771           HA       LYS 771  25.801 -13.638   0.056
    3    HB2  LYS 771           HB2      LYS 771  28.058 -15.017  -1.325
    4    HB3  LYS 771           HB3      LYS 771  27.768 -13.288  -1.473
    5    HG2  LYS 771           HG2      LYS 771  28.580 -14.829   0.997
    6    HG3  LYS 771           HG3      LYS 771  29.615 -13.753   0.061
    7    HD2  LYS 771           HD2      LYS 771  29.040 -12.323   1.773
    8    HD3  LYS 771           HD3      LYS 771  27.680 -12.013   0.702
    9    HE2  LYS 771           HE2      LYS 771  26.369 -13.722   1.968
   10    HE3  LYS 771           HE3      LYS 771  27.729 -13.903   3.055
   11    HZ2  LYS 771           HZ1      LYS 771  26.196 -11.414   2.618
   12    HZ1  LYS 771           HZ2      LYS 771  27.495 -11.576   3.675
   13    HZ3  LYS 771           HZ3      LYS 771  26.067 -12.428   3.957

  No H/Q in entry =          13
  In of MODEL   48
    1    H    ALA 772           H        ALA 772  25.813 -12.675  -2.320
    2    HA   ALA 772           HA       ALA 772  23.751 -13.891  -3.862
    3    HB2  ALA 772           HB1      ALA 772  24.279 -12.146  -5.448
    4    HB3  ALA 772           HB2      ALA 772  25.788 -11.803  -4.604
    5    HB1  ALA 772           HB3      ALA 772  24.241 -11.487  -3.817

  No H/Q in entry =           5
  In of MODEL   48
    1    H    CYS 773           H        CYS 773  23.909 -15.494  -5.333
    2    HA   CYS 773           HA       CYS 773  24.640 -17.344  -6.222
    3    HB2  CYS 773           HB2      CYS 773  26.175 -17.218  -8.046
    4    HB3  CYS 773           HB3      CYS 773  25.191 -15.779  -8.065

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLY 774           H        GLY 774  25.950 -16.381  -3.714
    2    HA3  GLY 774           HA2      GLY 774  27.039 -17.649  -2.135
    3    HA2  GLY 774           HA3      GLY 774  27.794 -18.595  -3.414

  No H/Q in entry =           3
  In of MODEL   48
    1    H    ALA 775           H        ALA 775  28.510 -15.949  -4.794
    2    HA   ALA 775           HA       ALA 775  30.471 -14.829  -3.011
    3    HB1  ALA 775           HB1      ALA 775  31.583 -16.919  -3.590
    4    HB3  ALA 775           HB2      ALA 775  32.430 -15.549  -4.313
    5    HB2  ALA 775           HB3      ALA 775  31.386 -16.562  -5.304

  No H/Q in entry =           5
  In of MODEL   48
    1    H    CYS 776           H        CYS 776  29.850 -12.738  -3.596
    2    HA   CYS 776           HA       CYS 776  30.703 -11.997  -6.252
    3    HB2  CYS 776           HB2      CYS 776  28.337 -12.567  -6.554
    4    HB3  CYS 776           HB3      CYS 776  27.893 -11.426  -5.293

  No H/Q in entry =           4
  In of MODEL   48
    1    HA   PRO 777           HA       PRO 777  31.631  -8.494  -3.503
    2    HB2  PRO 777           HB2      PRO 777  34.393  -8.876  -3.503
    3    HB3  PRO 777           HB3      PRO 777  33.282  -9.385  -2.227
    4    HG2  PRO 777           HG2      PRO 777  34.781 -11.067  -3.957
    5    HG3  PRO 777           HG3      PRO 777  33.517 -11.569  -2.822
    6    HD2  PRO 777           HD2      PRO 777  33.348 -11.077  -5.762
    7    HD3  PRO 777           HD3      PRO 777  32.447 -12.228  -4.752

  No H/Q in entry =           7
  In of MODEL   48
    1    H    LEU 778           H        LEU 778  34.457  -9.133  -5.631
    2    HA   LEU 778           HA       LEU 778  34.059  -6.461  -6.654
    3    HB2  LEU 778           HB2      LEU 778  36.413  -6.455  -7.431
    4    HB3  LEU 778           HB3      LEU 778  36.220  -6.660  -5.716
    5    HG   LEU 778           HG       LEU 778  38.101  -7.911  -6.458
    6   HD11  LEU 778          HD11      LEU 778  36.888  -8.978  -4.694
    7   HD13  LEU 778          HD12      LEU 778  37.701 -10.138  -5.738
    8   HD12  LEU 778          HD13      LEU 778  35.962  -9.912  -5.877
    9   HD21  LEU 778          HD21      LEU 778  36.314  -9.286  -8.437
   10   HD23  LEU 778          HD22      LEU 778  37.976  -9.762  -8.103
   11   HD22  LEU 778          HD23      LEU 778  37.637  -8.181  -8.811

  No H/Q in entry =          11
  In of MODEL   48
    1    H    TRP 779           H        TRP 779  33.428  -9.470  -7.825
    2    HA   TRP 779           HA       TRP 779  33.743  -8.511 -10.579
    3    HB2  TRP 779           HB2      TRP 779  33.158 -10.939 -11.173
    4    HB3  TRP 779           HB3      TRP 779  34.739 -10.617 -10.478
    5    HD1  TRP 779           HD1      TRP 779  31.295 -12.075  -9.431
    6    HE1  TRP 779           HE1      TRP 779  31.716 -13.686  -7.463
    7    HE3  TRP 779           HE3      TRP 779  36.250 -11.224  -8.795
    8    HZ2  TRP 779           HZ2      TRP 779  33.959 -14.466  -5.846
    9    HZ3  TRP 779           HZ3      TRP 779  37.453 -12.397  -7.032
   10    HH2  TRP 779           HH2      TRP 779  36.304 -13.997  -5.586

  No H/Q in entry =          10
  In of MODEL   48
    1    H    GLY 780           H        GLY 780  31.615  -7.959  -8.469
    2    HA3  GLY 780           HA2      GLY 780  29.478  -7.985 -10.352
    3    HA2  GLY 780           HA3      GLY 780  29.249  -9.054  -8.980

  No H/Q in entry =           3
  In of MODEL   48
    1    H    LYS 781           H        LYS 781  27.477  -7.354  -9.106
    2    HA   LYS 781           HA       LYS 781  28.035  -5.394  -7.009
    3    HB2  LYS 781           HB2      LYS 781  27.968  -4.289  -9.249
    4    HB3  LYS 781           HB3      LYS 781  26.363  -4.954  -9.490
    5    HG2  LYS 781           HG2      LYS 781  26.176  -2.638  -8.862
    6    HG3  LYS 781           HG3      LYS 781  25.563  -3.650  -7.558
    7    HD2  LYS 781           HD2      LYS 781  26.908  -1.806  -6.683
    8    HD3  LYS 781           HD3      LYS 781  27.665  -3.355  -6.331
    9    HE2  LYS 781           HE2      LYS 781  29.315  -1.691  -7.057
   10    HE3  LYS 781           HE3      LYS 781  29.230  -3.031  -8.190
   11    HZ2  LYS 781           HZ1      LYS 781  29.346  -0.906  -9.306
   12    HZ1  LYS 781           HZ2      LYS 781  27.927  -0.374  -8.563
   13    HZ3  LYS 781           HZ3      LYS 781  27.885  -1.645  -9.663

  No H/Q in entry =          13
  In of MODEL   48
    1    H    CYS 782           H        CYS 782  26.545  -5.671  -5.432
    2    HA   CYS 782           HA       CYS 782  24.288  -7.392  -6.110
    3    HB2  CYS 782           HB2      CYS 782  25.675  -6.998  -3.461
    4    HB3  CYS 782           HB3      CYS 782  24.284  -8.039  -3.746

  No H/Q in entry =           4
  In of MODEL   48
    1    H    ASP 783           H        ASP 783  22.275  -6.794  -5.548
    2    HA   ASP 783           HA       ASP 783  21.959  -4.037  -4.660
    3    HB2  ASP 783           HB2      ASP 783  19.587  -4.238  -5.271
    4    HB3  ASP 783           HB3      ASP 783  20.591  -4.761  -6.613

  No H/Q in entry =           4
  In of MODEL   48
    1    H    ALA 784           H        ALA 784  19.846  -3.867  -3.171
    2    HA   ALA 784           HA       ALA 784  20.567  -5.529  -0.870
    3    HB3  ALA 784           HB1      ALA 784  20.840  -3.111  -0.584
    4    HB2  ALA 784           HB2      ALA 784  19.641  -3.776   0.527
    5    HB1  ALA 784           HB3      ALA 784  19.121  -2.889  -0.905

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLU 785           H        GLU 785  17.877  -4.536  -2.852
    2    HA   GLU 785           HA       GLU 785  15.863  -5.408  -1.081
    3    HB2  GLU 785           HB2      GLU 785  14.285  -5.068  -2.903
    4    HB3  GLU 785           HB3      GLU 785  15.380  -3.712  -2.742
    5    HG2  GLU 785           HG2      GLU 785  16.677  -4.581  -4.663
    6    HG3  GLU 785           HG3      GLU 785  15.496  -5.878  -4.829

  No H/Q in entry =           6
  In of MODEL   48
    1    H    SER 786           H        SER 786  17.415  -7.028  -3.813
    2    HA   SER 786           HA       SER 786  15.912  -9.434  -3.108
    3    HB2  SER 786           HB2      SER 786  15.844  -8.647  -5.498
    4    HB3  SER 786           HB3      SER 786  17.588  -8.853  -5.578
    5    HG   SER 786           HG       SER 786  15.617 -10.831  -5.134

  No H/Q in entry =           5
  In of MODEL   48
    1    H    SER 787           H        SER 787  18.991  -7.874  -3.319
    2    HA   SER 787           HA       SER 787  21.000  -8.263  -2.373
    3    HB2  SER 787           HB2      SER 787  19.716 -10.686  -1.062
    4    HB3  SER 787           HB3      SER 787  21.254  -9.956  -0.605
    5    HG   SER 787           HG       SER 787  19.289  -8.099  -0.644

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LYS 788           H        LYS 788  20.133  -9.292  -4.899
    2    HA   LYS 788           HA       LYS 788  21.545 -11.822  -5.220
    3    HB2  LYS 788           HB2      LYS 788  20.674 -11.919  -7.396
    4    HB3  LYS 788           HB3      LYS 788  19.355 -11.477  -6.314
    5    HG2  LYS 788           HG2      LYS 788  19.468  -9.167  -6.989
    6    HG3  LYS 788           HG3      LYS 788  20.924  -9.467  -7.924
    7    HD2  LYS 788           HD2      LYS 788  19.598 -10.923  -9.423
    8    HD3  LYS 788           HD3      LYS 788  18.149 -10.482  -8.510
    9    HE2  LYS 788           HE2      LYS 788  19.972  -8.542  -9.935
   10    HE3  LYS 788           HE3      LYS 788  18.415  -9.100 -10.546
   11    HZ2  LYS 788           HZ1      LYS 788  18.222  -6.938  -9.482
   12    HZ1  LYS 788           HZ2      LYS 788  18.846  -7.533  -8.035
   13    HZ3  LYS 788           HZ3      LYS 788  17.360  -8.087  -8.618

  No H/Q in entry =          13
  In of MODEL   48
    1    H    CYS 789           H        CYS 789  22.804 -11.909  -7.357
    2    HA   CYS 789           HA       CYS 789  24.786  -9.787  -7.262
    3    HB2  CYS 789           HB2      CYS 789  26.135 -11.505  -8.491
    4    HB3  CYS 789           HB3      CYS 789  25.728 -11.915  -6.832

  No H/Q in entry =           4
  In of MODEL   48
    1    H    VAL 790           H        VAL 790  24.954  -8.466  -8.902
    2    HA   VAL 790           HA       VAL 790  24.109  -9.313 -11.566
    3    HB   VAL 790           HB       VAL 790  24.549  -6.565 -10.324
    4   HG11  VAL 790          HG11      VAL 790  24.022  -7.189 -13.244
    5   HG13  VAL 790          HG12      VAL 790  25.517  -6.522 -12.575
    6   HG12  VAL 790          HG13      VAL 790  24.033  -5.575 -12.529
    7   HG22  VAL 790          HG21      VAL 790  22.374  -7.522  -9.900
    8   HG21  VAL 790          HG22      VAL 790  22.168  -7.821 -11.626
    9   HG23  VAL 790          HG23      VAL 790  22.227  -6.162 -11.025

  No H/Q in entry =           9
  In of MODEL   48
    1    H    CYS 791           H        CYS 791  25.796  -9.183 -13.127
    2    HA   CYS 791           HA       CYS 791  28.377  -9.396 -11.763
    3    HB2  CYS 791           HB2      CYS 791  29.158 -10.622 -13.780
    4    HB3  CYS 791           HB3      CYS 791  27.793 -11.388 -12.979

  No H/Q in entry =           4
  In of MODEL   48
    1    H    ARG 792           H        ARG 792  30.171  -8.326 -12.382
    2    HA   ARG 792           HA       ARG 792  29.702  -5.882 -13.873
    3    HB2  ARG 792           HB2      ARG 792  32.151  -6.889 -12.419
    4    HB3  ARG 792           HB3      ARG 792  32.038  -5.335 -13.224
    5    HG2  ARG 792           HG2      ARG 792  30.302  -4.644 -11.671
    6    HG3  ARG 792           HG3      ARG 792  30.360  -6.215 -10.887
    7    HD2  ARG 792           HD2      ARG 792  31.666  -4.647  -9.602
    8    HD3  ARG 792           HD3      ARG 792  32.735  -5.835 -10.337
    9    HE   ARG 792           HE       ARG 792  32.339  -3.317 -11.748
   10   HH11  ARG 792          HH11      ARG 792  34.563  -5.403  -9.928
   11   HH12  ARG 792          HH12      ARG 792  35.892  -4.382 -10.021
   12   HH21  ARG 792          HH21      ARG 792  34.169  -1.829 -11.827
   13   HH22  ARG 792          HH22      ARG 792  35.636  -2.232 -11.067

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLU 793           H        GLU 793  31.346  -5.273 -15.462
    2    HA   GLU 793           HA       GLU 793  31.682  -7.430 -17.318
    3    HB2  GLU 793           HB2      GLU 793  32.555  -4.566 -17.506
    4    HB3  GLU 793           HB3      GLU 793  32.554  -5.725 -18.813
    5    HG2  GLU 793           HG2      GLU 793  30.165  -5.916 -18.761
    6    HG3  GLU 793           HG3      GLU 793  30.078  -4.865 -17.349

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ALA 794           H        ALA 794  33.614  -8.079 -18.138
    2    HA   ALA 794           HA       ALA 794  35.724  -8.364 -16.243
    3    HB1  ALA 794           HB1      ALA 794  35.593  -9.184 -19.136
    4    HB2  ALA 794           HB2      ALA 794  35.118 -10.176 -17.752
    5    HB3  ALA 794           HB3      ALA 794  36.805  -9.702 -17.971

  No H/Q in entry =           5
  In of MODEL   48
    1    H    SER 795           H        SER 795  34.988  -6.012 -18.467
    2    HA   SER 795           HA       SER 795  37.762  -5.170 -18.763
    3    HB2  SER 795           HB2      SER 795  36.337  -5.406 -20.817
    4    HB3  SER 795           HB3      SER 795  35.286  -4.145 -20.183
    5    HG   SER 795           HG       SER 795  37.987  -3.981 -20.930

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLU 796           H        GLU 796  35.252  -4.754 -16.648
    2    HA   GLU 796           HA       GLU 796  35.512  -1.859 -16.357
    3    HB2  GLU 796           HB2      GLU 796  33.244  -2.863 -16.291
    4    HB3  GLU 796           HB3      GLU 796  33.718  -3.835 -14.908
    5    HG2  GLU 796           HG2      GLU 796  33.997  -1.821 -13.574
    6    HG3  GLU 796           HG3      GLU 796  33.583  -0.824 -14.961

  No H/Q in entry =           6
  In of MODEL   48
    1    H    CYS 797           H        CYS 797  37.119  -4.492 -15.450
    2    HA   CYS 797           HA       CYS 797  37.461  -4.315 -12.690
    3    HB2  CYS 797           HB2      CYS 797  39.484  -5.688 -13.145
    4    HB3  CYS 797           HB3      CYS 797  38.007  -6.303 -13.874

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLU 798           H        GLU 798  38.541  -2.967 -11.486
    2    HA   GLU 798           HA       GLU 798  40.870  -1.642 -12.492
    3    HB2  GLU 798           HB2      GLU 798  39.963   0.550 -11.386
    4    HB3  GLU 798           HB3      GLU 798  39.632   0.167 -13.054
    5    HG2  GLU 798           HG2      GLU 798  37.682   1.050 -11.973
    6    HG3  GLU 798           HG3      GLU 798  37.405  -0.623 -12.432

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU 799           H        GLU 799  39.960  -3.584 -10.394
    2    HA   GLU 799           HA       GLU 799  41.189  -2.359  -8.059
    3    HB2  GLU 799           HB2      GLU 799  40.409  -4.378  -6.856
    4    HB3  GLU 799           HB3      GLU 799  39.089  -3.478  -7.567
    5    HG2  GLU 799           HG2      GLU 799  40.334  -5.922  -8.747
    6    HG3  GLU 799           HG3      GLU 799  38.885  -5.953  -7.729

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLU 800           H        GLU 800  42.256  -4.702  -6.925
    2    HA   GLU 800           HA       GLU 800  44.741  -4.747  -8.197
    3    HB2  GLU 800           HB2      GLU 800  43.666  -6.726  -6.164
    4    HB3  GLU 800           HB3      GLU 800  45.366  -6.478  -6.566
    5    HG2  GLU 800           HG2      GLU 800  45.103  -4.098  -5.829
    6    HG3  GLU 800           HG3      GLU 800  43.506  -4.519  -5.231

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLY 801           H        GLY 801  42.805  -7.740  -7.752
    2    HA3  GLY 801           HA2      GLY 801  42.173  -9.337  -9.231
    3    HA2  GLY 801           HA3      GLY 801  42.363  -8.148 -10.499

  No H/Q in entry =           3
  In of MODEL   48
    1    H    PHE 802           H        PHE 802  43.470 -10.964  -9.178
    2    HA   PHE 802           HA       PHE 802  46.077 -10.916 -10.448
    3    HB2  PHE 802           HB2      PHE 802  44.598 -12.887  -8.758
    4    HB3  PHE 802           HB3      PHE 802  45.991 -13.410  -9.696
    5    HD1  PHE 802           HD1      PHE 802  47.365 -13.957  -7.869
    6    HD2  PHE 802           HD2      PHE 802  45.689 -10.068  -8.170
    7    HE1  PHE 802           HE1      PHE 802  48.880 -13.189  -6.154
    8    HE2  PHE 802           HE2      PHE 802  47.210  -9.266  -6.464
    9    HZ   PHE 802           HZ       PHE 802  48.832 -10.823  -5.421

  No H/Q in entry =           9
  In of MODEL   48
    1    H    SER 803           H        SER 803  46.539 -13.228 -11.550
    2    HA   SER 803           HA       SER 803  44.538 -13.632 -13.620
    3    HB2  SER 803           HB2      SER 803  47.544 -14.010 -13.844
    4    HB3  SER 803           HB3      SER 803  46.341 -14.053 -15.135
    5    HG   SER 803           HG       SER 803  45.918 -11.790 -14.563

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ILE 804           H        ILE 804  43.766 -15.710 -13.449
    2    HA   ILE 804           HA       ILE 804  45.471 -17.670 -12.062
    3    HB   ILE 804           HB       ILE 804  43.649 -18.618 -10.843
    4   HG12  ILE 804          HG12      ILE 804  41.833 -18.376 -12.545
    5   HG13  ILE 804          HG13      ILE 804  41.313 -17.915 -10.936
    6   HG23  ILE 804          HG21      ILE 804  42.904 -16.796  -9.378
    7   HG22  ILE 804          HG22      ILE 804  43.497 -15.631 -10.566
    8   HG21  ILE 804          HG23      ILE 804  44.628 -16.712  -9.755
    9   HD11  ILE 804          HD11      ILE 804  41.575 -15.558 -11.574
   10   HD13  ILE 804          HD12      ILE 804  40.394 -16.420 -12.558
   11   HD12  ILE 804          HD13      ILE 804  41.986 -16.061 -13.219

  No H/Q in entry =          11
  In of MODEL   48
    1    H    CYS 805           H        CYS 805  44.673 -19.923 -12.455
    2    HA   CYS 805           HA       CYS 805  44.088 -20.266 -15.316
    3    HB2  CYS 805           HB2      CYS 805  46.129 -21.303 -14.445
    4    HB3  CYS 805           HB3      CYS 805  45.192 -22.125 -13.205

  No H/Q in entry =           4
  In of MODEL   48
    1    H    VAL 806           H        VAL 806  42.135 -20.875 -15.881
    2    HA   VAL 806           HA       VAL 806  40.640 -22.403 -13.916
    3    HB   VAL 806           HB       VAL 806  39.796 -20.104 -13.839
    4   HG11  VAL 806          HG11      VAL 806  39.371 -20.382 -16.768
    5   HG13  VAL 806          HG12      VAL 806  40.546 -19.342 -15.959
    6   HG12  VAL 806          HG13      VAL 806  38.812 -19.032 -15.776
    7   HG23  VAL 806          HG21      VAL 806  37.893 -21.852 -15.364
    8   HG22  VAL 806          HG22      VAL 806  37.470 -20.455 -14.357
    9   HG21  VAL 806          HG23      VAL 806  38.155 -21.904 -13.625

  No H/Q in entry =           9
  In of MODEL   48
    1    H    GLU 807           H        GLU 807  39.526 -24.122 -14.691
    2    HA   GLU 807           HA       GLU 807  40.165 -24.933 -17.362
    3    HB2  GLU 807           HB2      GLU 807  40.261 -26.524 -15.454
    4    HB3  GLU 807           HB3      GLU 807  38.536 -26.317 -15.212
    5    HG2  GLU 807           HG2      GLU 807  38.114 -27.246 -17.418
    6    HG3  GLU 807           HG3      GLU 807  39.847 -27.478 -17.663

  No H/Q in entry =           6
  In of MODEL   48
    1    H    VAL 808           H        VAL 808  38.988 -24.529 -18.961
    2    HA   VAL 808           HA       VAL 808  36.117 -24.094 -18.750
    3    HB   VAL 808           HB       VAL 808  37.197 -21.888 -18.646
    4   HG12  VAL 808          HG11      VAL 808  38.476 -20.961 -20.518
    5   HG11  VAL 808          HG12      VAL 808  38.494 -22.557 -21.270
    6   HG13  VAL 808          HG13      VAL 808  39.297 -22.305 -19.721
    7   HG21  VAL 808          HG21      VAL 808  35.847 -22.400 -21.273
    8   HG23  VAL 808          HG22      VAL 808  36.120 -20.807 -20.557
    9   HG22  VAL 808          HG23      VAL 808  35.064 -21.970 -19.743

  No H/Q in entry =           9
  In of MODEL   48
    1    H    ASN 809           H        ASN 809  35.078 -25.051 -20.441
    2    HA   ASN 809           HA       ASN 809  34.699 -26.163 -22.393
    3    HB2  ASN 809           HB2      ASN 809  37.142 -24.669 -23.055
    4    HB3  ASN 809           HB3      ASN 809  36.662 -25.932 -24.213
    5   HD21  ASN 809          HD21      ASN 809  36.224 -22.774 -23.030
    6   HD22  ASN 809          HD22      ASN 809  34.931 -22.302 -24.053

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLY 810           H        GLY 810  36.953 -27.017 -20.252
    2    HA3  GLY 810           HA2      GLY 810  37.410 -29.338 -19.857
    3    HA2  GLY 810           HA3      GLY 810  37.448 -29.588 -21.599

  No H/Q in entry =           3
  In of MODEL   48
    1    H    LYS 811           H        LYS 811  38.984 -26.779 -21.228
    2    HA   LYS 811           HA       LYS 811  41.578 -28.021 -20.738
    3    HB2  LYS 811           HB2      LYS 811  42.524 -26.625 -22.549
    4    HB3  LYS 811           HB3      LYS 811  41.315 -27.744 -23.150
    5    HG2  LYS 811           HG2      LYS 811  39.677 -25.789 -23.022
    6    HG3  LYS 811           HG3      LYS 811  41.097 -24.764 -22.809
    7    HD2  LYS 811           HD2      LYS 811  40.545 -26.593 -25.157
    8    HD3  LYS 811           HD3      LYS 811  40.426 -24.838 -25.162
    9    HE2  LYS 811           HE2      LYS 811  42.814 -24.645 -24.788
   10    HE3  LYS 811           HE3      LYS 811  42.959 -26.396 -24.637
   11    HZ1  LYS 811           HZ1      LYS 811  42.262 -26.603 -26.954
   12    HZ3  LYS 811           HZ2      LYS 811  43.637 -25.677 -26.795
   13    HZ2  LYS 811           HZ3      LYS 811  42.169 -24.917 -27.098

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLU 812           H        GLU 812  43.233 -25.891 -20.547
    2    HA   GLU 812           HA       GLU 812  41.839 -24.338 -18.493
    3    HB2  GLU 812           HB2      GLU 812  44.718 -25.227 -18.558
    4    HB3  GLU 812           HB3      GLU 812  44.019 -24.165 -17.346
    5    HG2  GLU 812           HG2      GLU 812  42.505 -25.935 -16.642
    6    HG3  GLU 812           HG3      GLU 812  43.164 -27.000 -17.879

  No H/Q in entry =           6
  In of MODEL   48
    1    H    GLN 813           H        GLN 813  42.009 -22.189 -18.470
    2    HA   GLN 813           HA       GLN 813  43.956 -20.944 -20.237
    3    HB2  GLN 813           HB2      GLN 813  41.888 -21.086 -21.484
    4    HB3  GLN 813           HB3      GLN 813  40.997 -20.341 -20.163
    5    HG2  GLN 813           HG2      GLN 813  42.163 -18.362 -20.418
    6    HG3  GLN 813           HG3      GLN 813  43.210 -19.000 -21.698
    7   HE21  GLN 813          HE21      GLN 813  40.181 -17.573 -20.974
    8   HE22  GLN 813          HE22      GLN 813  39.526 -17.615 -22.568

  No H/Q in entry =           8
  In of MODEL   48
    1    H    THR 814           H        THR 814  44.630 -18.913 -19.531
    2    HA   THR 814           HA       THR 814  44.143 -18.378 -16.728
    3    HB   THR 814           HB       THR 814  45.926 -16.878 -18.665
    4    HG1  THR 814           HG1      THR 814  47.497 -18.277 -18.182
    5   HG23  THR 814          HG21      THR 814  45.407 -15.636 -16.621
    6   HG22  THR 814          HG22      THR 814  47.092 -16.188 -16.579
    7   HG21  THR 814          HG23      THR 814  45.867 -17.038 -15.659

  No H/Q in entry =           7
  In of MODEL   48
    1    H    MET 815           H        MET 815  42.804 -16.843 -16.033
    2    HA   MET 815           HA       MET 815  41.983 -14.724 -17.917
    3    HB2  MET 815           HB2      MET 815  40.113 -15.859 -15.831
    4    HB3  MET 815           HB3      MET 815  39.719 -14.775 -17.157
    5    HG2  MET 815           HG2      MET 815  40.426 -16.732 -18.668
    6    HG3  MET 815           HG3      MET 815  40.351 -17.632 -17.161
    7    HE1  MET 815           HE1      MET 815  38.894 -19.257 -18.344
    8    HE3  MET 815           HE2      MET 815  38.735 -18.310 -19.816
    9    HE2  MET 815           HE3      MET 815  37.287 -18.954 -19.019

  No H/Q in entry =           9
  In of MODEL   48
    1    H    SER 816           H        SER 816  41.149 -12.843 -16.712
    2    HA   SER 816           HA       SER 816  42.787 -12.237 -14.473
    3    HB2  SER 816           HB2      SER 816  40.306 -10.746 -15.325
    4    HB3  SER 816           HB3      SER 816  41.775 -10.121 -14.583
    5    HG   SER 816           HG       SER 816  41.274 -10.782 -17.251

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLU 817           H        GLU 817  42.071 -11.955 -12.379
    2    HA   GLU 817           HA       GLU 817  40.490 -13.897 -11.221
    3    HB2  GLU 817           HB2      GLU 817  42.270 -12.302 -10.325
    4    HB3  GLU 817           HB3      GLU 817  40.921 -11.190 -10.157
    5    HG2  GLU 817           HG2      GLU 817  39.897 -12.356  -8.544
    6    HG3  GLU 817           HG3      GLU 817  40.754 -13.853  -8.932

  No H/Q in entry =           6
  In of MODEL   48
    1    H    CYS 818           H        CYS 818  39.739 -10.522 -11.797
    2    HA   CYS 818           HA       CYS 818  37.086 -10.511 -10.876
    3    HB2  CYS 818           HB2      CYS 818  37.055  -8.399 -12.318
    4    HB3  CYS 818           HB3      CYS 818  38.256  -8.472 -11.022

  No H/Q in entry =           4
  In of MODEL   48
    1    H    GLU 819           H        GLU 819  38.552 -11.550 -13.806
    2    HA   GLU 819           HA       GLU 819  36.253 -11.312 -15.533
    3    HB2  GLU 819           HB2      GLU 819  38.613 -11.104 -16.262
    4    HB3  GLU 819           HB3      GLU 819  38.832 -12.799 -15.847
    5    HG2  GLU 819           HG2      GLU 819  37.292 -13.427 -17.579
    6    HG3  GLU 819           HG3      GLU 819  37.040 -11.729 -18.000

  No H/Q in entry =           6
  In of MODEL   48
    1    H    ALA 820           H        ALA 820  38.238 -14.058 -14.379
    2    HA   ALA 820           HA       ALA 820  36.586 -16.116 -15.085
    3    HB1  ALA 820           HB1      ALA 820  38.846 -16.447 -14.263
    4    HB2  ALA 820           HB2      ALA 820  37.712 -17.428 -13.333
    5    HB3  ALA 820           HB3      ALA 820  38.349 -15.932 -12.650

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLY 821           H        GLY 821  36.663 -14.154 -12.139
    2    HA3  GLY 821           HA2      GLY 821  34.608 -15.447 -10.714
    3    HA2  GLY 821           HA3      GLY 821  35.192 -13.811 -10.439

  No H/Q in entry =           3
  In of MODEL   48
    1    H    ALA 822           H        ALA 822  34.558 -12.666 -12.981
    2    HA   ALA 822           HA       ALA 822  31.885 -11.955 -12.577
    3    HB3  ALA 822           HB1      ALA 822  32.042 -10.773 -14.715
    4    HB2  ALA 822           HB2      ALA 822  33.518 -11.656 -15.110
    5    HB1  ALA 822           HB3      ALA 822  33.512 -10.516 -13.771

  No H/Q in entry =           5
  In of MODEL   48
    1    H    LEU 823           H        LEU 823  33.382 -14.243 -14.833
    2    HA   LEU 823           HA       LEU 823  30.968 -14.966 -16.006
    3    HB2  LEU 823           HB2      LEU 823  33.632 -16.294 -15.863
    4    HB3  LEU 823           HB3      LEU 823  32.268 -17.163 -16.518
    5    HG   LEU 823           HG       LEU 823  31.983 -15.241 -18.149
    6   HD11  LEU 823          HD11      LEU 823  33.298 -13.549 -17.057
    7   HD13  LEU 823          HD12      LEU 823  33.931 -13.891 -18.668
    8   HD12  LEU 823          HD13      LEU 823  34.757 -14.518 -17.244
    9   HD23  LEU 823          HD21      LEU 823  33.812 -16.089 -19.593
   10   HD22  LEU 823          HD22      LEU 823  32.755 -17.289 -18.857
   11   HD21  LEU 823          HD23      LEU 823  34.377 -17.016 -18.182

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ARG 824           H        ARG 824  32.525 -16.201 -13.056
    2    HA   ARG 824           HA       ARG 824  30.807 -18.362 -12.632
    3    HB2  ARG 824           HB2      ARG 824  32.096 -16.549 -10.585
    4    HB3  ARG 824           HB3      ARG 824  31.298 -18.065 -10.210
    5    HG2  ARG 824           HG2      ARG 824  32.983 -19.237 -11.572
    6    HG3  ARG 824           HG3      ARG 824  33.830 -17.692 -11.801
    7    HD2  ARG 824           HD2      ARG 824  34.802 -19.014 -10.005
    8    HD3  ARG 824           HD3      ARG 824  34.080 -17.524  -9.382
    9    HE   ARG 824           HE       ARG 824  32.203 -19.606  -9.380
   10   HH11  ARG 824          HH11      ARG 824  34.977 -18.510  -7.398
   11   HH12  ARG 824          HH12      ARG 824  34.473 -19.411  -6.032
   12   HH21  ARG 824          HH21      ARG 824  31.589 -20.771  -7.518
   13   HH22  ARG 824          HH22      ARG 824  32.519 -20.722  -6.082

  No H/Q in entry =          13
  In of MODEL   48
    1    H    CYS 825           H        CYS 825  30.389 -14.937 -12.101
    2    HA   CYS 825           HA       CYS 825  27.996 -15.224 -10.521
    3    HB2  CYS 825           HB2      CYS 825  29.551 -13.403 -10.071
    4    HB3  CYS 825           HB3      CYS 825  29.416 -12.831 -11.722

  No H/Q in entry =           4
  In of MODEL   48
    1    H    ARG 826           H        ARG 826  28.960 -14.827 -13.765
    2    HA   ARG 826           HA       ARG 826  26.560 -13.768 -14.874
    3    HB2  ARG 826           HB2      ARG 826  29.099 -13.977 -15.704
    4    HB3  ARG 826           HB3      ARG 826  28.409 -15.359 -16.545
    5    HG2  ARG 826           HG2      ARG 826  26.644 -13.798 -17.372
    6    HG3  ARG 826           HG3      ARG 826  27.661 -12.529 -16.659
    7    HD2  ARG 826           HD2      ARG 826  28.195 -12.664 -19.020
    8    HD3  ARG 826           HD3      ARG 826  29.551 -13.312 -18.096
    9    HE   ARG 826           HE       ARG 826  27.756 -15.365 -18.802
   10   HH11  ARG 826          HH11      ARG 826  30.364 -13.419 -20.197
   11   HH12  ARG 826          HH12      ARG 826  30.585 -14.436 -21.547
   12   HH21  ARG 826          HH21      ARG 826  28.086 -16.760 -20.651
   13   HH22  ARG 826          HH22      ARG 826  29.261 -16.381 -21.816

  No H/Q in entry =          13
  In of MODEL   48
    1    H    GLY 827           H        GLY 827  27.706 -16.879 -14.041
    2    HA3  GLY 827           HA2      GLY 827  26.164 -18.738 -13.818
    3    HA2  GLY 827           HA3      GLY 827  25.281 -18.103 -15.202

  No H/Q in entry =           3
  In of MODEL   48
    1    H    GLN 828           H        GLN 828  28.684 -18.055 -15.390
    2    HA   GLN 828           HA       GLN 828  28.699 -19.937 -17.584
    3    HB2  GLN 828           HB2      GLN 828  30.047 -17.822 -17.486
    4    HB3  GLN 828           HB3      GLN 828  30.979 -18.592 -16.204
    5    HG2  GLN 828           HG2      GLN 828  32.224 -18.921 -18.185
    6    HG3  GLN 828           HG3      GLN 828  31.457 -20.441 -17.786
    7   HE21  GLN 828          HE21      GLN 828  31.387 -17.755 -19.977
    8   HE22  GLN 828          HE22      GLN 828  30.396 -18.530 -21.154

  No H/Q in entry =           8
  In of MODEL   48
    1    H    SER 829           H        SER 829  29.767 -21.977 -17.481
    2    HA   SER 829           HA       SER 829  30.477 -22.776 -14.804
    3    HB2  SER 829           HB2      SER 829  29.899 -24.458 -17.252
    4    HB3  SER 829           HB3      SER 829  30.415 -25.110 -15.693
    5    HG   SER 829           HG       SER 829  28.001 -23.841 -16.388

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ILE 830           H        ILE 830  32.408 -22.492 -14.261
    2    HA   ILE 830           HA       ILE 830  34.606 -23.219 -15.999
    3    HB   ILE 830           HB       ILE 830  35.904 -21.229 -15.362
    4   HG12  ILE 830          HG12      ILE 830  34.526 -20.753 -13.281
    5   HG13  ILE 830          HG13      ILE 830  35.042 -19.306 -14.116
    6   HG23  ILE 830          HG21      ILE 830  34.878 -21.168 -17.496
    7   HG22  ILE 830          HG22      ILE 830  34.792 -19.543 -16.793
    8   HG21  ILE 830          HG23      ILE 830  33.370 -20.596 -16.787
    9   HD12  ILE 830          HD11      ILE 830  32.315 -20.572 -14.086
   10   HD11  ILE 830          HD12      ILE 830  32.769 -19.283 -15.195
   11   HD13  ILE 830          HD13      ILE 830  32.783 -18.986 -13.462

  No H/Q in entry =          11
  In of MODEL   48
    1    H    SER 831           H        SER 831  36.348 -23.987 -14.820
    2    HA   SER 831           HA       SER 831  35.758 -24.271 -11.982
    3    HB2  SER 831           HB2      SER 831  36.987 -26.151 -13.943
    4    HB3  SER 831           HB3      SER 831  36.928 -26.467 -12.217
    5    HG   SER 831           HG       SER 831  34.803 -26.172 -14.088

  No H/Q in entry =           5
  In of MODEL   48
    1    H    VAL 832           H        VAL 832  37.155 -22.885 -10.971
    2    HA   VAL 832           HA       VAL 832  39.703 -22.231 -12.011
    3    HB   VAL 832           HB       VAL 832  38.578 -20.643 -10.535
    4   HG12  VAL 832          HG11      VAL 832  38.361 -20.992  -8.119
    5   HG11  VAL 832          HG12      VAL 832  38.920 -22.654  -8.322
    6   HG13  VAL 832          HG13      VAL 832  37.402 -22.141  -9.054
    7   HG23  VAL 832          HG21      VAL 832  40.419 -20.055  -9.010
    8   HG22  VAL 832          HG22      VAL 832  40.997 -20.484 -10.621
    9   HG21  VAL 832          HG23      VAL 832  41.144 -21.638  -9.298

  No H/Q in entry =           9
  In of MODEL   48
    1    H    THR 833           H        THR 833  41.466 -23.429 -12.114
    2    HA   THR 833           HA       THR 833  41.542 -25.811 -10.487
    3    HB   THR 833           HB       THR 833  43.363 -26.469 -12.106
    4    HG1  THR 833           HG1      THR 833  43.498 -25.208 -13.995
    5   HG21  THR 833          HG21      THR 833  40.661 -25.728 -13.206
    6   HG23  THR 833          HG22      THR 833  41.056 -27.231 -12.365
    7   HG22  THR 833          HG23      THR 833  41.771 -26.878 -13.945

  No H/Q in entry =           7
  In of MODEL   48
    1    H    SER 834           H        SER 834  43.185 -22.793 -10.867
    2    HA   SER 834           HA       SER 834  44.565 -23.239  -8.425
    3    HB2  SER 834           HB2      SER 834  46.146 -24.406  -9.897
    4    HB3  SER 834           HB3      SER 834  46.244 -22.965 -10.931
    5    HG   SER 834           HG       SER 834  47.456 -23.561  -8.557

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ILE 835           H        ILE 835  45.666 -21.431  -7.707
    2    HA   ILE 835           HA       ILE 835  44.456 -18.935  -8.519
    3    HB   ILE 835           HB       ILE 835  45.569 -18.018  -6.558
    4   HG12  ILE 835          HG12      ILE 835  47.087 -20.650  -6.552
    5   HG13  ILE 835          HG13      ILE 835  47.692 -18.996  -6.604
    6   HG23  ILE 835          HG21      ILE 835  44.565 -19.431  -4.809
    7   HG22  ILE 835          HG22      ILE 835  44.374 -20.730  -5.982
    8   HG21  ILE 835          HG23      ILE 835  43.482 -19.222  -6.190
    9   HD13  ILE 835          HD11      ILE 835  48.102 -20.015  -4.503
   10   HD12  ILE 835          HD12      ILE 835  46.370 -20.298  -4.314
   11   HD11  ILE 835          HD13      ILE 835  46.990 -18.634  -4.355

  No H/Q in entry =          11
  In of MODEL   48
    1    H    ARG 836           H        ARG 836  47.041 -20.799  -9.393
    2    HA   ARG 836           HA       ARG 836  48.922 -18.718 -10.135
    3    HB2  ARG 836           HB2      ARG 836  48.816 -21.702 -10.429
    4    HB3  ARG 836           HB3      ARG 836  49.958 -20.763 -11.362
    5    HG2  ARG 836           HG2      ARG 836  49.823 -20.781  -8.364
    6    HG3  ARG 836           HG3      ARG 836  50.863 -21.850  -9.308
    7    HD2  ARG 836           HD2      ARG 836  50.945 -18.833  -9.237
    8    HD3  ARG 836           HD3      ARG 836  52.166 -19.932  -8.577
    9    HE   ARG 836           HE       ARG 836  51.727 -20.298 -11.369
   10   HH11  ARG 836          HH11      ARG 836  53.688 -18.539  -9.012
   11   HH12  ARG 836          HH12      ARG 836  54.663 -17.778 -10.190
   12   HH21  ARG 836          HH21      ARG 836  53.107 -19.213 -12.993
   13   HH22  ARG 836          HH22      ARG 836  54.308 -18.168 -12.470

  No H/Q in entry =          13
  In of MODEL   48
    1    HA   PRO 837           HA       PRO 837  47.080 -18.383 -14.203
    2    HB2  PRO 837           HB2      PRO 837  49.214 -17.168 -15.414
    3    HB3  PRO 837           HB3      PRO 837  48.072 -16.282 -14.400
    4    HG2  PRO 837           HG2      PRO 837  50.785 -17.336 -13.721
    5    HG3  PRO 837           HG3      PRO 837  50.046 -15.788 -13.279
    6    HD2  PRO 837           HD2      PRO 837  50.191 -17.870 -11.574
    7    HD3  PRO 837           HD3      PRO 837  48.848 -16.709 -11.543

  No H/Q in entry =           7
  In of MODEL   48
    1    H    CYS 838           H        CYS 838  47.418 -19.597 -16.168
    2    HA   CYS 838           HA       CYS 838  49.495 -21.540 -15.797
    3    HB2  CYS 838           HB2      CYS 838  48.279 -22.833 -17.641
    4    HB3  CYS 838           HB3      CYS 838  47.409 -22.673 -16.125

  No H/Q in entry =           4
  In of MODEL   48
    1    H    ALA 839           H        ALA 839  50.248 -22.368 -18.210
    2    HA   ALA 839           HA       ALA 839  51.621 -20.162 -19.368
    3    HB1  ALA 839           HB1      ALA 839  52.585 -22.416 -19.285
    4    HB3  ALA 839           HB2      ALA 839  52.491 -21.827 -20.947
    5    HB2  ALA 839           HB3      ALA 839  51.308 -22.995 -20.352

  No H/Q in entry =           5
  In of MODEL   48
    1    H    ALA 840           H        ALA 840  48.543 -21.078 -19.588
    2    HA   ALA 840           HA       ALA 840  48.096 -20.559 -22.381
    3    HB1  ALA 840           HB1      ALA 840  46.862 -22.344 -21.339
    4    HB3  ALA 840           HB2      ALA 840  45.733 -21.042 -21.769
    5    HB2  ALA 840           HB3      ALA 840  46.279 -21.246 -20.098

  No H/Q in entry =           5
  In of MODEL   48
    1    H    GLU 841           H        GLU 841  49.178 -18.411 -20.648
    2    HA   GLU 841           HA       GLU 841  47.051 -16.505 -20.448
    3    HB2  GLU 841           HB2      GLU 841  50.057 -16.040 -20.528
    4    HB3  GLU 841           HB3      GLU 841  48.871 -14.778 -20.229
    5    HG2  GLU 841           HG2      GLU 841  48.120 -16.023 -18.241
    6    HG3  GLU 841           HG3      GLU 841  49.422 -17.179 -18.505

  No H/Q in entry =           6
  In of MODEL   48
    1    H    THR 842           H        THR 842  49.274 -17.562 -22.732
    2    HA   THR 842           HA       THR 842  48.443 -15.742 -24.817
    3    HB   THR 842           HB       THR 842  49.924 -18.371 -25.118
    4    HG1  THR 842           HG1      THR 842  51.189 -15.851 -24.804
    5   HG22  THR 842          HG21      THR 842  49.988 -15.799 -26.717
    6   HG21  THR 842          HG22      THR 842  49.115 -17.262 -27.169
    7   HG23  THR 842          HG23      THR 842  50.876 -17.279 -27.093

  No H/Q in entry =           7
  In of MODEL   48
    1    H    GLN 843           H        GLN 843  46.567 -16.155 -25.918
    2    HA   GLN 843           HA       GLN 843  45.350 -18.755 -25.480
    3    HB2  GLN 843           HB2      GLN 843  44.130 -16.132 -26.356
    4    HB3  GLN 843           HB3      GLN 843  43.245 -17.638 -26.144
    5    HG2  GLN 843           HG2      GLN 843  43.780 -17.683 -23.794
    6    HG3  GLN 843           HG3      GLN 843  44.792 -16.254 -23.967
    7   HE21  GLN 843          HE21      GLN 843  41.687 -16.576 -25.587
    8   HE22  GLN 843          HE22      GLN 843  40.892 -15.405 -24.602

  No H/Q in entry =           8