*HEADER    TRANSFERASE                             26-AUG-06   2J48
*TITLE     NMR STRUCTURE OF THE PSEUDO-RECEIVER DOMAIN OF THE CIKA
*TITLE    2 PROTEIN.
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: TWO-COMPONENT SENSOR KINASE;
*COMPND   3 CHAIN: A;
*COMPND   4 FRAGMENT: PSEUDO-RECEIVER DOMAIN, RESIDUES 627-745;
*COMPND   5 EC: 2.7.13.3;
*COMPND   6 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   3 EXPRESSION_SYSTEM_STRAIN: BL21;
*SOURCE   4 EXPRESSION_SYSTEM_PLASMID: PET-15B;
*SOURCE   5 EXPRESSION_SYSTEM_VARIANT: DE3;
*SOURCE   6 ORGANISM_SCIENTIFIC: SYNECHOCOCCUS ELONGATUS;
*SOURCE   7 STRAIN: PCC 7942;
*SOURCE   8 ATCC: 33912
*KEYWDS    KINASE, PSEUDO-RECEIVER, CIRCADIAN CLOCK, TRANSFERASE,
*KEYWDS   2 RESPONSE REGULATOR, HISTIDINE PROTEIN KINASE
*EXPDTA    NMR, 20 STRUCTURES
*AUTHOR    T.GAO,X.ZHANG,S.S.GOLDEN,A.LIWANG
*REVDAT   1   01-SEP-06 2J48    0




 restraints dihed reset
!  nassign=200
! set message=off echo=off end
! Phi from TALOS
assign (resid 11 and name c)  (resid 12 and name n)
       (resid 12 and name ca) (resid 12 and name c) 1.0 -88.020 43.96 2
assign (resid 12 and name c)  (resid 13 and name n)
       (resid 13 and name ca) (resid 13 and name c) 1.0 -114.630 23.42 2
assign (resid 13 and name c)  (resid 14 and name n)
       (resid 14 and name ca) (resid 14 and name c) 1.0 -111.190 30.34 2
assign (resid 14 and name c)  (resid 15 and name n)
       (resid 15 and name ca) (resid 15 and name c) 1.0 -116.620 18.1 2
assign (resid 15 and name c)  (resid 16 and name n)
       (resid 16 and name ca) (resid 16 and name c) 1.0 -110.470 19.8 2
assign (resid 16 and name c)  (resid 17 and name n)
       (resid 17 and name ca) (resid 17 and name c) 1.0 -127.290 30.76 2
assign (resid 17 and name c)  (resid 18 and name n)
       (resid 18 and name ca) (resid 18 and name c) 1.0 -102.110 55.6 2
assign (resid 19 and name c)  (resid 20 and name n)
       (resid 20 and name ca) (resid 20 and name c) 1.0 -87.160 46.76 2
assign (resid 20 and name c)  (resid 21 and name n)
       (resid 21 and name ca) (resid 21 and name c) 1.0 -60.320 15.32 2
assign (resid 21 and name c)  (resid 22 and name n)
       (resid 22 and name ca) (resid 22 and name c) 1.0 -65.240 15.16 2
assign (resid 22 and name c)  (resid 23 and name n)
       (resid 23 and name ca) (resid 23 and name c) 1.0 -65.510 7.24 2
assign (resid 23 and name c)  (resid 24 and name n)
       (resid 24 and name ca) (resid 24 and name c) 1.0 -65.640 10.76 2
assign (resid 24 and name c)  (resid 25 and name n)
       (resid 25 and name ca) (resid 25 and name c) 1.0 -60.570 11.76 2
assign (resid 25 and name c)  (resid 26 and name n)
       (resid 26 and name ca) (resid 26 and name c) 1.0 -64.560 7.52 2
assign (resid 26 and name c)  (resid 27 and name n)
       (resid 27 and name ca) (resid 27 and name c) 1.0 -58.280 12.06 2
assign (resid 27 and name c)  (resid 28 and name n)
       (resid 28 and name ca) (resid 28 and name c) 1.0 -63.970 7.68 2
assign (resid 28 and name c)  (resid 29 and name n)
       (resid 29 and name ca) (resid 29 and name c) 1.0 -62.640 11.2 2
assign (resid 29 and name c)  (resid 30 and name n)
       (resid 30 and name ca) (resid 30 and name c) 1.0 -64.670 17.64 2
assign (resid 30 and name c)  (resid 31 and name n)
       (resid 31 and name ca) (resid 31 and name c) 1.0 -65.780 9 2
assign (resid 31 and name c)  (resid 32 and name n)
       (resid 32 and name ca) (resid 32 and name c) 1.0 -67.500 13.32 2
assign (resid 32 and name c)  (resid 33 and name n)
       (resid 33 and name ca) (resid 33 and name c) 1.0 -87.210 23.22 2
assign (resid 34 and name c)  (resid 35 and name n)
       (resid 35 and name ca) (resid 35 and name c) 1.0 -100.680 54.46 2
assign (resid 35 and name c)  (resid 36 and name n)
       (resid 36 and name ca) (resid 36 and name c) 1.0 -107.650 40.82 2
assign (resid 36 and name c)  (resid 37 and name n)
       (resid 37 and name ca) (resid 37 and name c) 1.0 -110.720 33.34 2
assign (resid 37 and name c)  (resid 38 and name n)
       (resid 38 and name ca) (resid 38 and name c) 1.0 -114.660 34.88 2
assign (resid 38 and name c)  (resid 39 and name n)
       (resid 39 and name ca) (resid 39 and name c) 1.0 -108.200 40.24 2
assign (resid 39 and name c)  (resid 40 and name n)
       (resid 40 and name ca) (resid 40 and name c) 1.0 -113.790 38.8 2
assign (resid 43 and name c)  (resid 44 and name n)
       (resid 44 and name ca) (resid 44 and name c) 1.0 -62.140 16.04 2
assign (resid 44 and name c)  (resid 45 and name n)
       (resid 45 and name ca) (resid 45 and name c) 1.0 -65.890 18.24 2
assign (resid 45 and name c)  (resid 46 and name n)
       (resid 46 and name ca) (resid 46 and name c) 1.0 -63.910 6.66 2
assign (resid 46 and name c)  (resid 47 and name n)
       (resid 47 and name ca) (resid 47 and name c) 1.0 -63.890 14.86 2
assign (resid 47 and name c)  (resid 48 and name n)
       (resid 48 and name ca) (resid 48 and name c) 1.0 -66.410 15.06 2
assign (resid 48 and name c)  (resid 49 and name n)
       (resid 49 and name ca) (resid 49 and name c) 1.0 -72.050 24.24 2
assign (resid 49 and name c)  (resid 50 and name n)
       (resid 50 and name ca) (resid 50 and name c) 1.0 -60.020 15.4 2
assign (resid 50 and name c)  (resid 51 and name n)
       (resid 51 and name ca) (resid 51 and name c) 1.0 -64.150 13.58 2
assign (resid 51 and name c)  (resid 52 and name n)
       (resid 52 and name ca) (resid 52 and name c) 1.0 -70.240 20.46 2
assign (resid 52 and name c)  (resid 53 and name n)
       (resid 53 and name ca) (resid 53 and name c) 1.0 -77.130 17.16 2
assign (resid 56 and name c)  (resid 57 and name n)
       (resid 57 and name ca) (resid 57 and name c) 1.0 -127.980 26.38 2
assign (resid 57 and name c)  (resid 58 and name n)
       (resid 58 and name ca) (resid 58 and name c) 1.0 -106.380 22.68 2
assign (resid 58 and name c)  (resid 59 and name n)
       (resid 59 and name ca) (resid 59 and name c) 1.0 -107.790 29.8 2
assign (resid 59 and name c)  (resid 60 and name n)
       (resid 60 and name ca) (resid 60 and name c) 1.0 -118.140 31 2
assign (resid 60 and name c)  (resid 61 and name n)
       (resid 61 and name ca) (resid 61 and name c) 1.0 -99.610 42.98 2
assign (resid 61 and name c)  (resid 62 and name n)
       (resid 62 and name ca) (resid 62 and name c) 1.0 -114.900 48.84 2
assign (resid 63 and name c)  (resid 64 and name n)
       (resid 64 and name ca) (resid 64 and name c) 1.0 -69.550 16.6 2
assign (resid 67 and name c)  (resid 68 and name n)
       (resid 68 and name ca) (resid 68 and name c) 1.0 -61.850 18.86 2
assign (resid 68 and name c)  (resid 69 and name n)
       (resid 69 and name ca) (resid 69 and name c) 1.0 -62.370 12.92 2
assign (resid 69 and name c)  (resid 70 and name n)
       (resid 70 and name ca) (resid 70 and name c) 1.0 -62.900 11.74 2
assign (resid 70 and name c)  (resid 71 and name n)
       (resid 71 and name ca) (resid 71 and name c) 1.0 -65.330 10.24 2
assign (resid 71 and name c)  (resid 72 and name n)
       (resid 72 and name ca) (resid 72 and name c) 1.0 -64.990 14.08 2
assign (resid 72 and name c)  (resid 73 and name n)
       (resid 73 and name ca) (resid 73 and name c) 1.0 -63.160 7.22 2
assign (resid 73 and name c)  (resid 74 and name n)
       (resid 74 and name ca) (resid 74 and name c) 1.0 -63.590 6.6 2
assign (resid 74 and name c)  (resid 75 and name n)
       (resid 75 and name ca) (resid 75 and name c) 1.0 -61.070 11.56 2
assign (resid 75 and name c)  (resid 76 and name n)
       (resid 76 and name ca) (resid 76 and name c) 1.0 -63.740 8.7 2
assign (resid 76 and name c)  (resid 77 and name n)
       (resid 77 and name ca) (resid 77 and name c) 1.0 -60.870 11.62 2
assign (resid 77 and name c)  (resid 78 and name n)
       (resid 78 and name ca) (resid 78 and name c) 1.0 -64.310 4.52 2
assign (resid 79 and name c)  (resid 80 and name n)
       (resid 80 and name ca) (resid 80 and name c) 1.0 -69.750 31.58 2
 assign (resid 84 and name c)  (resid 85 and name n)
       (resid 85 and name ca) (resid 85 and name c) 1.0 -71.540 30.34 2
assign (resid 86 and name c)  (resid 87 and name n)
       (resid 87 and name ca) (resid 87 and name c) 1.0 -93.750 60.02 2
assign (resid 87 and name c)  (resid 88 and name n)
       (resid 88 and name ca) (resid 88 and name c) 1.0 -114.500 30.44 2
assign (resid 88 and name c)  (resid 89 and name n)
       (resid 89 and name ca) (resid 89 and name c) 1.0 -113.200 31.8 2
assign (resid 89 and name c)  (resid 90 and name n)
       (resid 90 and name ca) (resid 90 and name c) 1.0 -127.710 21.02 2
assign (resid 90 and name c)  (resid 91 and name n)
       (resid 91 and name ca) (resid 91 and name c) 1.0 -118.190 39.8 2
assign (resid 92 and name c)  (resid 93 and name n)
       (resid 93 and name ca) (resid 93 and name c) 1.0 -86.960 28.74 2
assign (resid 96 and name c)  (resid 97 and name n)
       (resid 97 and name ca) (resid 97 and name c) 1.0 -99.730 60.92 2
assign (resid 98 and name c)  (resid 99 and name n)
       (resid 99 and name ca) (resid 99 and name c) 1.0 -63.480 18.98 2
assign (resid 99 and name c)  (resid 100 and name n)
       (resid 100 and name ca) (resid 100 and name c) 1.0 -69.430 20.58 2
assign (resid 100 and name c)  (resid 101 and name n)
       (resid 101 and name ca) (resid 101 and name c) 1.0 -63.380 10.02 2
assign (resid 101 and name c)  (resid 102 and name n)
       (resid 102 and name ca) (resid 102 and name c) 1.0 -63.850 11.6 2
assign (resid 102 and name c)  (resid 103 and name n)
       (resid 103 and name ca) (resid 103 and name c) 1.0 -80.670 36.44 2
assign (resid 103 and name c)  (resid 104 and name n)
       (resid 104 and name ca) (resid 104 and name c) 1.0 -97.600 67.86 2
assign (resid 104 and name c)  (resid 105 and name n)
       (resid 105 and name ca) (resid 105 and name c) 1.0 -65.770 20.2 2
assign (resid 106 and name c)  (resid 107 and name n)
       (resid 107 and name ca) (resid 107 and name c) 1.0 -124.120 36.94 2
assign (resid 107 and name c)  (resid 108 and name n)
       (resid 108 and name ca) (resid 108 and name c) 1.0 -111.790 18.78 2
assign (resid 110 and name c)  (resid 111 and name n)
       (resid 111 and name ca) (resid 111 and name c) 1.0 -98.390 60.76 2
assign (resid 114 and name c)  (resid 115 and name n)
       (resid 115 and name ca) (resid 115 and name c) 1.0 -62.900 10.26 2
assign (resid 115 and name c)  (resid 116 and name n)
       (resid 116 and name ca) (resid 116 and name c) 1.0 -65.670 9.08 2
assign (resid 116 and name c)  (resid 117 and name n)
       (resid 117 and name ca) (resid 117 and name c) 1.0 -64.410 12.58 2
assign (resid 117 and name c)  (resid 118 and name n)
       (resid 118 and name ca) (resid 118 and name c) 1.0 -61.260 10.04 2
assign (resid 118 and name c)  (resid 119 and name n)
       (resid 119 and name ca) (resid 119 and name c) 1.0 -67.530 14.12 2
assign (resid 119 and name c)  (resid 120 and name n)
       (resid 120 and name ca) (resid 120 and name c) 1.0 -66.720 20.04 2
assign (resid 120 and name c)  (resid 121 and name n)
       (resid 121 and name ca) (resid 121 and name c) 1.0 -60.850 6.5 2
assign (resid 121 and name c)  (resid 122 and name n)
       (resid 122 and name ca) (resid 122 and name c) 1.0 -65.320 10.26 2
assign (resid 125 and name c)  (resid 126 and name n)
       (resid 126 and name ca) (resid 126 and name c) 1.0 -66.980 17.66 2

! Psi from TALOS
assign (resid 12 and name n)  (resid 12 and name ca)
       (resid 12 and name c) (resid 13 and name n) 1.0 136.550 28.94 2
assign (resid 13 and name n)  (resid 13 and name ca)
       (resid 13 and name c) (resid 14 and name n) 1.0 129.540 24.96 2
assign (resid 14 and name n)  (resid 14 and name ca)
       (resid 14 and name c) (resid 15 and name n) 1.0 123.350 17.18 2
assign (resid 15 and name n)  (resid 15 and name ca)
       (resid 15 and name c) (resid 16 and name n) 1.0 128.230 10.68 2
assign (resid 16 and name n)  (resid 16 and name ca)
       (resid 16 and name c) (resid 17 and name n) 1.0 126.080 21.68 2
assign (resid 17 and name n)  (resid 17 and name ca)
       (resid 17 and name c) (resid 18 and name n) 1.0 133.910 36.66 2
assign (resid 18 and name n)  (resid 18 and name ca)
       (resid 18 and name c) (resid 19 and name n) 1.0 157.250 26.56 2
assign (resid 20 and name n)  (resid 20 and name ca)
       (resid 20 and name c) (resid 21 and name n) 1.0 -26.650 60.06 2
assign (resid 21 and name n)  (resid 21 and name ca)
       (resid 21 and name c) (resid 22 and name n) 1.0 -41.650 18.24 2
assign (resid 22 and name n)  (resid 22 and name ca)
       (resid 22 and name c) (resid 23 and name n) 1.0 -40.180 5.3 2
assign (resid 23 and name n)  (resid 23 and name ca)
       (resid 23 and name c) (resid 24 and name n) 1.0 -41.170 8.52 2
assign (resid 24 and name n)  (resid 24 and name ca)
       (resid 24 and name c) (resid 25 and name n) 1.0 -41.630 15.84 2
assign (resid 25 and name n)  (resid 25 and name ca)
       (resid 25 and name c) (resid 26 and name n) 1.0 -44.020 9.42 2
assign (resid 26 and name n)  (resid 26 and name ca)
       (resid 26 and name c) (resid 27 and name n) 1.0 -43.040 10.72 2
assign (resid 27 and name n)  (resid 27 and name ca)
       (resid 27 and name c) (resid 28 and name n) 1.0 -42.610 15.28 2
assign (resid 28 and name n)  (resid 28 and name ca)
       (resid 28 and name c) (resid 29 and name n) 1.0 -44.780 13.64 2
assign (resid 29 and name n)  (resid 29 and name ca)
       (resid 29 and name c) (resid 30 and name n) 1.0 -44.040 13.94 2
assign (resid 30 and name n)  (resid 30 and name ca)
       (resid 30 and name c) (resid 31 and name n) 1.0 -37.110 10.96 2
assign (resid 31 and name n)  (resid 31 and name ca)
       (resid 31 and name c) (resid 32 and name n) 1.0 -39.620 8.12 2
assign (resid 32 and name n)  (resid 32 and name ca)
       (resid 32 and name c) (resid 33 and name n) 1.0 -21.830 13.46 2
assign (resid 33 and name n)  (resid 33 and name ca)
       (resid 33 and name c) (resid 34 and name n) 1.0 -3.080 19.18 2
assign (resid 35 and name n)  (resid 35 and name ca)
       (resid 35 and name c) (resid 36 and name n) 1.0 129.400 29.7 2
assign (resid 36 and name n)  (resid 36 and name ca)
       (resid 36 and name c) (resid 37 and name n) 1.0 120.800 49.46 2
assign (resid 37 and name n)  (resid 37 and name ca)
       (resid 37 and name c) (resid 38 and name n) 1.0 129.700 29.08 2
assign (resid 38 and name n)  (resid 38 and name ca)
       (resid 38 and name c) (resid 39 and name n) 1.0 121.910 13.4 2
assign (resid 39 and name n)  (resid 39 and name ca)
       (resid 39 and name c) (resid 40 and name n) 1.0 122.990 30.74 2
assign (resid 40 and name n)  (resid 40 and name ca)
       (resid 40 and name c) (resid 41 and name n) 1.0 144.960 30.22 2
assign (resid 44 and name n)  (resid 44 and name ca)
       (resid 44 and name c) (resid 45 and name n) 1.0 -43.110 13.76 2
assign (resid 45 and name n)  (resid 45 and name ca)
       (resid 45 and name c) (resid 46 and name n) 1.0 -40.230 16.4 2
assign (resid 46 and name n)  (resid 46 and name ca)
       (resid 46 and name c) (resid 47 and name n) 1.0 -40.790 7.52 2
assign (resid 47 and name n)  (resid 47 and name ca)
       (resid 47 and name c) (resid 48 and name n) 1.0 -40.180 17.76 2
assign (resid 48 and name n)  (resid 48 and name ca)
       (resid 48 and name c) (resid 49 and name n) 1.0 -39.650 11.22 2
assign (resid 49 and name n)  (resid 49 and name ca)
       (resid 49 and name c) (resid 50 and name n) 1.0 -38.940 18.82 2
assign (resid 50 and name n)  (resid 50 and name ca)
       (resid 50 and name c) (resid 51 and name n) 1.0 -43.390 11.88 2
assign (resid 51 and name n)  (resid 51 and name ca)
       (resid 51 and name c) (resid 52 and name n) 1.0 -39.320 10 2
assign (resid 52 and name n)  (resid 52 and name ca)
       (resid 52 and name c) (resid 53 and name n) 1.0 -33.620 24.72 2
assign (resid 53 and name n)  (resid 53 and name ca)
       (resid 53 and name c) (resid 54 and name n) 1.0 -29.930 31.96 2
assign (resid 57 and name n)  (resid 57 and name ca)
       (resid 57 and name c) (resid 58 and name n) 1.0 151.660 21.08 2
assign (resid 58 and name n)  (resid 58 and name ca)
       (resid 58 and name c) (resid 59 and name n) 1.0 125.830 24.68 2
assign (resid 59 and name n)  (resid 59 and name ca)
       (resid 59 and name c) (resid 60 and name n) 1.0 130.960 23.84 2
assign (resid 60 and name n)  (resid 60 and name ca)
       (resid 60 and name c) (resid 61 and name n) 1.0 126.130 16.9 2
assign (resid 61 and name n)  (resid 61 and name ca)
       (resid 61 and name c) (resid 62 and name n) 1.0 138.690 13.36 2
! assign (resid 62 and name n)  (resid 62 and name ca) ! rm 010606
!       (resid 62 and name c) (resid 63 and name n) 1.0 128.890 19.2 2
! assign (resid 64 and name n)  (resid 64 and name ca)
!       (resid 64 and name c) (resid 65 and name n) 1.0 146.630 28.6 2
assign (resid 68 and name n)  (resid 68 and name ca)
       (resid 68 and name c) (resid 69 and name n) 1.0 -38.510 17.4 2
assign (resid 69 and name n)  (resid 69 and name ca)
       (resid 69 and name c) (resid 70 and name n) 1.0 -44.000 28.94 2
assign (resid 70 and name n)  (resid 70 and name ca)
       (resid 70 and name c) (resid 71 and name n) 1.0 -41.460 8.54 2
assign (resid 71 and name n)  (resid 71 and name ca)
       (resid 71 and name c) (resid 72 and name n) 1.0 -39.860 11.54 2
assign (resid 72 and name n)  (resid 72 and name ca)
       (resid 72 and name c) (resid 73 and name n) 1.0 -46.080 6.56 2
assign (resid 73 and name n)  (resid 73 and name ca)
       (resid 73 and name c) (resid 74 and name n) 1.0 -37.930 12.3 2
assign (resid 74 and name n)  (resid 74 and name ca)
       (resid 74 and name c) (resid 75 and name n) 1.0 -41.610 11.54 2
assign (resid 75 and name n)  (resid 75 and name ca)
       (resid 75 and name c) (resid 76 and name n) 1.0 -48.630 16.54 2
assign (resid 76 and name n)  (resid 76 and name ca)
       (resid 76 and name c) (resid 77 and name n) 1.0 -38.140 10.5 2
assign (resid 77 and name n)  (resid 77 and name ca)
       (resid 77 and name c) (resid 78 and name n) 1.0 -41.290 13.66 2
assign (resid 78 and name n)  (resid 78 and name ca)
       (resid 78 and name c) (resid 79 and name n) 1.0 -41.340 23.3 2
 assign (resid 80 and name n)  (resid 80 and name ca)
       (resid 80 and name c) (resid 81 and name n) 1.0 -25.140 45.72 2
assign (resid 85 and name n)  (resid 85 and name ca)
       (resid 85 and name c) (resid 86 and name n) 1.0 144.280 34.48 2
assign (resid 87 and name n)  (resid 87 and name ca)
       (resid 87 and name c) (resid 88 and name n) 1.0 139.360 54.9 2
assign (resid 88 and name n)  (resid 88 and name ca)
       (resid 88 and name c) (resid 89 and name n) 1.0 132.350 27.52 2
assign (resid 89 and name n)  (resid 89 and name ca)
       (resid 89 and name c) (resid 90 and name n) 1.0 139.610 27.64 2
assign (resid 90 and name n)  (resid 90 and name ca)
       (resid 90 and name c) (resid 91 and name n) 1.0 140.380 33.16 2
assign (resid 91 and name n)  (resid 91 and name ca)
       (resid 91 and name c) (resid 92 and name n) 1.0 134.400 39.78 2
assign (resid 93 and name n)  (resid 93 and name ca)
       (resid 93 and name c) (resid 94 and name n) 1.0 149.290 45.48 2
assign (resid 97 and name n)  (resid 97 and name ca)
       (resid 97 and name c) (resid 98 and name n) 1.0 122.410 30.2 2
assign (resid 99 and name n)  (resid 99 and name ca)
       (resid 99 and name c) (resid 100 and name n) 1.0 -29.220 37.2 2
assign (resid 100 and name n)  (resid 100 and name ca)
       (resid 100 and name c) (resid 101 and name n) 1.0 -41.830 9.98 2
assign (resid 101 and name n)  (resid 101 and name ca)
       (resid 101 and name c) (resid 102 and name n) 1.0 -42.790 10.42 2
assign (resid 102 and name n)  (resid 102 and name ca)
       (resid 102 and name c) (resid 103 and name n) 1.0 -29.950 25.78 2
assign (resid 103 and name n)  (resid 103 and name ca)
       (resid 103 and name c) (resid 104 and name n) 1.0 -29.350 24.92 2
assign (resid 104 and name n)  (resid 104 and name ca)
       (resid 104 and name c) (resid 105 and name n) 1.0 129.690 54.52 2
assign (resid 105 and name n)  (resid 105 and name ca)
       (resid 105 and name c) (resid 106 and name n) 1.0 -34.170 14.72 2
assign (resid 107 and name n)  (resid 107 and name ca)
       (resid 107 and name c) (resid 108 and name n) 1.0 124.840 18.36 2
assign (resid 108 and name n)  (resid 108 and name ca)
       (resid 108 and name c) (resid 109 and name n) 1.0 131.870 37.18 2
assign (resid 111 and name n)  (resid 111 and name ca)
       (resid 111 and name c) (resid 112 and name n) 1.0 134.660 21.92 2
assign (resid 115 and name n)  (resid 115 and name ca)
       (resid 115 and name c) (resid 116 and name n) 1.0 -39.320 18.1 2
assign (resid 116 and name n)  (resid 116 and name ca)
       (resid 116 and name c) (resid 117 and name n) 1.0 -39.940 13.08 2
assign (resid 117 and name n)  (resid 117 and name ca)
       (resid 117 and name c) (resid 118 and name n) 1.0 -47.060 5.92 2
assign (resid 118 and name n)  (resid 118 and name ca)
       (resid 118 and name c) (resid 119 and name n) 1.0 -38.660 10.22 2
assign (resid 119 and name n)  (resid 119 and name ca)
       (resid 119 and name c) (resid 120 and name n) 1.0 -38.190 20.58 2
assign (resid 120 and name n)  (resid 120 and name ca)
       (resid 120 and name c) (resid 121 and name n) 1.0 -42.050 13.94 2
assign (resid 121 and name n)  (resid 121 and name ca)
       (resid 121 and name c) (resid 122 and name n) 1.0 -44.250 15.58 2
assign (resid 122 and name n)  (resid 122 and name ca)
       (resid 122 and name c) (resid 123 and name n) 1.0 -35.770 28.2 2
assign (resid 126 and name n)  (resid 126 and name ca)
       (resid 126 and name c) (resid 127 and name n) 1.0 146.630 27 2
! set message=on echo=on end
 end

! A10
assign (resid   9 and name c ) (resid  10 and name n )
       (resid  10 and name ca) (resid  10 and name c )        5.9 0.5
! H12
assign (resid  11 and name c ) (resid  12 and name n )
       (resid  12 and name ca) (resid  12 and name c )        7.7 0.5
! I13
assign (resid  12 and name c ) (resid  13 and name n )
       (resid  13 and name ca) (resid  13 and name c )        9.8 0.5
! L14
assign (resid  13 and name c ) (resid  14 and name n )
       (resid  14 and name ca) (resid  14 and name c )       10.2 0.5
! L15
assign (resid  14 and name c ) (resid  15 and name n )
       (resid  15 and name ca) (resid  15 and name c )        8.5 0.5
! L16
assign (resid  15 and name c ) (resid  16 and name n )
       (resid  16 and name ca) (resid  16 and name c )        9.6 0.5
! E17
assign (resid  16 and name c ) (resid  17 and name n )
       (resid  17 and name ca) (resid  17 and name c )        6.5 0.5
! E21
assign (resid  20 and name c ) (resid  21 and name n )
       (resid  21 and name ca) (resid  21 and name c )        5.3 0.5
! A23
! T24
assign (resid  23 and name c ) (resid  24 and name n )
       (resid  24 and name ca) (resid  24 and name c )        4.7 0.5
! V25
assign (resid  24 and name c ) (resid  25 and name n )
       (resid  25 and name ca) (resid  25 and name c )        2.9 0.5
! V26
assign (resid  25 and name c ) (resid  26 and name n )
       (resid  26 and name ca) (resid  26 and name c )        3.3 0.5
! E28
assign (resid  27 and name c ) (resid  28 and name n )
       (resid  28 and name ca) (resid  28 and name c )        4.7 0.5
! L30
assign (resid  29 and name c ) (resid  30 and name n )
       (resid  30 and name ca) (resid  30 and name c )        5.3 0.5
! T31
assign (resid  30 and name c ) (resid  31 and name n )
       (resid  31 and name ca) (resid  31 and name c )        2.6 0.5
! F35
assign (resid  34 and name c ) (resid  35 and name n )
       (resid  35 and name ca) (resid  35 and name c )        8.2 0.5
! K36
assign (resid  35 and name c ) (resid  36 and name n )
       (resid  36 and name ca) (resid  36 and name c )        8.9 0.5
! V37
assign (resid  36 and name c ) (resid  37 and name n )
       (resid  37 and name ca) (resid  37 and name c )        9.5 0.5
! I38
assign (resid  37 and name c ) (resid  38 and name n )
       (resid  38 and name ca) (resid  38 and name c )        9.7 0.5
! W39
assign (resid  38 and name c ) (resid  39 and name n )
       (resid  39 and name ca) (resid  39 and name c )        8.0 0.5
! L40
assign (resid  39 and name c ) (resid  40 and name n )
       (resid  40 and name ca) (resid  40 and name c )       10.1 0.5
! V41
assign (resid  40 and name c ) (resid  41 and name n )
       (resid  41 and name ca) (resid  41 and name c )        9.2 0.5
! D42
assign (resid  41 and name c ) (resid  42 and name n )
       (resid  42 and name ca) (resid  42 and name c )        7.8 0.5
! S44
assign (resid  43 and name c ) (resid  44 and name n )
       (resid  44 and name ca) (resid  44 and name c )        4.2 0.5
! T45
assign (resid  44 and name c ) (resid  45 and name n )
       (resid  45 and name ca) (resid  45 and name c )        4.9 0.5
! A46
assign (resid  45 and name c ) (resid  46 and name n )
       (resid  46 and name ca) (resid  46 and name c )        4.4 0.5
! L47
assign (resid  46 and name c ) (resid  47 and name n )
       (resid  47 and name ca) (resid  47 and name c )        3.7 0.5
! D48
assign (resid  47 and name c ) (resid  48 and name n )
       (resid  48 and name ca) (resid  48 and name c )        4.8 0.5
! Q49
assign (resid  48 and name c ) (resid  49 and name n )
       (resid  49 and name ca) (resid  49 and name c )        7.9 0.5
! L50
assign (resid  49 and name c ) (resid  50 and name n )
       (resid  50 and name ca) (resid  50 and name c )        2.1 0.5
! D51
assign (resid  50 and name c ) (resid  51 and name n )
       (resid  51 and name ca) (resid  51 and name c )        4.8 0.5
! L52
assign (resid  51 and name c ) (resid  52 and name n )
       (resid  52 and name ca) (resid  52 and name c )        6.7 0.5
! L53
assign (resid  52 and name c ) (resid  53 and name n )
       (resid  53 and name ca) (resid  53 and name c )        6.3 0.5
! Q54
assign (resid  53 and name c ) (resid  54 and name n )
       (resid  54 and name ca) (resid  54 and name c )        6.9 0.5
! I56
assign (resid  55 and name c ) (resid  56 and name n )
       (resid  56 and name ca) (resid  56 and name c )        9.2 0.5
! V57
assign (resid  56 and name c ) (resid  57 and name n )
       (resid  57 and name ca) (resid  57 and name c )        8.2 0.5
! I58
assign (resid  57 and name c ) (resid  58 and name n )
       (resid  58 and name ca) (resid  58 and name c )        8.9 0.5
! L59
assign (resid  58 and name c ) (resid  59 and name n )
       (resid  59 and name ca) (resid  59 and name c )        9.1 0.5
! M60
assign (resid  59 and name c ) (resid  60 and name n )
       (resid  60 and name ca) (resid  60 and name c )        9.2 0.5
! A61
assign (resid  60 and name c ) (resid  61 and name n )
       (resid  61 and name ca) (resid  61 and name c )        4.5 0.5
! W62
assign (resid  61 and name c ) (resid  62 and name n )
       (resid  62 and name ca) (resid  62 and name c )        9.6 0.5
! D66
assign (resid  65 and name c ) (resid  66 and name n )
       (resid  66 and name ca) (resid  66 and name c )        7.1 0.5
! Q67
assign (resid  66 and name c ) (resid  67 and name n )
       (resid  67 and name ca) (resid  67 and name c )        4.0 0.5
! S68
assign (resid  67 and name c ) (resid  68 and name n )
       (resid  68 and name ca) (resid  68 and name c )        5.4 0.5
! C69
assign (resid  68 and name c ) (resid  69 and name n )
       (resid  69 and name ca) (resid  69 and name c )        4.4 0.5
! L70
assign (resid  69 and name c ) (resid  70 and name n )
       (resid  70 and name ca) (resid  70 and name c )        5.6 0.5
! L71
assign (resid  70 and name c ) (resid  71 and name n )
       (resid  71 and name ca) (resid  71 and name c )        5.9 0.5
! L72
assign (resid  71 and name c ) (resid  72 and name n )
       (resid  72 and name ca) (resid  72 and name c )        3.8 0.5
! L73
assign (resid  72 and name c ) (resid  73 and name n )
       (resid  73 and name ca) (resid  73 and name c )        4.0 0.5
! Q74
assign (resid  73 and name c ) (resid  74 and name n )
       (resid  74 and name ca) (resid  74 and name c )        4.4 0.5
! H75
assign (resid  74 and name c ) (resid  75 and name n )
       (resid  75 and name ca) (resid  75 and name c )        3.5 0.5
! L76
assign (resid  75 and name c ) (resid  76 and name n )
       (resid  76 and name ca) (resid  76 and name c )        2.5 0.5
! R77
assign (resid  76 and name c ) (resid  77 and name n )
       (resid  77 and name ca) (resid  77 and name c )        5.3 0.5
! E78
assign (resid  77 and name c ) (resid  78 and name n )
       (resid  78 and name ca) (resid  78 and name c )        5.8 0.5
! Q80
assign (resid  79 and name c ) (resid  80 and name n )
       (resid  80 and name ca) (resid  80 and name c )        4.2 0.5
! A81
assign (resid  80 and name c ) (resid  81 and name n )
       (resid  81 and name ca) (resid  81 and name c )        7.9 0.5
! D82
assign (resid  81 and name c ) (resid  82 and name n )
       (resid  82 and name ca) (resid  82 and name c )        5.7 0.5
! H84
! L87
assign (resid  86 and name c ) (resid  87 and name n )
       (resid  87 and name ca) (resid  87 and name c )        6.3 0.5
! V88
assign (resid  87 and name c ) (resid  88 and name n )
       (resid  88 and name ca) (resid  88 and name c )        9.5 0.5
! L89
assign (resid  88 and name c ) (resid  89 and name n )
       (resid  89 and name ca) (resid  89 and name c )        9.9 0.5
! F90
assign (resid  89 and name c ) (resid  90 and name n )
       (resid  90 and name ca) (resid  90 and name c )        9.4 0.5
! L91
assign (resid  90 and name c ) (resid  91 and name n )
       (resid  91 and name ca) (resid  91 and name c )        8.1 0.5
! E93
assign (resid  92 and name c ) (resid  93 and name n )
       (resid  93 and name ca) (resid  93 and name c )        8.2 0.5
! V96
assign (resid  95 and name c ) (resid  96 and name n )
       (resid  96 and name ca) (resid  96 and name c )        7.7 0.5
! D97
assign (resid  96 and name c ) (resid  97 and name n )
       (resid  97 and name ca) (resid  97 and name c )        5.4 0.5
! L99
assign (resid  98 and name c ) (resid  99 and name n )
       (resid  99 and name ca) (resid  99 and name c )        6.2 0.5
! L100
assign (resid  99 and name c ) (resid 100 and name n )
       (resid 100 and name ca) (resid 100 and name c )        7.8 0.5
! T101
assign (resid 100 and name c ) (resid 101 and name n )
       (resid 101 and name ca) (resid 101 and name c )        4.5 0.5
! A102
assign (resid 101 and name c ) (resid 102 and name n )
       (resid 102 and name ca) (resid 102 and name c )        4.6 0.5
! Q103
assign (resid 102 and name c ) (resid 103 and name n )
       (resid 103 and name ca) (resid 103 and name c )        6.8 0.5
! A104
assign (resid 103 and name c ) (resid 104 and name n )
       (resid 104 and name ca) (resid 104 and name c )        5.8 0.5
! S105
assign (resid 104 and name c ) (resid 105 and name n )
       (resid 105 and name ca) (resid 105 and name c )        8.2 0.5
! A106
assign (resid 105 and name c ) (resid 106 and name n )
       (resid 106 and name ca) (resid 106 and name c )        5.0 0.5
! I107
assign (resid 106 and name c ) (resid 107 and name n )
       (resid 107 and name ca) (resid 107 and name c )        7.1 0.5
! L108
assign (resid 107 and name c ) (resid 108 and name n )
       (resid 108 and name ca) (resid 108 and name c )        9.9 0.5
! S109
assign (resid 108 and name c ) (resid 109 and name n )
       (resid 109 and name ca) (resid 109 and name c )        5.4 0.5
! K110
assign (resid 109 and name c ) (resid 110 and name n )
       (resid 110 and name ca) (resid 110 and name c )        9.1 0.5
! L112
assign (resid 111 and name c ) (resid 112 and name n )
       (resid 112 and name ca) (resid 112 and name c )        4.3 0.5
! D113
assign (resid 112 and name c ) (resid 113 and name n )
       (resid 113 and name ca) (resid 113 and name c )        8.3 0.5
! Q115
assign (resid 114 and name c ) (resid 115 and name n )
       (resid 115 and name ca) (resid 115 and name c )        7.2 0.5
! L116
assign (resid 115 and name c ) (resid 116 and name n )
       (resid 116 and name ca) (resid 116 and name c )        5.7 0.5
! L117
assign (resid 116 and name c ) (resid 117 and name n )
       (resid 117 and name ca) (resid 117 and name c )        3.1 0.5
! L118
assign (resid 117 and name c ) (resid 118 and name n )
       (resid 118 and name ca) (resid 118 and name c )        4.5 0.5
! T119
assign (resid 118 and name c ) (resid 119 and name n )
       (resid 119 and name ca) (resid 119 and name c )        4.0 0.5
! T120
assign (resid 119 and name c ) (resid 120 and name n )
       (resid 120 and name ca) (resid 120 and name c )        4.6 0.5
! L121
assign (resid 120 and name c ) (resid 121 and name n )
       (resid 121 and name ca) (resid 121 and name c )        4.9 0.5
! Q122
assign (resid 121 and name c ) (resid 122 and name n )
       (resid 122 and name ca) (resid 122 and name c )        4.9 0.5
! L124
assign (resid 123 and name c ) (resid 124 and name n )
       (resid 124 and name ca) (resid 124 and name c )        7.5 0.5
! C125
assign (resid 124 and name c ) (resid 125 and name n )
      (resid 125 and name ca) (resid 125 and name c )        9.1 0.5

! N128
assign (resid 127 and name c ) (resid 128 and name n )
       (resid 128 and name ca) (resid 128 and name c )        7.9 0.5

! H12
assign (resid  12 and name   HA ) (resid  36 and name  HB# )  4.0  2.2  1.5 ! A.524  at -5.04e+05
assign (resid  12 and name  HB# ) (resid  55 and name   HA )  4.0  2.2  1.5 ! A.946  at 7.16e+05

! I13
assign (resid  13 and name   HA ) (resid  13 and name HG1# )  4.0  2.2  2.5 ! A.1031 at 4.06e+05
assign (resid  13 and name HD1# ) (resid  13 and name   HB )  4.0  2.2  1.5 ! A.121  at -6.01e+05
assign (resid  13 and name HG2# ) (resid  13 and name   HA )  2.5  0.7  0.7 ! A.82   at 1.69e+06
assign (resid  13 and name HD1# ) (resid  13 and name   HA )  4.0  2.2  1.5 ! A.2650 at 6.79e+05
assign (resid  13 and name HD1# ) (resid  30 and name   HG )  4.0  2.2  2.0 ! A.3234 at 9.90e+05(wd)
assign (resid  13 and name HG2# ) (resid  30 and name   HG )  4.0  2.2  2.5 ! A.3230 at 8.52e+05
assign (resid  13 and name HD1# ) (resid  30 and name HD* )  4.0  2.2  2.0 ! A.2666 at 5.56e+05
assign (resid  13 and name HD1# ) (resid  35 and name  HD1 )  4.0  2.2  2.5 ! A.2664 at -5.18e+05(wd)
assign (resid  13 and name HD1# ) (resid  35 and name  HB# )  4.0  2.2  2.5 ! A.2659 at -3.69e+05
assign (resid  13 and name   HB ) (resid  37 and name   HA )  3.0  1.2  0.3 ! A.2953 at -1.43e+06
assign (resid  13 and name   HB ) (resid  37 and name HG* )  4.0  2.2  1.0 ! A.123  at -1.45e+06
assign (resid  13 and name HG2# ) (resid  37 and name HG* )  4.0  2.2  2.5 ! A.144  at 2.07e+06
assign (resid  13 and name HG2# ) (resid  57 and name HG* )  4.0  2.2  2.0 ! A.2913 at 9.00e+05
assign (resid  13 and name HD1# ) (resid  57 and name HG* )  4.0  2.2  1.0 ! A.2909 at 1.33e+06
assign (resid  13 and name HD1# ) (resid  56 and name HD1# )  4.0  2.2  2.5 ! A.292 at 6.21e+05 (Queen 050606)
assign (resid  13 and name   HA ) (resid  57 and name   HB )  4.0  2.2  2.0 ! A.1015 at -4.11e+05
assign (resid  13 and name HD1# ) (resid  57 and name   HB )  4.0  2.2  2.5 ! A.156  at -8.35e+05
assign (resid  13 and name HG2# ) (resid  57 and name   HB )  4.0  2.2  1.5 ! A.141  at -9.86e+05(wd)
assign (resid  13 and name HG2# ) (resid  59 and name   HG )  4.0  2.2  2.5 ! A.149  at 7.82e+05
assign (resid  13 and name HD1# ) (resid  59 and name   HD* )  4.0  2.2  2.5 ! A.172  at 5.92e+05 (Queen 050606) 

! L14
assign (resid  14 and name   HG ) (resid  14 and name   HA )  4.0  2.2  1.0 ! A.162  at -5.06e+05
assign (resid  14 and name HD* ) (resid  14 and name  HB# )  2.5  0.7  1.2 ! A.171  at -3.63e+06
assign (resid  14 and name   HA ) (resid  38 and name   HB )  4.0  2.2  1.0 ! A.576  at 7.78e+05
assign (resid  14 and name   HA ) (resid  38 and name HG2# )  4.0  2.2  2.5 ! A.159  at -3.59e+05
assign (resid  14 and name HD* ) (resid  38 and name   HB )  4.0  2.2  1.5 ! A.585  at -5.86e+05
assign (resid  14 and name HD* ) (resid  38 and name HG2# )  4.0  2.2  2.5 ! A.600  at 1.21e+06
assign (resid  14 and name HD* ) (resid  40 and name   HG )  4.0  2.2  1.5 ! A.644  at 7.46e+06(wd,ov)
assign (resid  14 and name HD* ) (resid  46 and name   HA )  4.0  2.2  2.5 ! A.749  at 8.98e+05
assign (resid  14 and name   HG ) (resid  58 and name HG1# )  4.0  2.2  1.5 ! A.775  at 2.33e+06
assign (resid  14 and name HD* ) (resid  58 and name HG1# )  4.0  2.2  2.0 ! A.1053 at 6.95e+05
assign (resid  14 and name  HB# ) (resid  58 and name HG1# )  4.0  2.2  2.5 ! A.1047 at -3.98e+05
assign (resid  14 and name  HB# ) (resid  58 and name HG2# )  4.0  2.2  2.0 ! A.1056 at -4.80e+05
assign (resid  14 and name  HB# ) (resid  58 and name   HA )  4.0  2.2  2.5 ! A.1038 at -3.97e+05

! L15
assign (resid  15 and name HD* ) (resid  15 and name   HA )  4.0  2.2  2.0 ! A.3295 at -9.56e+05
assign (resid  15 and name HD* ) (resid  17 and name  HB# )  4.0  2.2  2.5 ! A.2694 at -3.87e+05
assign (resid  15 and name  HB# ) (resid  39 and name   HA )  4.0  2.2  2.5 ! A.612  at -4.38e+05

! L16
assign (resid  16 and name   HA ) (resid  16 and name   HG )  3.0  1.2  0.3 ! A.229  at 1.13e+06
assign (resid  16 and name   HA ) (resid  16 and name HD* )  3.0  1.2  0.8 ! A.3036 at 1.93e+06
assign (resid  16 and name HD* ) (resid  16 and name  HB# )  3.0  1.2  1.3 ! A.3304 at -1.17e+06
assign (resid  16 and name HD* ) (resid  40 and name   HA )  4.0  2.2  2.5 ! A.2624 at -6.31e+05
assign (resid  16 and name HG ) (resid  46 and name  HB# )  4.0  2.2  2.5 ! A.1129  at 5.25e+05 (Queen 050606)
assign (resid  16 and name HD* ) (resid  46 and name  HB# )  4.0  2.2  1.0 ! A.756  at 4.40e+06
assign (resid  16 and name HD* ) (resid  58 and name HG2# )  4.0  2.2  1.5  ! A.1055 at 2.96e+06
assign (resid  16 and name HD* ) (resid  60 and name  HG# )  4.0  2.2  2.0 ! A.1116 at 4.67e+05
assign (resid  16 and name  HB# ) (resid  60 and name  HG# )  4.0  2.2  2.5 ! A.1112 at -3.23e+05
assign (resid  16 and name  HB# ) (resid  60 and name   HA )  4.0  2.2  1.5 ! A.1107 at -8.19e+05
assign (resid  16 and name HD* ) (resid  60 and name  HE# )  4.0  2.2  1.0 ! A.2828 at 7.99e+06

! E17
assign (resid  17 and name   HA ) (resid  61 and name  HB# )  2.5  0.7  0.7 ! A.274  at 1.48e+06

! E18

! E19
assign (resid  19 and name  HG# ) (resid  19 and name   HA )  3.0  1.2  0.8 ! A.3025 at -1.13e+06
assign (resid  19 and name  HG# ) (resid  21 and name   HA )  4.0  2.2  1.5 ! A.364  at -6.86e+05

! D20

! E21
assign (resid  21 and name   HA ) (resid  24 and name   HB )  3.0  1.2  0.3 ! A.281  at 1.01e+06
assign (resid  21 and name   HA ) (resid  24 and name HG2# )  4.0  2.2  2.5 ! A.284  at 3.97e+05

! A22
assign (resid  22 and name   HA ) (resid  25 and name   HB )  3.0  1.2  0.3 ! A.14   at 1.27e+06
assign (resid  22 and name  HB# ) (resid  25 and name   HB )  4.0  2.2  2.5 ! A.2743 at 3.42e+05
assign (resid  22 and name   HA ) (resid  25 and name HG* )  4.0  2.2  1.5 ! A.17   at 5.64e+05
! assign (resid  22 and name   HA ) (resid 112 and name   HG )  4.0  2.2  1.0 ! A.3327 at 5.85e+05 (Queen 041706)

! A23
assign (resid  23 and name   HA ) (resid  26 and name   HB )  4.0  2.2  2.0 ! A.296  at 3.50e+05

! assign (resid  23 and name   HA ) (resid 111 and name  HB# )  4.0  2.2  2.5 ! A.3177 at -8.91e+05 (Queen 042306) 

! T24
assign (resid  24 and name HG2# ) (resid  24 and name   HA )  3.0  1.2  0.8 ! A.300  at 1..77e+06 
assign (resid  24 and name   HA ) (resid  27 and name  HB# )  4.0  2.2  1.5 ! A.301  at 6.83e+05

! V25
assign (resid  25 and name HG* ) (resid  25 and name   HA )  3.0  1.2  0.8 ! A.6    at 3.80e+06
! assign (resid  25 and name HG* ) (resid  25 and name   HA )  2.5  0.7  0.7 ! A.7    at 2.79e+06
assign (resid  25 and name HG* ) (resid  26 and name   HA )  4.0  2.2  2.5 ! A.327  at 4.96e+05
assign (resid  25 and name   HA ) (resid  28 and name  HB# )  3.0  1.2  0.8 ! A.4    at 9.01e+05

! V26
assign (resid  26 and name HG* ) (resid  26 and name   HA )  2.5  0.7  0.7 ! A.336  at 2.33e+06

! C27
assign (resid  27 and name  HB# ) (resid  37 and name HG* )  4.0  2.2  2.5 ! A.2751 at 3.07e+05
assign (resid  27 and name   HA ) (resid  37 and name HG* )  4.0  2.2  1.0 ! A.3376 at 1.64e+06
assign (resid  27 and name   HA ) (resid  37 and name   HB )  4.0  2.2  2.0 ! A.551  at -4.07e+05

! E28
assign (resid  28 and name  HG# ) (resid  29 and name  HB# )  4.0  2.2  2.5 ! A.2758 at -8.85e+05
assign (resid  28 and name   HA ) (resid  31 and name   HB )  3.0  1.2  0.3 ! A.437  at 1.45e+06
assign (resid  28 and name   HA ) (resid  31 and name HG2# )  4.0  2.2  1.5 ! A.363  at 5.47e+05

! M29
assign (resid  29 and name  HE# ) (resid  29 and name  HB# )  4.0  2.2  1.0 ! A.1201 at -1.08e+07
assign (resid  29 and name  HE# ) (resid  29 and name  HG# )  4.0  2.2  2.5 ! A.2771 at 4.26e+05
assign (resid  29 and name  HE# ) (resid  30 and name HD* )  4.0  2.2  2.5 ! A.2814 at 5.42e+05
assign (resid  29 and name   HA ) (resid  32 and name  HB# )  3.0  1.2  0.8 ! A.371  at 1.24e+06
! assign (resid  29 and name  HE# ) (resid 114 and name   HA )  4.0  2.2  2.5 ! A.2273 at 4.24e+05 (Queen 042806)

! L30
assign (resid  30 and name   HA ) (resid  30 and name   HG )  4.0  2.2  2.0 ! A.401  at 3.76e+05
assign (resid  30 and name   HA ) (resid  30 and name HD* )  2.5  0.7  0.7 ! A.402  at 2.53e+06
! assign (resid  30 and name  HB# ) (resid  30 and name HD* )  4.0  2.2  2.0 ! A.1693 at -6.00e+05
assign (resid  30 and name  HB# ) (resid  30 and name HD* )  4.0  2.2  2.0 ! A.1692 at -5.64e+05
! assign (resid  30 and name HD* ) (resid  33 and name  HB# )  4.0  2.2  1.5    ! A.1691 at 9.86e+05
assign (resid  30 and name HD* ) (resid  33 and name  HB# )  4.0  2.2  1.0 ! A.457  at 1.12e+06
assign (resid  30 and name   HA ) (resid  33 and name  HB# )  3.0  1.2  0.8 ! A.395  at 1.14e+06
assign (resid  30 and name   HA ) (resid  35 and name  HD1 )  4.0  2.2  2.0 ! A.475  at -3.59e+05
assign (resid  30 and name HD* ) (resid  35 and name  HD1 )  4.0  2.2  1.5 ! A.480  at -5.04e+05
! assign (resid  30 and name  HB# ) (resid  37 and name HG* )  4.0  2.2  2.0 ! A.557  at -8.08e+05
assign (resid  30 and name  HB# ) (resid  37 and name HG* )  4.0  2.2  2.0 ! A.416  at -7.77e+05
assign (resid  30 and name HD* ) (resid 117 and name   HG )  4.0  2.2  2.5 ! A.2436 at 5.30e+05 (Queen 042306 050606)
assign (resid  30 and name HD* ) (resid 117 and name   HA )  4.0  2.2  2.5 ! A.2372 at 5.50e+05 (Queen 050606)
! assign (resid  30 and name HD* ) (resid 118 and name   HA )  4.0  2.2  2.5 ! A.2372 at 5.50e+05 (Queen 050606)

! T31
assign (resid  31 and name HG2# ) (resid  31 and name   HA )  2.5  0.7  0.7 ! A.426  at 3.90e+06
assign (resid  31 and name HG2# ) (resid  32 and name   HA )  4.0  2.2  2.5 ! A.439  at 3.76e+05
assign (resid  31 and name HG2# ) (resid  32 and name  HB# )  4.0  2.2  2.5 ! A.447  at 4.62e+05
assign (resid  31 and name HG2# ) (resid  36 and name   HA )  4.0  2.2  2.5 ! A.505  at 3.23e+05
assign (resid  31 and name HG2# ) (resid  37 and name HG* )  4.0  2.2  2.5 ! A.1278 at 7.44e+05 (Queen 051406)
assign (resid  31 and name   HA ) (resid  37 and name HG* )  4.0  2.2  2.5 ! A.343  at 4.21e+05

! A32
assign (resid  32 and name  HB# ) (resid  33 and name   HA )  4.0  2.2  2.5 ! A.445  at -3.23e+05

! A33
assign (resid  33 and name  HB# ) (resid  35 and name  HD1 )  4.0  2.2  1.5 ! A.456  at -1.03e+06 (wd)
assign (resid  33 and name  HB# ) (resid  35 and name  HB# )  4.0  2.2  2.5 ! A.2947 at -3.70e+05
assign (resid  33 and name  HB# ) (resid  35 and name  HE1 )  4.0  2.2  2.0 ! A.455  at -1.02e+06 (wd,ov)
assign (resid  33 and name  HB# ) (resid 118 and name HD* )  4.0  2.2  2.5 ! A.3216 at 3.63e+06

! G34

! F35
assign (resid  35 and name  HB# ) (resid  35 and name  HD1 )  4.0  2.2  1.5 ! A.478  at 6.75e+05
assign (resid  35 and name   HA ) (resid  35 and name  HD1 )  4.0  2.2  1.0 ! A.473  at -7.94e+05
! assign (resid  35 and name  HB# ) (resid  37 and name HG* )  4.0  2.2  2.5 ! A.484  at -3.54e+05
assign (resid  35 and name  HB# ) (resid  37 and name HG* )  4.0  2.2  2.5 ! A.2946 at -5.08e+05

! K36

assign (resid  36 and name  HB# ) (resid  36 and name  HD# )  3.0  1.2  1.3 ! A.534  at -9.33e+05
assign (resid  36 and name   HA ) (resid  36 and name  HG# )  4.0  2.2  1.5 ! A.514  at 8.61e+05
assign (resid  36 and name  HE# ) (resid  36 and name  HG# )  4.0  2.2  2.0 ! A.178  at -7.66e+05
assign (resid  36 and name   HA ) (resid  37 and name HG* )  4.0  2.2  2.5 ! A.513  at 4.17e+05
assign (resid  36 and name  HD# ) (resid  38 and name HD1# )  4.0  2.2  2.5 ! A.910  at 3.30e+05
assign (resid  36 and name  HG# ) (resid  38 and name HD1# )  4.0  2.2  2.5 ! A.911  at 3.04e+05
assign (resid  36 and name  HE# ) (resid  38 and name HD1# )  4.0  2.2  2.5 ! A.539  at -8.18e+05

! V37
assign (resid  37 and name   HA ) (resid  37 and name HG* )  3.0  1.2  0.8 ! A.549  at 2.98e+06
assign (resid  37 and name HG* ) (resid  38 and name   HA )  4.0  2.2  2.5 ! A.567  at 4.05e+05
assign (resid  37 and name HG* ) (resid  39 and name   HA )  4.0  2.2  2.5 ! A.618  at 3.42e+05

! I38
assign (resid  38 and name   HA ) (resid  38 and name HG1# )  3.0  1.2  0.8 ! A.568  at 1.28e+06
assign (resid  38 and name HG2# ) (resid  38 and name   HA )  2.5  0.7  0.7 ! A.563  at 2.62e+06
assign (resid  38 and name HD1# ) (resid  38 and name   HA )  4.0  2.2  1.0 ! A.564  at 1.72e+06
assign (resid  38 and name HD1# ) (resid  38 and name   HB )  4.0  2.2  1.5 ! A.574  at -8.16e+05
assign (resid  38 and name HG2# ) (resid  53 and name HD* )    4.0  2.2  2.0 ! A.422  at 5.84e+05
assign (resid  38 and name HD1# ) (resid  53 and name HD* )    4.0  2.2  1.0 ! A.1120  at 8.89e+05 (Queen 050606)

! W39
assign (resid  39 and name   HE3 ) (resid  39 and name  HB# )  4.0  2.2  2.5 ! A.621  at -4.30e+05
assign (resid  39 and name   HA ) (resid  39 and name  HD1 )  3.0  1.2  0.8 ! A.614  at -9.68e+05

! L40
assign (resid  40 and name   HG ) (resid  40 and name   HA )  4.0  2.2  1.0 ! A.64   at -8.87e+05
assign (resid  40 and name HD* ) (resid  42 and name   HA )  4.0  2.2  2.5 ! A.3037 at -4.22e+05
assign (resid  40 and name   HG ) (resid  45 and name   HB )  4.0  2.2  2.0 ! A.3392 at -4.09e+05
assign (resid  40 and name HD* ) (resid  46 and name  HB# )  4.0  2.2  1.0 ! A.647  at 3.49e+06 (wd,ov)

! V41
! assign (resid  41 and name   HA ) (resid  41 and name HG* )  2.5  0.7  0.7 ! A.666  at 2.20e+06
assign (resid  41 and name HG* ) (resid  41 and name   HA )  4.0  2.2  1.5 ! A.660  at 6.69e+05
assign (resid  41 and name HG* ) (resid  42 and name  HB# )  4.0  2.2  2.0 ! A.683  at -5.32e+05

! D42

! G43
assign (resid  43 and name  HA# ) (resid  46 and name  HB# )  4.0  2.2  2.0 ! A.703  at -7.58e+05

! S44
assign (resid  44 and name   HA ) (resid  47 and name HD* )  4.0  2.2  1.5 ! A.716  at 7.02e+05
assign (resid  44 and name   HA ) (resid  47 and name  HB# )  4.0  2.2  1.5 ! A.717  at -7.02e+05
assign (resid  44 and name  HB# ) (resid  47 and name  HB# )  4.0  2.2  2.0 ! A.724  at -7.71e+05

! T45
assign (resid  45 and name HG2# ) (resid  45 and name   HA )  2.5  0.7  0.7 ! A.734  at 3.62e+06
assign (resid  45 and name   HB ) (resid  48 and name  HB# )  4.0  2.2  2.5 ! A.3090 at -3.18e+05
assign (resid  45 and name   HA ) (resid  48 and name  HB# )  4.0  2.2  1.5 ! A.736  at -6.69e+05
assign (resid  45 and name HG2# ) (resid  49 and name  HG# )  4.0  2.2  2.0 ! A.742  at -8.32e+05

! A46
assign (resid  46 and name   HA ) (resid  49 and name  HB# )  4.0  2.2  1.5 ! A.747  at 5.23e+05

! L47
assign (resid  47 and name   HA ) (resid  47 and name   HG )  4.0  2.2  1.0 ! A.767  at 6.62e+05
assign (resid  47 and name   HA ) (resid  47 and name HD* )  2.5  0.7  0.7 ! A.779  at 2.56e+06
assign (resid  47 and name  HB# ) (resid  47 and name HD* )  2.5  0.7  1.2 ! A.781  at -4.68e+06
assign (resid  47 and name  HB# ) (resid  48 and name  HB# )  4.0  2.2  1.5 ! A.2360 at -1.12e+06
assign (resid  47 and name HD* ) (resid  71 and name   HG )  4.0  2.2  2.5 ! A.790  at 4.93e+05
assign (resid  47 and name HD* ) (resid  71 and name  HB# )  4.0  2.2  2.0 ! A.789  at -7.73e+05
assign (resid  47 and name   HG ) (resid  72 and name HD* )  4.0  2.2  2.5 ! A.2686 at 6.47e+06 (wd) (Queen 050606)
assign (resid  47 and name HD* ) (resid  72 and name   HA )  3.0  1.2  0.8 ! A.780  at 1.53e+06
assign (resid  47 and name HD* ) (resid  75 and name  HB# )  4.0  2.2  2.5 ! A.778  at 7.08e+05
assign (resid  47 and name HD* ) (resid  75 and name  HD2 )  4.0  2.2  2.5 ! A.1177  at 3.75e+05 (Queen 050606)

! D48

! Q49
assign (resid  49 and name  HG# ) (resid  52 and name HD* )  4.0  2.2  2.5 ! A.922  at -4.91e+05

! L50
assign (resid  50 and name  HB# ) (resid  50 and name HD* )  2.5  0.7  1.2 ! A.839  at -2.54e+06
assign (resid  50 and name   HA ) (resid  50 and name HD* )  3.0  1.2  1.3 ! A.830  at 1.73e+06
assign (resid  50 and name   HG ) (resid  53 and name  HB# )  4.0  2.2  2.0 ! A.847  at -5.45e+05
assign (resid  50 and name   HG ) (resid  53 and name   HG )  3.0  1.2  1.0 ! A.895  at 1.98e+06 (wd)
assign (resid  50 and name   HG ) (resid  54 and name   HA )  4.0  2.2  2.0 ! A.3416 at 6.25e+05
assign (resid  50 and name HD* ) (resid  54 and name   HA )  4.0  2.2  2.5 ! A.913  at 4.29e+05
assign (resid  50 and name HD* ) (resid  55 and name  HD# )  4.0  2.2  2.0 ! A.2244 at -6.04e+05
assign (resid  50 and name   HA ) (resid  55 and name  HD# )  4.0  2.2  2.5 ! A.827  at -4.71e+05 (wd)
! Queen 041706
! assign (resid  50 and name HD* ) (resid  75 and name  HD2 )  4.0  2.2  2.5 ! A.3491 at -1.36e+06 (wd,ov)

! D51

! L52
assign (resid  52 and name   HA ) (resid  52 and name   HG )  3.0  1.2  0.3 ! A.642  at 1.12e+06

! L53
assign (resid  53 and name   HA ) (resid  53 and name   HG )  4.0  2.2  1.0 ! A.884  at 6.79e+05
assign (resid  53 and name HD* ) (resid  53 and name  HB# )  3.0  1.2  1.3 ! A.892  at -1.03e+06
assign (resid  53 and name   HA ) (resid  53 and name HD* )  4.0  2.2  1.0 ! A.883  at 2.91e+06 (wd)
assign (resid  53 and name   HG ) (resid  54 and name  HG# )  4.0  2.2  2.5 ! A.3424 at -7.34e+05
assign (resid  53 and name  HB# ) (resid  55 and name  HD# )  4.0  2.2  2.0 ! A.888  at 4.72e+05

! Q54
assign (resid  54 and name  HG# ) (resid  54 and name   HA )  2.5  0.7  0.7 ! A.20   at -1.57e+06
assign (resid  54 and name   HA ) (resid  55 and name  HD# )  3.0  1.2  0.8 ! A.915  at -9.84e+05

! P55
assign (resid  55 and name   HA ) (resid  55 and name  HG# )  4.0  2.2  2.5 ! A.944  at 3.89e+05
assign (resid  55 and name  HD# ) (resid  56 and name   HA )  4.0  2.2  2.5 ! A.3275 at -3.76e+05
assign (resid  55 and name  HG# ) (resid  58 and name HD1# )  4.0  2.2  2.5 ! A.953  at 3.11e+05

! I56
assign (resid  56 and name   HA ) (resid  56 and name HG1# )  4.0  2.2  2.5 ! A.987  at 4.27e+05
assign (resid  56 and name HD1# ) (resid  56 and name   HA )  4.0  2.2  1.5 ! A.974  at 6.21e+05
assign (resid  56 and name HG2# ) (resid  56 and name   HA )  2.5  0.7  0.7 ! A.973  at 2.58e+06
assign (resid  56 and name HD1# ) (resid  56 and name   HB )  2.5  0.7  0.7 ! A.980  at -1.62e+06
assign (resid  56 and name   HA ) (resid  57 and name HG* )  4.0  2.2  2.5 ! A.970  at 4.71e+05
assign (resid  56 and name   HB ) (resid  57 and name HG* )  4.0  2.2  2.5 ! A.979  at -8.39e+05
! assign (resid  56 and name   HA ) (resid  86 and name  HB# )  3.0  1.2  1.0 ! A.969  at 1.47e+06 (Queen 042306)
assign (resid  56 and name   HB ) (resid 124 and name HD* )  4.0  2.2  2.0 ! A.2911 at -7.70e+05
assign (resid  56 and name HD1# ) (resid 124 and name HD* )  4.0  2.2  2.5 ! A.1001 at 1.17e+06
! Queen add I56  041706
assign (resid  56 and name   HA ) (resid 124 and name HD* )  4.0  2.2  2.5 ! A.413  at  4.71e+05
assign (resid  56 and name   HG2# ) (resid 124 and name HD* )  4.0  2.2  1.5 ! A.433  at -7.70e+05
! V57
assign (resid  57 and name HG* ) (resid  59 and name HD* )  3.0  1.2  1.0 ! A.3001 at 2.60e+06
assign (resid  57 and name   HA ) (resid  87 and name  HB# )  4.0  2.2  2.5 ! A.1027 at -3.79e+05
assign (resid  57 and name HG* ) (resid  87 and name   HA )  4.0  2.2  2.5 ! A.1702 at 4.08e+05

! I58
assign (resid  58 and name   HA ) (resid  58 and name HG1# )  4.0  2.2  1.5 ! A.1043 at 5.65e+05
assign (resid  58 and name HG2# ) (resid  58 and name   HA )  3.0  1.2  0.8 ! A.1036 at 1.24e+06
assign (resid  58 and name HD1# ) (resid  58 and name   HA )  4.0  2.2  2.5 ! A.1037 at 3.30e+05
assign (resid  58 and name HG2# ) (resid  60 and name  HE# )  4.0  2.2  1.5 ! A.2888 at 1.05e+06
assign (resid  58 and name HG2# ) (resid  60 and name  HB# )  4.0  2.2  2.0 ! A.1066 at -6.85e+05
assign (resid  58 and name HG2# ) (resid  60 and name   HA )  4.0  2.2  2.5 ! A.1110 at 3.18e+05
assign (resid  58 and name HD1# ) (resid  86 and name  HB# )  4.0  2.2  2.0 ! A.1073 at 8.68e+05
assign (resid  58 and name HD1# ) (resid  86 and name  HG# )  3.0  1.2  1.3 ! A.1074 at 1.32e+06
assign (resid  58 and name   HB ) (resid  87 and name  HB# )  4.0  2.2  2.5 ! A.3419 at 9.39e+05(widened)
assign (resid  58 and name   HB ) (resid  88 and name HG* )  4.0  2.2  1.5 ! A.1052 at -1.20e+06
assign (resid  58 and name HG2# ) (resid  88 and name HG* )  4.0  2.2  2.5 ! A.1064 at 4.22e+05
! assign (resid  58 and name HG2# ) (resid  88 and name HG* )  4.0  2.2  2.0 ! A.1059 at 6.51e+05
! assign (resid  58 and name   HB ) (resid  88 and name HG* )  4.0  2.2  1.5 ! A.1720 at -4.71e+05
assign (resid  58 and name HD1# ) (resid  88 and name HG* )  4.0  2.2  2.5 ! A.1077 at 9.74e+05

! L59
assign (resid  59 and name   HG ) (resid  59 and name   HA )  4.0  2.2  1.0 ! A.1083 at -5.93e+05
! assign (resid  59 and name HD* ) (resid  59 and name   HA )  3.0  1.2  0.8 ! A.1082 at -1.38e+06
assign (resid  59 and name  HB# ) (resid  59 and name HD* )  4.0  2.2  2.0 ! A.2998 at -7.37e+05
assign (resid  59 and name   HA ) (resid  59 and name HD* )  4.0  2.2  1.0 ! A.1087 at -1.42e+06

! M60
assign (resid  60 and name   HA ) (resid  60 and name  HG# )  4.0  2.2  1.5 ! A.1114 at 7.09e+05
assign (resid  60 and name  HE# ) (resid  60 and name  HG# )  4.0  2.2  2.0 ! A.2791 at 6.12e+05
assign (resid  60 and name   HA ) (resid  60 and name  HE# )  4.0  2.2  1.5 ! A.2815 at 4.69e+05
assign (resid  60 and name  HE# ) (resid  69 and name  HB# )  4.0  2.2  2.0 ! A.1282 at 6.78e+05
assign (resid  60 and name  HE# ) (resid  69 and name   HA )  4.0  2.2  1.5 ! A.1274 at 8.32e+05
assign (resid  60 and name  HE# ) (resid  72 and name   HG )  4.0  2.2  2.5 ! A.2679 at 3.88e+05
assign (resid  60 and name  HE# ) (resid  72 and name HD* )  4.0  2.2  1.5 ! A.2889 at 5.39e+06
assign (resid  60 and name  HE# ) (resid  73 and name   HG )  4.0  2.2  2.5 ! A.2823 at 1.43e+06 (wd)
assign (resid  60 and name  HE# ) (resid  73 and name HD* )  4.0  2.2  2.5    ! A.2824 at 2.37e+06
assign (resid  60 and name  HB# ) (resid  90 and name  HD# )  4.0  2.2  2.5 ! A.1817 at 3.39e+05

! A61
assign (resid  61 and name  HB# ) (resid  63 and name  HD# )  4.0  2.2  2.0 ! A.3467 at -7.75e+05
assign (resid  61 and name   HA ) (resid  91 and name  HB# )  4.0  2.2  1.5 ! A.1095 at 7.99e+05
assign (resid  61 and name   HA ) (resid  91 and name HD* )  4.0  2.2  1.5 ! A.1086 at -5.10e+05
assign (resid  61 and name  HB# ) (resid  91 and name  HB# )  4.0  2.2  2.5 ! A.1138 at -3.25e+05

! W62
assign (resid  62 and name  HD1 ) (resid  62 and name  HB# )  4.0  2.2  1.5 ! A.1144 at -4.41e+05
assign (resid  62 and name  HZ2 ) (resid  70 and name HD* )  4.0  2.2  1.5 ! A.1302 at 5.02e+05
assign (resid  62 and name  HH2 ) (resid  70 and name HD* )  4.0  2.2  1.5 ! A.1242 at -4.69e+05
! assign (resid  62 and name  HH2 ) (resid  70 and name HD* )  2.5  0.7  0.7 ! A.2867 at -1.64e+06
assign (resid  62 and name  HZ3 ) (resid  70 and name HD* )  4.0  2.2  2.5 ! A.3067 at -3.81e+05
assign (resid  62 and name  HH2 ) (resid  73 and name   HG )  4.0  2.2  2.0 ! A.1326 at -3.91e+05
assign (resid  62 and name  HZ3 ) (resid  73 and name   HG )  4.0  2.2  1.0 ! A.2939 at -6.11e+05
assign (resid  62 and name  HD1 ) (resid  93 and name  HB# )  4.0  2.2  1.5 ! A.1149 at -5.21e+05
assign (resid  62 and name  HZ2 ) (resid 100 and name HD* )  4.0  2.2  1.5 ! A.2002 at 7.68e+05

! P63
assign (resid  63 and name   HA ) (resid  64 and name  HD# )  3.0  1.2  0.8 ! A.107 at -2.10e+06

! P64
assign (resid  64 and name  HB# ) (resid  65 and name  HD# )  4.0  2.2  2.5 ! A.1206 at -3.80e+05
assign (resid  64 and name   HA ) (resid  65 and name  HD# )  3.0  1.2  0.8 ! A.1173 at -1.14e+06


! P65
assign (resid  65 and name   HA ) (resid  65 and name  HD# )  4.0  2.2  2.5 ! A.1217 at -3.27e+05
assign (resid  65 and name   HA ) (resid  65 and name  HG# )  4.0  2.2  1.5 ! A.1210 at 5.30e+05

! D66

! Q67
assign (resid  67 and name  HG# ) (resid  67 and name   HA )  2.5  0.7  0.7 ! A.1230 at -1.55e+06
assign (resid  67 and name  HB# ) (resid  70 and name HD* )  4.0  2.2  2.5 ! A.1235 at 3.45e+05
assign (resid  67 and name  HB# ) (resid  70 and name  HB# )  4.0  2.2  2.5 ! A.1315 at -3.02e+05
assign (resid  67 and name   HA ) (resid  70 and name   HG )  4.0  2.2  1.0 ! A.1231 at 8.74e+05
assign (resid  67 and name   HA ) (resid  70 and name HD* )  3.0  1.2  0.8 ! A.1233 at 1.20e+06
assign (resid  67 and name  HG# ) (resid  70 and name HD* )  4.0  2.2  2.0 ! A.1250 at -6.74e+05

! S68
assign (resid  68 and name   HA ) (resid  71 and name   HG )  4.0  2.2  1.0 ! A.1257 at 8.86e+05
assign (resid  68 and name   HA ) (resid  71 and name HD* )  3.0  1.2  0.8 ! A.1259 at 1.43e+06
assign (resid  68 and name  HB# ) (resid  71 and name HD* )  4.0  2.2  2.5 ! A.1266 at 3.20e+05
! assign (resid  68 and name   HA ) (resid  71 and name HD* )  4.0  2.2  2.5 ! A.1260 at 3.99e+05
assign (resid  68 and name   HA ) (resid  71 and name  HB# )  4.0  2.2  1.5 ! A.862  at -4.44e+05

! C69
assign (resid  69 and name   HA ) (resid  72 and name HD* )  4.0  2.2  2.0 ! A.1279 at 7.92e+05
assign (resid  69 and name   HA ) (resid  72 and name  HB# )  4.0  2.2  1.5 ! A.1278 at -4.93e+05

! L70
assign (resid  70 and name   HA ) (resid  70 and name   HG )  3.0  1.2  0.3 ! A.1238 at 9.53e+05
! assign (resid  70 and name  HB# ) (resid  70 and name HD* )  2.5  0.7  1.2 ! A.1244 at -1.91e+06
assign (resid  70 and name   HA ) (resid  70 and name HD* )  2.5  0.7  0.7 ! A.1297 at 3.41e+06
assign (resid  70 and name  HB# ) (resid  70 and name HD* )  3.0  1.2  1.3 ! A.1298 at -1.13e+06
assign (resid  70 and name HD* ) (resid  73 and name   HG )  4.0  2.2  2.0 ! A.1324 at 1.37e+06
! assign (resid  70 and name HD* ) (resid 100 and name HD* )  4.0  2.2  1.0 ! A.1323 at 1.39e+06 (Queen 042306)

! L71
assign (resid  71 and name   HA ) (resid  71 and name   HG )  4.0  2.2  1.0 ! A.864  at 7.54e+05
assign (resid  71 and name   HA ) (resid  71 and name HD* )  4.0  2.2  1.0 ! A.1341 at 9.52e+05
! assign (resid  71 and name  HB# ) (resid  71 and name HD* )  2.5  0.7  1.2 ! A.1342 at -2.07e+06
assign (resid  71 and name  HB# ) (resid  71 and name HD* )  2.5  0.7  1.2 ! A.1337 at -2.72e+06
assign (resid  71 and name   HA ) (resid  74 and name  HB# )  3.0  1.2  0.8 ! A.1455 at 1.45e+06

! L72
assign (resid  72 and name   HA ) (resid  72 and name   HG )  4.0  2.2  1.0 ! A.1354 at 7.44e+05
assign (resid  72 and name   HA ) (resid  72 and name HD* )  4.0  2.2  1.5 ! A.1376 at 6.78e+05
! assign (resid  72 and name  HB# ) (resid  72 and name HD* )  3.0  1.2  1.3 ! A.1375 at -1.19e+06
! assign (resid  72 and name   HA ) (resid  72 and name HD* )  4.0  2.2  1.0 ! A.2294 at 9.71e+05 
assign (resid  72 and name  HB# ) (resid  72 and name HD* )  4.0  2.2  2.0 ! A.1374 at -7.26e+05
assign (resid  72 and name   HA ) (resid  75 and name  HB# )  4.0  2.2  1.5 ! A.1368 at 5.08e+05
assign (resid  72 and name HD* ) (resid  75 and name  HB# )  4.0  2.2  2.5 ! A.1383 at 3.32e+05

! L73
assign (resid  73 and name   HA ) (resid  73 and name   HG )  4.0  2.2  1.0 ! A.1397 at 5.15e+05
assign (resid  73 and name   HA ) (resid  73 and name HD* )  2.5  0.7  0.7 ! A.1405 at 2.52e+06
! assign (resid  73 and name  HB# ) (resid  73 and name HD* )  3.0  1.2  1.3 ! A.1411 at -1.16e+06
assign (resid  73 and name  HB# ) (resid  73 and name HD* )  4.0  2.2  2.0 ! A.1410 at -7.34e+05
! Queen 041706 Queen 042306 restore
assign (resid  73 and name HD* ) (resid  88 and name HG* )  4.0  2.2  2.5  ! A.1416 at 1.58e+06
assign (resid  73 and name   HG ) (resid  88 and name HG* )  4.0  2.2  2.5 ! A.1717 at 3.14e+05
assign (resid  73 and name HD* ) (resid  90 and name  HE# )  4.0  2.2  2.5 ! A.3488 at -6.13e+05
assign (resid  73 and name   HG ) (resid  90 and name  HE# )  4.0  2.2  2.5 ! A.3511 at -1.01e+06 (widened)

! Q74
assign (resid  74 and name  HG# ) (resid  74 and name   HA )  2.5  0.7  0.7 ! A.1439 at -2.11e+06
assign (resid  74 and name   HA ) (resid  77 and name  HB# )  4.0  2.2  2.5 ! A.1526 at 3.01e+05

! H75
assign (resid  75 and name  HD2 ) (resid  75 and name  HB# )  4.0  2.2  2.5 ! A.1486 at -3.02e+05
assign (resid  75 and name  HD2 ) (resid  76 and name HD* )  4.0  2.2  2.5 ! A.1487 at -8.83e+05
assign (resid  75 and name  HD2 ) (resid  76 and name   HA )  4.0  2.2  2.0 ! A.1476 at -3.66e+05
assign (resid  75 and name   HA ) (resid  78 and name  HB# )  4.0  2.2  2.5 ! A.1542 at 4.02e+05
assign (resid  75 and name   HA ) (resid  79 and name  HD2 )  4.0  2.2  2.5 ! A.1462 at -4.47e+05

! L76
assign (resid  76 and name   HA ) (resid  79 and name  HB# )  4.0  2.2  2.5 ! A.1478 at 3.78e+05
! Queen 042306 
! assign (resid  76 and name HD* ) (resid  86 and name  HD# )  4.0  2.2  2.5 ! A.1499 at -5.72e+05

! R77
assign (resid  77 and name  HD# ) (resid  77 and name  HB# )  4.0  2.2  2.0 ! A.1524 at -6.23e+05
assign (resid  77 and name   HA ) (resid  77 and name  HG# )  4.0  2.2  1.5 ! A.1529 at 6.65e+05
assign (resid  77 and name   HA ) (resid  80 and name  HB# )  4.0  2.2  1.5 ! A.1513 at 8.99e+05

! E78
assign (resid  78 and name  HG# ) (resid  78 and name   HA )  2.5  0.7  0.7 ! A.1539 at -1.86e+06

! H79

! Q80
assign (resid  80 and name  HG# ) (resid  81 and name  HB# )  4.0  2.2  2.5 ! A.1561 at -3.22e+05

! A81

! D82
assign (resid  82 and name   HA ) (resid  83 and name  HG# )  4.0  2.2  1.5 ! A.1603 at 6.79e+05
assign (resid  82 and name  HB# ) (resid  83 and name  HD# )  4.0  2.2  1.0 ! A.1188 at 9.29e+05

! P83
assign (resid  83 and name  HD# ) (resid  83 and name  HB# )  4.0  2.2  2.0 ! A.1582 at -5.09e+05
assign (resid  83 and name   HA ) (resid  83 and name  HD# )  4.0  2.2  2.5 ! A.1595 at -3.70e+05
assign (resid  83 and name   HA ) (resid  83 and name  HG# )  3.0  1.2  0.8 ! A.1592 at 1.26e+06
assign (resid  83 and name  HB# ) (resid  84 and name  HD2 )  4.0  2.2  2.5 ! A.1585 at -3.70e+05
! assign (resid  83 and name  HB# ) (resid  85 and name  HD# )  4.0  2.2  2.5 ! A.3125 at -9.47e+05 (wd)

! H84
assign (resid   84 and name   HA ) (resid   85 and name  HD# )  3.0  1.2  0.8 ! A.101  at -3.20e+06

! P85
assign (resid  85 and name   HA ) (resid  85 and name  HG# )  4.0  2.2  1.5 ! A.1630 at 7.04e+05
assign (resid  85 and name  HD# ) (resid  85 and name   HA )  2.5  0.7  0.7 ! A.1614 at -3.82e+06

! P86
assign (resid  86 and name  HD# ) (resid  86 and name   HA )  4.0  2.2  1.5 ! A.1635 at -6.06e+05
assign (resid  86 and name  HG# ) (resid  87 and name   HA )  4.0  2.2  2.5 ! A.1658 at 6.57e+05
assign (resid  86 and name  HB# ) (resid  87 and name   HA )  4.0  2.2  1.5 ! A.2575 at 6.83e+05

! L87
assign (resid  87 and name   HA ) (resid  87 and name HD* )  3.0  1.2  0.8 ! A.1676 at 4.10e+06
! (Queen 042306)
! assign (resid  87 and name   HG ) (resid 124 and name   HA )  4.0  2.2  1.0 ! A.2398 at 6.15e+05
! assign (resid  87 and name   HG ) (resid 124 and name  HB# )  4.0  2.2  2.0 ! A.3584 at -5.99e+05

! V88
! assign (resid  88 and name   HA ) (resid  88 and name HG* )  2.5  0.7  0.7 ! A.1703 at 1.54e+06
assign (resid  88 and name   HA ) (resid  88 and name HG* )  3.0  1.2  0.8 ! A.1429 at 1.26e+06
assign (resid  88 and name HG* ) (resid  90 and name  HE# )  4.0  2.2  2.0 ! A.1713 at -4.63e+05
assign (resid  88 and name HG* ) (resid 103 and name  HG# )  4.0  2.2  2.5 ! A.1430 at -3.81e+05
assign (resid  88 and name HG* ) (resid 104 and name   HA )  4.0  2.2  1.5 ! A.1704 at -4.45e+05
assign (resid  88 and name HG* ) (resid 104 and name  HB# )  4.0  2.2  2.5 ! A.2120 at 1.11e+06
assign (resid  88 and name   HB ) (resid 104 and name  HB# )  4.0  2.2  2.5 ! A.1696 at -3.50e+05

! L89
assign (resid  89 and name   HA ) (resid  89 and name   HG )  3.0  1.2  0.3 ! A.1743 at 9.09e+05
! assign (resid  89 and name   HA ) (resid  89 and name HD* )  4.0  2.2  1.5 ! A.1755 at 5.69e+05
assign (resid  89 and name  HB# ) (resid  89 and name HD* )  2.5  0.7  1.2 ! A.1759 at -1.98e+06
! assign (resid  89 and name HD* ) (resid  89 and name  HB# )  2.5  0.7  1.2 ! A.183  at -1.54e+06
assign (resid  89 and name   HA ) (resid  89 and name HD* )  4.0  2.2  1.5 ! A.1768 at 6.71e+05
assign (resid  89 and name   HA ) (resid 104 and name  HB# )  4.0  2.2  1.5 ! A.1728 at 5.45e+05
assign (resid  89 and name HD* ) (resid 105 and name  HB# )  4.0  2.2  2.5 ! A.1756 at 4.10e+05
assign (resid  89 and name   HG ) (resid 106 and name  HB# )  3.0  1.2  1.3 ! A.1744 at 1.47e+06
! assign (resid  89 and name HD* ) (resid 106 and name  HB# )  4.0  2.2  1.5 ! A.1766 at 3.66e+06
assign (resid  89 and name HD* ) (resid 106 and name  HB# )  4.0  2.2  1.0 ! A.1748 at 1.12e+06
assign (resid  89 and name   HA ) (resid 106 and name  HB# )  4.0  2.2  2.5 ! A.1789 at 3.27e+05
! assign (resid  89 and name HD* ) (resid 120 and name HG2# )  4.0  2.2  1.0 ! A.1757 at 2.52e+06
! assign (resid  89 and name HD* ) (resid 120 and name HG2# )  4.0  2.2  2.5 ! A.1774 at 9.33e+06 (Queen 042806)

! F90
assign (resid  90 and name  HB# ) (resid  90 and name  HD# )  4.0  2.2  2.5 ! A.1811 at 4.28e+05
assign (resid  90 and name   HA ) (resid  90 and name  HD# )  3.0  1.2  0.8 ! A.1809 at -9.46e+05
assign (resid  90 and name  HE# ) (resid 104 and name  HB# )  3.0  1.2  0.8 ! A.1821 at -1.32e+06
assign (resid  90 and name  HD# ) (resid 104 and name  HB# )  3.0  1.2  0.8 ! A.1820 at -1.27e+06
assign (resid  90 and name  HD# ) (resid 107 and name HG1# )  4.0  2.2  2.5 ! A.2841 at -3.17e+05
assign (resid  90 and name  HB# ) (resid 107 and name HG1# )  4.0  2.2  2.5 ! A.1802 at -3.30e+05
assign (resid  90 and name  HD# ) (resid 107 and name HD1# )  4.0  2.2  2.0 ! A.1813 at -7.81e+05
assign (resid  90 and name  HB# ) (resid 107 and name HG2# )  4.0  2.2  2.5 ! A.1796 at -4.17e+05

! L91
assign (resid  91 and name   HG ) (resid  91 and name   HA )  4.0  2.2  1.0 ! A.1832 at -4.74e+05
! assign (resid  91 and name HD* ) (resid  91 and name   HA )  2.5  0.7  1.0 ! A.1833 at -2.89e+06
assign (resid  91 and name HD* ) (resid  91 and name   HA )  4.0  2.2  1.0 ! A.1834 at -1.22e+06
assign (resid  91 and name  HB# ) (resid  91 and name HD* )  3.0  1.2  1.3 ! A.1862 at -1.44e+06
! assign (resid  91 and name  HB# ) (resid  91 and name HD* )  2.5  0.7  1.2 ! A.1101 at -1.57e+06
assign (resid  91 and name   HA ) (resid 108 and name  HB# )  4.0  2.2  2.5 ! A.2168 at 4.37e+05

! G92
assign (resid  92 and name  HA# ) (resid 109 and name   HA )  4.0  2.2  2.5 ! A.1872 at -3.93e+05

! E93
assign (resid  93 and name  HG# ) (resid  94 and name  HD# )  4.0  2.2  2.5 ! A.249  at 3.32e+05
assign (resid  93 and name   HA ) (resid  94 and name  HG# )  4.0  2.2  2.5 ! A.1878 at 4.21e+05

! P94
assign (resid  94 and name  HD# ) (resid  94 and name  HB# )  4.0  2.2  2.0 ! A.1884 at -7.93e+05
assign (resid  94 and name   HA ) (resid  94 and name  HG# )  4.0  2.2  2.5 ! A.1930 at 4.10e+05
assign (resid  94 and name   HA ) (resid  95 and name  HD# )  3.0  1.2  0.8 ! A.1906 at -1.29e+06
assign (resid  94 and name  HB# ) (resid 107 and name HG2# )  4.0  2.2  2.5 ! A.2158 at 4.27e+05
assign (resid  94 and name  HB# ) (resid 107 and name HD1# )  4.0  2.2  2.0 ! A.1940 at 7.51e+05
assign (resid  94 and name  HG# ) (resid 107 and name HG2# )  4.0  2.2  2.5 ! A.3204 at 3.81e+05
assign (resid  94 and name   HA ) (resid 107 and name HD1# )  3.0  1.2  0.8 ! A.1899 at 1.22e+06
assign (resid  94 and name   HA ) (resid 107 and name HG2# )  3.0  1.2  0.8 ! A.1918 at 1.27e+06
assign (resid  94 and name  HD# ) (resid 107 and name HG2# )  4.0  2.2  2.0 ! A.2150 at -5.38e+05

! P95
assign (resid  95 and name  HB# ) (resid 100 and name HD* )  4.0  2.2  2.0 ! A.1966 at 4.56e+05
assign (resid  95 and name  HB# ) (resid 100 and name  HB# )  4.0  2.2  2.5 ! A.1953 at -3.25e+05
assign (resid  95 and name  HD# ) (resid 101 and name HG2# )  4.0  2.2  2.5 ! A.1924 at -6.56e+05
assign (resid  95 and name  HD# ) (resid 107 and name HD1# )  4.0  2.2  2.0 ! A.1909 at -5.68e+05

! V96
assign (resid  96 and name HG* ) (resid  96 and name   HA )  2.5  0.7  0.7 ! A.1982 at 4.83e+06
! assign (resid  96 and name   HA ) (resid  96 and name HG* )  2.5  0.7  0.7 ! A.1985 at 2.17e+06
! assign (resid  96 and name HG* ) (resid  97 and name   HA )  4.0  2.2  2.5 ! A.1990 at -3.37e+05
assign (resid  96 and name HG* ) (resid  97 and name   HA )  4.0  2.2  2.5 ! A.1994 at -3.00e+05
assign (resid  96 and name   HB ) (resid 100 and name HD* )  4.0  2.2  2.5 ! A.3105 at 4.38e+05

! D97
assign (resid  97 and name   HA ) (resid  98 and name  HD# )  2.5  0.7  0.7 ! A.1993 at 2.88e+06
assign (resid  97 and name   HA ) (resid  98 and name  HG# )  4.0  2.2  1.5 ! A.1995 at -9.83e+05 (wd)
assign (resid  97 and name  HB# ) (resid 100 and name   HG )  4.0  2.2  1.5 ! A.1998 at -6.57e+05
assign (resid  97 and name  HB# ) (resid 100 and name HD* )  3.0  1.2  1.3 ! A.1999 at -1.18e+06
assign (resid  97 and name   HA ) (resid 100 and name  HB# )  4.0  2.2  2.5 ! A.2061 at -3.17e+05

! P98
assign (resid  98 and name  HD# ) (resid  98 and name  HB# )  4.0  2.2  2.0 ! A.936  at -5.48e+05
assign (resid  98 and name   HA ) (resid  98 and name  HD# )  4.0  2.2  2.5 ! A.3520 at -2.90e+05
assign (resid  98 and name   HA ) (resid  98 and name  HG# )  3.0  1.2  0.8 ! A.2015 at 1.17e+06
assign (resid  98 and name  HB# ) (resid 101 and name   HB )  4.0  2.2  2.5 ! A.3527 at 3.52e+05
assign (resid  98 and name   HA ) (resid 101 and name   HB )  2.5  0.7  0.7 ! A.2004 at 2.23e+06 (wd)
assign (resid  98 and name   HA ) (resid 101 and name HG2# )  4.0  2.2  1.5 ! A.2080 at 7.81e+05

! L99
assign (resid  99 and name   HA ) (resid  99 and name   HG )  4.0  2.2  1.0 ! A.2041 at 7.63e+05
assign (resid  99 and name   HA ) (resid  99 and name HD* )  4.0  2.2  1.0 ! A.2043 at 3.31e+06
assign (resid  99 and name HD* ) (resid  99 and name  HB# )  2.5  0.7  1.2 ! A.2036 at -2.13e+06
assign (resid  99 and name   HA ) (resid 102 and name  HB# )  3.0  1.2  1.0 ! A.1480 at 1.82e+06 (wd)


! L100
assign (resid 100 and name   HA ) (resid 100 and name   HG )  4.0  2.2  1.0 ! A.2001 at 7.30e+05
assign (resid 100 and name   HA ) (resid 100 and name HD* )  4.0  2.2  1.5 ! A.1960 at 6.85e+05
! assign (resid 100 and name   HA ) (resid 100 and name HD* )  2.5  0.7  1.0 ! A.2068 at 2.85e+06
assign (resid 100 and name   HA ) (resid 103 and name  HG# )  4.0  2.2  1.5 ! A.2072 at -6.98e+05

! T101
assign (resid 101 and name HG2# ) (resid 101 and name   HA )  2.5  0.7  0.7 ! A.1827 at 2.42e+06
assign (resid 101 and name HG2# ) (resid 102 and name  HB# )  4.0  2.2  2.5 ! A.2032 at 3.94e+05
assign (resid 101 and name   HA ) (resid 104 and name  HB# )  4.0  2.2  1.5 ! A.2074 at 7.38e+05
assign (resid 101 and name HG2# ) (resid 104 and name  HB# )  4.0  2.2  2.5 ! A.2082 at 4.06e+05
assign (resid 101 and name   HA ) (resid 107 and name HD1# )  4.0  2.2  2.5 ! A.1915 at 7.68e+05

! A102
assign (resid 102 and name  HB# ) (resid 103 and name   HA )  4.0  2.2  2.5 ! A.2096 at 3.59e+05

! Q103
assign (resid 103 and name  HG# ) (resid 103 and name   HA )  2.5  0.7  0.7 ! A.2098 at -1.85e+06

! A104
assign (resid 104 and name  HB# ) (resid 107 and name HG1# )  4.0  2.2  2.0 ! A.2117 at 7.21e+05
assign (resid 104 and name  HB# ) (resid 107 and name HD1# )  4.0  2.2  1.0 ! A.1917 at 2.20e+06 (wd)

! S105

! A106
! assign (resid 106 and name  HB# ) (resid 108 and name HD* )  4.0  2.2  2.0 ! A.3569 at 2.00e+06
assign (resid 106 and name  HB# ) (resid 108 and name HD* )  4.0  2.2  2.5 ! A.1749 at 1.42e+06

! I107
assign (resid 107 and name   HA ) (resid 107 and name HG1# )  4.0  2.2  1.5 ! A.2126 at 8.00e+05
assign (resid 107 and name HD1# ) (resid 107 and name   HA )  4.0  2.2  1.5 ! A.547  at 7.13e+05
assign (resid 107 and name HG2# ) (resid 107 and name   HA )  2.5  0.7  0.7 ! A.546  at 2.09e+06
assign (resid 107 and name HD1# ) (resid 107 and name   HB )  2.5  0.7  0.7 ! A.1062 at -1.89e+06

! L108
assign (resid 108 and name HD* ) (resid 108 and name   HA )  4.0  2.2  1.0 ! A.2166 at -1.14e+06
! assign (resid 108 and name HD* ) (resid 108 and name   HA )  2.5  0.7  0.7 ! A.2165 at -3.64e+06
assign (resid 108 and name   HG ) (resid 108 and name   HA )  4.0  2.2  2.0 ! A.2164 at -1.42e+06 (wd)
assign (resid 108 and name  HB# ) (resid 108 and name HD* )  2.5  0.7  1.2 ! A.2175 at -3.31e+06
assign (resid 108 and name HD* ) (resid 120 and name HG2# )  4.0  2.2  2.5   ! A.1763 at 1.45e+06
assign (resid 108 and name HD* ) (resid 120 and name   HB )  4.0  2.2  1.5 ! A.2176 at 8.90e+05

! S109

! K110
assign (resid 110 and name   HA ) (resid 110 and name  HG# )  4.0  2.2  1.5 ! A.2202 at 7.31e+05
assign (resid 110 and name  HG# ) (resid 111 and name   HA )  4.0  2.2  1.5 ! A.1637 at 7.26e+05
assign (resid 110 and name  HB# ) (resid 111 and name   HA )  4.0  2.2  1.5 ! A.2197 at -5.53e+05
assign (resid 110 and name   HA ) (resid 112 and name HD* )  4.0  2.2  2.5 ! A.3544 at 5.95e+05
! assign (resid 110 and name  HB# ) (resid 117 and name   HG )  2.5  0.7  0.7 ! A.3371 at -2.31e+06(ov)

! P111
assign (resid 111 and name  HB# ) (resid 111 and name  HD# )  4.0  2.2  2.0 ! A.2223 at 6.50e+05
assign (resid 111 and name   HA ) (resid 111 and name  HG# )  4.0  2.2  1.5 ! A.2218 at 4.84e+05

! L112
assign (resid 112 and name   HA ) (resid 112 and name HD* )  3.0  1.2  1.0 ! A.2242 at 2.77e+06(WD)

! D113
assign (resid 113 and name   HA ) (resid 114 and name  HD# )  2.5  0.7  0.7 ! A.2250 at 2.30e+06
assign (resid 113 and name   HA ) (resid 114 and name  HG# )  4.0  2.2  2.5 ! A.2263 at -3.83e+05
assign (resid 113 and name  HB# ) (resid 116 and name HD* )  4.0  2.2  2.5 ! A.2261 at -3.64e+05

! P114
assign (resid 114 and name   HA ) (resid 114 and name  HG# )  4.0  2.2  1.5 ! A.2276 at 6.15e+05
assign (resid 114 and name   HA ) (resid 117 and name  HB# )  4.0  2.2  1.5 ! A.2275 at -5.16e+05

! Q115
assign (resid 115 and name  HG# ) (resid 115 and name   HA )  2.5  0.7  0.7 ! A.2292 at -1.88e+06
assign (resid 115 and name   HA ) (resid 118 and name  HB# )  4.0  2.2  1.5 ! A.2282 at -7.84e+05

! L116
assign (resid 116 and name   HA ) (resid 116 and name   HG )  4.0  2.2  1.0 ! A.2314 at 7.64e+05
! assign (resid 116 and name  HB# ) (resid 116 and name HD* )  2.5  0.7  1.2 ! A.2255 at -1.83e+06
assign (resid 116 and name  HB# ) (resid 116 and name HD* )  3.0  1.2  1.3 ! A.2309 at -1.25e+06
assign (resid 116 and name   HG ) (resid 117 and name   HA )  4.0  2.2  1.5 ! A.2330 at 8.98e+05
assign (resid 116 and name   HG ) (resid 117 and name  HB# )  4.0  2.2  1.0 ! A.3566 at -1.41e+06
assign (resid 116 and name   HA ) (resid 119 and name   HB )  3.0  1.2  0.3 ! A.2296 at 1.36e+06
assign (resid 116 and name   HA ) (resid 119 and name HG2# )  4.0  2.2  1.5 ! A.2302 at 5.42e+05

! L117
assign (resid 117 and name   HA ) (resid 117 and name HD* )  2.5  0.7  0.7 ! A.206  at 3.08e+06
! assign (resid 117 and name  HB# ) (resid 117 and name HD* )  3.0  1.2  1.3 ! A.2339 at -9.64e+05
assign (resid 117 and name  HB# ) (resid 117 and name HD* )  3.0  1.2  1.3 ! A.2340 at -1.43e+06
assign (resid 117 and name HD* ) (resid 120 and name   HB )  4.0  2.2  1.5 ! A.2341 at 5.80e+05
assign (resid 117 and name   HA ) (resid 120 and name   HB )  3.0  1.2  0.3 ! A.2324 at 1.33e+06

! L118
assign (resid 118 and name   HA ) (resid 118 and name   HG )  4.0  2.2  1.0 ! A.641  at 1.31e+06
assign (resid 118 and name  HB# ) (resid 118 and name HD* )  2.5  0.7  1.2 ! A.2366 at -2.29e+06
assign (resid 118 and name   HA ) (resid 118 and name HD* )  3.0  1.2  1.3 ! A.2368 at 3.75e+06 (wd)
assign (resid 118 and name   HG ) (resid 122 and name  HG# )  4.0  2.2  2.5 ! A.2445 at -3.95e+05
assign (resid 118 and name HD* ) (resid 122 and name  HG# )  4.0  2.2  2.5 ! A.2112 at -4.82e+05

! T119
assign (resid 119 and name HG2# ) (resid 119 and name   HA )  3.0  1.2  0.8 ! A.76   at 3.50e+06
assign (resid 119 and name   HA ) (resid 122 and name  HB# )  4.0  2.2  1.5 ! A.99   at 7.10e+05

! T120
assign (resid 120 and name HG2# ) (resid 120 and name   HA )  3.0  1.2  0.8 ! A.2388 at 3.89e+06
assign (resid 120 and name HG2# ) (resid 121 and name   HA )  4.0  2.2  1.5 ! A.2395 at 5.11e+05

! L121
assign (resid 121 and name   HA ) (resid 121 and name HD* )  3.0  1.2  0.8 ! A.2418 at 9.96e+05
! assign (resid 121 and name  HB# ) (resid 121 and name HD* )  3.0  1.2  1.3 ! A.2421 at -1.14e+06
assign (resid 121 and name  HB# ) (resid 121 and name HD* )  4.0  2.2  2.0 ! A.2426 at -7.11e+05
assign (resid 121 and name   HG ) (resid 121 and name   HA )  3.0  1.2  0.3 ! A.2345 at 1.43e+06
assign (resid 121 and name   HA ) (resid 124 and name  HB# )  4.0  2.2  2.5 ! A.2464 at -3.08e+05

! Q122
assign (resid 122 and name  HG# ) (resid 122 and name   HA )  3.0  1.2  0.8 ! A.1346 at -9.36e+05
assign (resid 122 and name   HA ) (resid 125 and name  HB# )  4.0  2.2  2.5 ! A.3144 at 2.95e+05

! G123

! L124
assign (resid 124 and name   HA ) (resid 124 and name HD* )  3.0  1.2  1.3 ! A.1340 at 4.85e+06 (wd)
assign (resid 124 and name   HG ) (resid 124 and name   HA )  4.0  2.2  1.0 ! A.2453 at 7.06e+05
! Queen 042307
! assign (resid 124 and name HD* ) (resid 126 and name  HD# )  4.0  2.2  2.0 ! A.1190 at -8.12e+05
! assign (resid 124 and name HD* ) (resid 126 and name   HA )  4.0  2.2  2.5 ! A.1500 at 3.92e+05

! C125
 assign (resid 125 and name   HA ) (resid 126 and name  HD# )  3.0  1.2  1.0 ! A.2476 at -4.20e+06 (wd)
 assign (resid 125 and name  HB# ) (resid 126 and name  HD# )  4.0  2.2  2.0 ! A.2479 at -4.87e+05
 assign (resid 125 and name   HA ) (resid 126 and name  HG# )  4.0  2.2  2.5 ! A.2475 at 4.28e+05
 assign (resid 125 and name   HA ) (resid 127 and name  HB# )  4.0  2.2  2.0 ! A.671  at 7.27e+05

! P126
 assign (resid 126 and name  HD# ) (resid 126 and name  HB# )  3.0  1.2  1.3 ! A.2490 at -1.40e+06
 assign (resid 126 and name   HA ) (resid 127 and name  HD# )  2.5  0.7  0.7 ! A.1613 at -4.20e+06
 assign (resid 126 and name  HB# ) (resid 127 and name  HD# )  3.0  1.2  1.3 ! A.2486 at -9.22e+05

! P127
 assign (resid 127 and name   HA ) (resid 127 and name  HG# )  3.0  1.2  0.8 ! A.1591 at 1.18e+06
 assign (resid 127 and name  HG# ) (resid 128 and name   HA )  4.0  2.2  1.5 ! A.2507 at -8.93e+05

! N128

! S137


assign (resid  13 and name HG2# ) (resid  59 and name HD* )  4.0  2.2  2.0 ! A.145  at 2.31e+06
assign (resid  13 and name HG2# ) (resid 121 and name HD* )  4.0  2.2  2.5 ! A.2950 at 3.02e+05
! Queen add I13 041706
assign (resid  13 and name HD1# ) (resid 121 and name HD* )  4.0  2.2  1.0 ! A.171  at 9.35e+05
assign (resid  13 and name HD1# ) (resid 121 and name HG   )  4.0  2.2  1.0 ! A.347  at 3.95e+05

assign (resid  16 and name   HA ) (resid  40 and name HD* )  4.0  2.2  2.5 ! A.213  at 1.68e+06
assign (resid  16 and name HD* ) (resid  42 and name   HA )  4.0  2.2  2.5 ! A.3037 at -4.22e+05

! assign (resid  17 and name  HB# ) (resid  20 and name   HA )  4.0  2.2  2.5 ! A.2713 at -8.00e+05 (Queen 050606) 

! E18
assign (resid  18 and name   HA ) (resid  41 and name HG* )  4.0  2.2  1.5 ! A.679  at 5.75e+05
! assign (resid  18 and name  HG# ) (resid  63 and name  HD# )  4.0  2.2  2.0 ! A.248  at 5.89e+05 (Queen 051406) 
! Queen 041706
! assign (resid  18 and name   HA ) (resid  64 and name  HB# )  4.0  2.2  2.5 ! A.671  at 7.27e+05
assign (resid  93 and name  HG# ) (resid  93 and name  HB# )  2.5  0.7  1.2 ! A.250  at -2.00e+06 ! adjust 

assign (resid  19 and name  HB# ) (resid  22 and name  HB# )  4.0  2.2  2.5 ! A.2738 at 3.03e+05
assign (resid  19 and name  HG# ) (resid  22 and name  HB# )  4.0  2.2  2.5 ! A.2736 at -3.61e+05
assign (resid  78 and name   HA ) (resid  78 and name  HB# )  3.0  1.2  0.8 ! A.1538 at 1.31e+06 ! adjust

assign (resid  21 and name   HA ) (resid  21 and name  HG# )  2.5  0.7  0.7 ! A.283  at -1.69e+06

! V26
! assign (resid  26 and name   HA ) (resid  26 and name HG* )  2.5  0.7  0.7 ! A.350  at 1.54e+06
assign (resid  26 and name   HA ) (resid  29 and name  HB# )  4.0  2.2  2.5 ! A.2747 at 3.22e+05
assign (resid  26 and name HG* ) (resid  30 and name  HB# )  4.0  2.2  1.0 ! A.410  at -1.06e+06

assign (resid  29 and name   HA ) (resid  29 and name  HG# )  4.0  2.2  1.5 ! A.388  at 6.15e+05

! assign (resid  30 and name HD* ) (resid  30 and name   HA )  2.5  0.7  0.7 ! A.402  at 2.53e+06 ! adjust
assign (resid  30 and name   HG ) (resid 117 and name HD* )  4.0  2.2   1.0 ! A.2901 at 3.21e+06  
! assign (resid  30 and name HD* ) (resid 118 and name   HA )  4.0  2.2  2.5 ! A.2372 at 5.50e+05

assign (resid  35 and name  HE1 ) (resid  118 and name HD* )  4.0  2.2  2.5 ! A.501  at -5.05e+05 ! adjust

! assign (resid  42 and name   HA ) (resid  65 and name  HG# )  4.0  2.2  1.5 ! A.690  at -5.30e+05 (Queen 041706)

assign (resid  59 and name HB# ) (resid  59 and name   HA )  4.0  2.2  1.5 ! A.1089 at 7.65e+05 ! adjust

assign (resid  47 and name   HA ) (resid  50 and name  HB# )  2.5  0.7  0.7 ! A.760  at -1.55e+06

! D48
assign (resid  48 and name  HB# ) (resid  49 and name  HG# )  4.0  2.2  2.5 ! A.3091 at 3.28e+05
assign (resid  48 and name   HA ) (resid  51 and name  HB# )  4.0  2.2  1.0 ! A.3092 at -2.23e+06

! Q49
assign (resid  49 and name  HG# ) (resid  49 and name   HA )  2.5  0.7  0.7 ! A.803  at -2.11e+06
assign (resid  49 and name   HA ) (resid  52 and name HD* )  4.0  2.2  1.0 ! A.802  at 9.36e+05
assign (resid  49 and name   HA ) (resid  52 and name   HG )  4.0  2.2  2.0 ! A.800  at 4.26e+05
assign (resid  49 and name   HA ) (resid  52 and name  HB# )  4.0  2.2  1.5 ! A.801  at -8.28e+05
assign (resid  49 and name  HB# ) (resid  53 and name   HG )  4.0  2.2  1.5 ! A.815  at 5.46e+05

! L50
! assign (resid  50 and name HD* ) (resid  50 and name   HA )  3.0  1.2  1.3 ! A.824  at 2.66e+06
assign (resid  50 and name   HG ) (resid  53 and name HD* )  4.0  2.2  1.0 ! A.846  at 1.75e+06
assign (resid  50 and name   HA ) (resid  53 and name  HB# )  4.0  2.2  2.5 ! A.3139 at -3.72e+05
! assign (resid  50 and name   HA ) (resid  14 and name HD* )  4.0  2.2  2.5 ! A.830  at 1.73e+06 ! adjust (Queen 042806)


! D51
assign (resid  51 and name   HA ) (resid  54 and name  HB# )  4.0  2.2  2.5 ! A.3140 at 1.46e+05

! assign (resid  103 and name   HA ) (resid  99 and name HG )  4.0  2.2  1.0 ! A.2301 at 1.18e+06 ! adjust (Queen 050606)
! P55
assign (resid  57 and name   HA ) (resid  57 and name HG* )  3.0  1.2  0.8 ! A.2910 at 1.81e+06

assign (resid  58 and name   HB ) (resid  58 and name HD1# )  3.0  1.2  0.8 ! A.1069 at -1.33e+06
! Queen 041706 
! assign (resid  58 and name HD1# ) (resid  76 and name HD* )  4.0  2.2  1.0 ! A.1078 at 1.37e+06 (notsure)

! assign (resid  59 and name   HA ) (resid  91 and name  HB# )  4.0  2.2  2.5 ! A.1095 at 7.99e+05 
! assign (resid  59 and name   HG ) (resid  91 and name   HA )  4.0  2.2  2.0 ! A.1848 at -4.10e+05
! assign (resid  59 and name HD* ) (resid 117 and name HD* )  4.0  2.2  1.0 ! A.3000 at 2.41e+06 (Queen 041706)
! Queen 041706 L59 add
! assign (resid  59 and name   HG ) (resid  91 and name  HB# )  4.0  2.2  2.5 ! A.313  at 9.26e+05
! assign (resid  59 and name   HG ) (resid  91 and name  HD* )  4.0  2.2  1.0 ! A.315  at 2.53e+06
! assign (resid  59 and name   HB# ) (resid  91 and name  HB# )  4.0  2.2  2.5 ! A.1095 at 7.99e+05
! assign (resid  59 and name   HA ) (resid  91 and name  HD* )  4.0  2.2  2.5 ! A.352  at 5.05e+05
! assign (resid  59 and name   HA ) (resid  91 and name  HG  )  4.0  2.2  2.5 ! A.354  at 5.93e+05
assign (resid  62 and name  HH2 ) (resid  62 and name  HZ2 )  2.5  0.7  0.2 ! A.1309 at -2.04e+06
assign (resid  62 and name  HZ3 ) (resid  62 and name  HH2 )  4.0  2.2  1.0 ! A.2864 at 8.10e+05
assign (resid  62 and name HD1 ) (resid  95 and name   HA )  4.0  2.2  2.5 ! A.722  at -3.96e+05
assign (resid  62 and name  HH2 ) (resid 100 and name HD* )  4.0  2.2  2.5 ! A.2869 at -9.95e+05

assign (resid  64 and name   HA ) (resid  65 and name  HG# )  4.0  2.2  1.5 ! A.1170 at 4.62e+05

assign (resid  65 and name  HD# ) (resid  65 and name  HB# )  4.0  2.2  2.0 ! A.1195 at -5.82e+05
assign (resid  65 and name  HB# ) (resid  66 and name   HA )  4.0  2.2  1.5 ! A.1221 at -4.56e+05
! (Queen 041706)
! assign (resid  65 and name  HG# ) (resid  95 and name   HA )  4.0  2.2  2.5 ! A.723  at 4.07e+05

assign (resid  70 and name   HA ) (resid  73 and name   HG )  4.0  2.2  2.5 ! A.373  at 1.32e+06

assign (resid  58  and name  HB ) (resid  55 and name  HG# ) 4.0  2.2  2.5 ! A.867  at -3.52e+06 ! adjust
! Queen 041706
! assign (resid  73 and name   HG ) (resid 100 and name HD* )  4.0  2.2  2.5 ! A.1401 at 2.26e+06 ! adjust

assign (resid  75 and name  HD2 ) (resid  78 and name   HA )  4.0  2.2  2.5 ! A.1475 at -4.35e+05
assign (resid  76 and name   HA ) (resid  76 and name HD* )  4.0  2.2  1.0 ! A.1498 at 3.20e+06

assign (resid  77 and name  HD# ) (resid  77 and name   HA )  4.0  2.2  2.5 ! A.1510 at -4.33e+05

assign (resid  80 and name  HG# ) (resid  80 and name   HA )  2.5  0.7  0.7 ! A.1556 at -1.60e+06
assign (resid  83 and name  HB# ) (resid  85 and name  HD# )  3.0  1.2  1.3 ! A.3125 at -9.47e+05
assign (resid  88 and name HG* ) (resid  89 and name   HA )  4.0  2.2  2.5 ! A.1729 at 3.29e+05
assign (resid  88 and name   HB ) (resid 104 and name   HA )  4.0  2.2  1.0 ! A.1694 at 1.45e+06
! assign (resid  88 and name HG* ) (resid 104 and name   HA )  4.0  2.2  1.0 ! A.1711 at -1.01e+06
assign (resid  90 and name  HE# ) (resid 101 and name   HA )  4.0  2.2  2.0 ! A.1823 at -3.35e+05
! assign (resid  91 and name HD* ) (resid  59 and name  HB# )  4.0  2.2  1.5  ! A.1101 at -1.57e+06 ! adjust
assign (resid  59 and name HB# ) (resid  15 and name  HD* )  4.0  2.2  1.5 ! A.1101 at -1.57e+06 ! adjust sure

assign (resid  93 and name  HG# ) (resid  93 and name   HA )  2.5  0.7  0.7 ! A.1874 at -1.49e+06
assign (resid  94 and name  HB# ) (resid 101 and name HG2# )  4.0  2.2  2.0 ! A.1923 at 4.48e+05

assign (resid  95 and name  HB# ) (resid  95 and name  HD# )  4.0  2.2  2.5 ! A.1980 at -3.29e+05
assign (resid  95 and name  HG# ) (resid  95 and name   HA )  4.0  2.2  2.5 ! A.726  at 3.39e+05

! assign (resid  99 and name   HA ) (resid  99 and name HD* )  3.0  1.2  0.8 ! A.1492 at 2.11e+06
assign (resid 100 and name  HB# ) (resid 101 and name HG2# )  4.0  2.2  2.5 ! A.2079 at -5.80e+06
assign (resid 100 and name   HA ) (resid 103 and name  HB# )  4.0  2.2  1.5 ! A.2052 at 4.42e+05

assign (resid 101 and name  HB ) (resid 102 and name  HB# )  4.0  2.2  2.5 ! A.2088 at 3.29e+05
assign (resid 101 and name  HG2# ) (resid 102 and name  HA )  4.0  2.2  1.5 ! A.2093 at 5.58e+05
assign (resid 101 and name HG2# ) (resid 107 and name HD1# )  2.5  0.7  1.2 ! A.1946 at 3.19e+06
 
! S105
assign (resid 105 and name   HA ) (resid 87 and name HD* )  4.0  2.2  2.5 ! A.3014 at 3.35e+05 ! adjust

! assign (resid 106 and name  HB# ) (resid 120 and name HG2# )  4.0  2.2  2.5 ! A.2394 at 4.09e+06 (Queen 042806)

assign (resid 113 and name   HA ) (resid 116 and name  HB# )  4.0  2.2  2.5 ! A.3143 at 1.16e+05 

! H12
assign (resid  12 and name  HB# ) (resid  12 and name   HN )  3.0  1.2  1.0 ! A.69   at 9.97e+07
assign (resid  12 and name   HA ) (resid  13 and name   HN )  2.5  0.7  0.4 ! A.75   at 2.68e+08
assign (resid  12 and name  HB# ) (resid  13 and name   HN )  4.0  2.2  2.5 ! A.85   at 2.69e+07
assign (resid  12 and name   HA ) (resid  36 and name   HN )  4.0  2.2  2.0 ! A.252  at 2.91e+07
assign (resid  12 and name   HN ) (resid  55 and name   HA )  4.0  2.2  1.0 ! A.66   at 5.82e+07
assign (resid  12 and name   HN ) (resid  55 and name  HB# )  4.0  2.2  2.5 ! A.1116 at 1.39e+07
assign (resid  12 and name   HN ) (resid  56 and name HG2# )  4.0  2.2  2.5 ! A.68   at 4.75e+07
assign (resid  12 and name   HN ) (resid  56 and name HG1# )  4.0  2.2  2.5 ! A.70   at 1.66e+07
assign (resid  12 and name   HN ) (resid  56 and name HD1# )  4.0  2.2  2.5 ! A.74   at 2.99e+07
assign (resid  12 and name  HB# ) (resid  56 and name   HN )  4.0  2.2  2.5 ! A.227  at 2.12e+07

! I13
assign (resid  13 and name HD1# ) (resid  13 and name   HN )  4.0  2.2  2.5 ! A.80   at 3.70e+07
assign (resid  13 and name HG1# ) (resid  13 and name   HN )  4.0  2.2  1.5 ! A.83   at 5.12e+07
assign (resid  13 and name HG2# ) (resid  13 and name   HN )  4.0  2.2  1.5 ! A.79   at 6.15e+07
assign (resid  13 and name   HB ) (resid  13 and name   HN )  3.0  1.2  0.5 ! A.78   at -9.54e+07
assign (resid  13 and name HG2# ) (resid  14 and name   HN )  2.5  0.7  0.9 ! A.94   at 1.69e+08
assign (resid  13 and name   HA ) (resid  14 and name   HN )  2.5  0.7  0.4 ! A.89   at 3.17e+08
assign (resid  13 and name HG1# ) (resid  14 and name   HN )  4.0  2.2  2.5 ! A.98   at 1.67e+07
assign (resid  13 and name HD1# ) (resid  14 and name   HN )  4.0  2.2  2.5 ! A.95   at 2.78e+07
assign (resid  13 and name   HB ) (resid  14 and name   HN )  4.0  2.2  2.0 ! A.93   at -1.99e+07
assign (resid  13 and name HG2# ) (resid  15 and name   HN )  4.0  2.2  2.5 ! A.105  at 1.73e+07
assign (resid  13 and name   HN ) (resid  36 and name  HB# )  4.0  2.2  2.5 ! A.1120 at -3.16e+07
assign (resid  13 and name   HN ) (resid  37 and name   HA )  4.0  2.2  1.0 ! A.77   at 6.74e+07
assign (resid  13 and name   HN ) (resid  37 and name HG* )  4.0  2.2  1.5 ! A.82   at 4.79e+07
assign (resid  13 and name HG2# ) (resid  38 and name   HN )  4.0  2.2  2.5 ! A.121  at 3.14e+07
assign (resid  13 and name   HN ) (resid  38 and name HD1# )  4.0  2.2  2.5 ! A.81   at 2.79e+07
! Queen 041706
! assign (resid  13 and name   HN ) (resid  53 and name HD* )  4.0  2.2  2.5 ! A.1118 at 8.96e+06
assign (resid  13 and name HD1# ) (resid  56 and name   HN )  4.0  2.2  2.5 ! A.230  at 1.60e+07
assign (resid  13 and name   HA ) (resid  56 and name   HN )  4.0  2.2  2.0 ! A.229  at 2.60e+07
assign (resid  13 and name HD1# ) (resid  57 and name   HN )  4.0  2.2  2.5 ! A.238  at 4.94e+07
assign (resid  13 and name HG2# ) (resid  57 and name   HN )  4.0  2.2  1.5 ! A.239  at 5.08e+07
assign (resid  13 and name   HA ) (resid  57 and name   HN )  3.0  1.2  0.5 ! A.235  at 8.82e+07
assign (resid  13 and name HG1# ) (resid  57 and name   HN )  4.0  2.2  2.5 ! A.247  at 2.67e+07
assign (resid  13 and name HG2# ) (resid  59 and name   HN )  4.0  2.2  1.5 ! A.172  at 6.77e+07

! L14
assign (resid  14 and name HD* ) (resid  14 and name   HN )  4.0  2.2  1.5 ! A.92   at 5.16e+07
assign (resid  14 and name  HB# ) (resid  14 and name   HN )  3.0  1.2  1.0 ! A.90   at -9.16e+07
assign (resid  14 and name   HG ) (resid  15 and name   HN )  4.0  2.2  2.0 ! A.110  at 4.03e+07
assign (resid  14 and name HD* ) (resid  15 and name   HN )  3.0  1.2  1.0 ! A.108  at 1.32e+08
assign (resid  14 and name  HB# ) (resid  15 and name   HN )  4.0  2.2  2.5 ! A.1127 at -2.84e+07
assign (resid  14 and name   HA ) (resid  15 and name   HN )  2.5  0.7  0.4 ! A.102  at -3.79e+08
assign (resid  14 and name   HN ) (resid  57 and name HG* )  4.0  2.2  2.5 ! A.100  at 2.41e+07
assign (resid  14 and name   HN ) (resid  58 and name HG1# )  4.0  2.2  2.5 ! A.97   at 2.44e+07

! L15
assign (resid  15 and name HD* ) (resid  15 and name   HN )  4.0  2.2  2.5 ! A.1126 at 1.30e+07
assign (resid  15 and name  HB# ) (resid  15 and name   HN )  4.0  2.2  1.5 ! A.104  at -7.93e+07
assign (resid  15 and name   HA ) (resid  16 and name   HN )  2.5  0.7  0.4 ! A.123  at 2.77e+08
assign (resid  15 and name HD* ) (resid  16 and name   HN )  4.0  2.2  2.5 ! A.1134 at 1.30e+07
assign (resid  15 and name   HN ) (resid  37 and name HG* )  4.0  2.2  2.5 ! A.107  at 7.53e+07
assign (resid  15 and name   HN ) (resid  38 and name HG2# )  4.0  2.2  2.5 ! A.106  at 3.15e+07
assign (resid  15 and name   HN ) (resid  38 and name   HB )  4.0  2.2  1.0 ! A.103  at -4.51e+07
assign (resid  15 and name   HN ) (resid  39 and name   HA )  4.0  2.2  1.0 ! A.115  at 6.66e+07

! L16
assign (resid  16 and name   HG ) (resid  16 and name   HN )  4.0  2.2  1.0 ! A.127  at 4.73e+07
! assign (resid  16 and name HD* ) (resid  16 and name   HN )  4.0  2.2  1.5 ! A.128  at 6.49e+07
assign (resid  16 and name HD* ) (resid  16 and name   HN )  4.0  2.2  1.5 ! A.129  at 5.38e+07
assign (resid  16 and name  HB# ) (resid  16 and name   HN )  4.0  2.2  1.5 ! A.125  at -5.82e+07
assign (resid  16 and name   HG ) (resid  17 and name   HN )  4.0  2.2  2.0 ! A.140  at 2.92e+07
assign (resid  16 and name   HA ) (resid  17 and name   HN )  2.5  0.7  0.4 ! A.132  at 3.84e+08
assign (resid  16 and name HD* ) (resid  17 and name   HN )  4.0  2.2  1.5 ! A.138  at 7.77e+07
assign (resid  16 and name  HB# ) (resid  17 and name   HN )  4.0  2.2  2.5 ! A.137  at -2.11e+07
assign (resid  16 and name HD* ) (resid  40 and name   HN )  4.0  2.2  2.0 ! A.278  at 6.34e+07
assign (resid  16 and name   HN ) (resid  60 and name  HE# )  4.0  2.2  2.5 ! A.1132 at 1.31e+07
assign (resid  16 and name   HN ) (resid  60 and name  HG# )  4.0  2.2  2.5 ! A.1128 at 1.08e+07
assign (resid  16 and name  HB# ) (resid  61 and name   HN )  4.0  2.2  2.5 ! A.196  at -2.78e+07

! E17
assign (resid  17 and name  HB# ) (resid  17 and name   HN )  4.0  2.2  2.5 ! A.142  at -4.19e+07
assign (resid  17 and name   HN ) (resid  39 and name  HD1 )  4.0  2.2  1.0 ! A.131  at -6.96e+07
assign (resid  17 and name   HN ) (resid  39 and name  HZ2 )  4.0  2.2  2.5 ! A.1505  at 9.51e+06 (Queen 050606) 
assign (resid  17 and name   HN ) (resid  41 and name   HA )  4.0  2.2  1.0 ! A.133  at 6.69e+07
assign (resid  17 and name   HN ) (resid  41 and name  HG* )  4.0  2.2  2.5 ! A.134  at 3.13e+07 (Queen 050606)
assign (resid  17 and name   HA ) (resid  61 and name   HN )  4.0  2.2  2.0 ! A.191  at 2.45e+07

! E18

! E19

! D20
assign (resid  20 and name   HA ) (resid  21 and name   HN )  4.0  2.2  2.0 ! A.283  at 2.96e+07
assign (resid  20 and name  HB# ) (resid  21 and name   HN )  3.0  1.2  1.0 ! A.282  at -9.27e+07
assign (resid  20 and name   HA ) (resid  23 and name   HN )  4.0  2.2  2.5 ! A.295  at 2.95e+07

! E21
assign (resid  21 and name  HB# ) (resid  21 and name   HN )  2.5  0.7  0.9 ! A.281  at 1.80e+08
assign (resid  21 and name  HG# ) (resid  21 and name   HN )  3.0  1.2  1.0 ! A.285  at -8.41e+07
assign (resid  21 and name   HN ) (resid  22 and name  HB# )  4.0  2.2  2.5 ! A.1138 at 1.54e+07
assign (resid  21 and name   HA ) (resid  24 and name   HN )  4.0  2.2  2.0 ! A.299  at 3.59e+07

! A22
assign (resid  22 and name   HA ) (resid  23 and name   HN )  4.0  2.2  2.0 ! A.1143 at 4.35e+07
assign (resid  22 and name  HB# ) (resid  23 and name   HN )  2.5  0.7  0.9 ! A.296  at 1.70e+08
assign (resid  22 and name  HB# ) (resid  24 and name   HN )  4.0  2.2  2.5 ! A.300  at 1.98e+07
assign (resid  22 and name   HA ) (resid  24 and name   HN )  4.0  2.2  2.0 ! A.1149 at 1.75e+07
assign (resid  22 and name   HN ) (resid  25 and name   HB )  4.0  2.2  2.0 ! A.1140 at 3.11e+07
assign (resid  22 and name   HA ) (resid  25 and name   HN )  4.0  2.2  1.0 ! A.315  at 7.98e+07

! A23
assign (resid  23 and name   HN ) (resid  24 and name   HB )  4.0  2.2  2.0 ! A.297  at 2.20e+07
assign (resid  23 and name   HA ) (resid  24 and name   HN )  4.0  2.2  2.0 ! A.306  at 2.27e+07
assign (resid  23 and name   HA ) (resid  26 and name   HN )  4.0  2.2  2.0 ! A.324  at 3.48e+07

! T24
assign (resid  24 and name HG2# ) (resid  24 and name   HN )  4.0  2.2  1.0 ! A.304  at 9.11e+07
assign (resid  24 and name   HB ) (resid  24 and name   HN )  2.5  0.7  0.4 ! A.302  at 1.49e+08
assign (resid  24 and name   HA ) (resid  25 and name   HN )  4.0  2.2  1.0 ! A.309  at 7.64e+07
assign (resid  24 and name   HB ) (resid  25 and name   HN )  3.0  1.2  0.5 ! A.319  at 8.59e+07
assign (resid  24 and name   HN ) (resid  25 and name   HB )  4.0  2.2  2.0 ! A.1151 at 1.19e+07
assign (resid  24 and name   HB ) (resid  26 and name   HN )  4.0  2.2  2.0 ! A.337  at 1.74e+07

! V25
assign (resid  25 and name   HB ) (resid  25 and name   HN )  2.5  0.7  0.4 ! A.314  at 1.62e+08
! assign (resid  25 and name HG* ) (resid  25 and name   HN )  4.0  2.2  1.5 ! A.318  at 2.22e+08 (wd,ov)
assign (resid  25 and name HG* ) (resid  25 and name   HN )  4.0  2.2  1.5 ! A.317  at 6.32e+07
assign (resid  25 and name   HB ) (resid  26 and name   HN )  3.0  1.2  1.0 ! A.335  at 1.80e+08
assign (resid  25 and name   HA ) (resid  26 and name   HN )  4.0  2.2  1.0 ! A.322  at 7.61e+07
assign (resid  25 and name HG* ) (resid  26 and name   HN )  4.0  2.2  1.0 ! A.329  at 9.29e+07
! assign (resid  25 and name HG* ) (resid  26 and name   HN )  3.0  1.2  1.0 ! A.330  at 8.09e+07
assign (resid  25 and name   HA ) (resid  28 and name   HN )  4.0  2.2  1.0 ! A.370  at 6.60e+07

! V26
assign (resid  26 and name   HB ) (resid  26 and name   HN )  2.5  0.7  0.4 ! A.334  at 2.05e+08
assign (resid  26 and name   HN ) (resid  27 and name  HB# )  4.0  2.2  2.5 ! A.336  at 1.65e+07
assign (resid  26 and name   HB ) (resid  27 and name   HN )  4.0  2.2  1.0 ! A.341  at 4.85e+07
assign (resid  26 and name HG* ) (resid  27 and name   HN )  4.0  2.2  2.5 ! A.339  at 2.76e+07
assign (resid  26 and name   HA ) (resid  28 and name   HN )  4.0  2.2  2.0 ! A.1160 at 1.58e+07
assign (resid  26 and name HG* ) (resid  30 and name   HN )  4.0  2.2  1.5 ! A.390  at 7.69e+07
assign (resid  26 and name   HA ) (resid  30 and name   HN )  4.0  2.2  2.0 ! A.395  at 2.47e+07

! C27
assign (resid  27 and name  HB# ) (resid  27 and name   HN )  4.0  2.2  1.5 ! A.340  at 4.52e+07
assign (resid  27 and name  HB# ) (resid  28 and name   HN )  3.0  1.2  1.0 ! A.357  at 1.13e+08
assign (resid  27 and name   HA ) (resid  28 and name   HN )  4.0  2.2  1.0 ! A.371  at 4.92e+07
assign (resid  27 and name   HA ) (resid  31 and name   HN )  2.5  0.7  0.9 ! A.841  at 2.78e+08

! E28
assign (resid  28 and name  HB# ) (resid  28 and name   HN )  2.5  0.7  0.9 ! A.361  at 2.39e+08
assign (resid  28 and name  HG# ) (resid  28 and name   HN )  4.0  2.2  1.0 ! A.356  at -1.21e+08
assign (resid  28 and name   HN ) (resid  29 and name  HB# )  4.0  2.2  2.5 ! A.362  at 3.69e+07
assign (resid  28 and name   HA ) (resid  30 and name   HN )  4.0  2.2  2.0 ! A.1167 at 2.00e+07
assign (resid  28 and name   HA ) (resid  31 and name   HN )  4.0  2.2  2.0 ! A.399  at 3.67e+07

! M29
assign (resid  29 and name  HB# ) (resid  30 and name   HN )  4.0  2.2  1.5 ! A.393  at 7.50e+07
assign (resid  29 and name  HG# ) (resid  30 and name   HN )  4.0  2.2  2.5 ! A.1169 at 1.87e+07

! L30
assign (resid  30 and name HD* ) (resid  30 and name   HN )  3.0  1.2  1.0 ! A.389  at 9.79e+07
assign (resid  30 and name   HG ) (resid  30 and name   HN )  3.0  1.2  1.0 ! A.388  at 8.89e+07 (wd)
assign (resid  30 and name  HB# ) (resid  30 and name   HN )  4.0  2.2  1.5 ! A.391  at -7.04e+07
assign (resid  30 and name   HN ) (resid  31 and name   HA )  4.0  2.2  2.0 ! A.1168 at 1.45e+07
assign (resid  30 and name   HA ) (resid  33 and name   HN )  4.0  2.2  1.0 ! A.414  at 7.90e+07
assign (resid  30 and name  HB# ) (resid  33 and name   HN )  4.0  2.2  2.5 ! A.1184 at -1.37e+07
assign (resid  30 and name   HN ) (resid  33 and name  HB# )  4.0  2.2  2.5 ! A.1170 at 2.56e+07
assign (resid  30 and name   HA ) (resid  34 and name   HN )  4.0  2.2  2.0 ! A.427  at -2.23e+07
assign (resid  30 and name   HA ) (resid  35 and name   HN )  4.0  2.2  2.0 ! A.434  at 2.78e+07
assign (resid  30 and name HD* ) (resid  35 and name   HN )  4.0  2.2  2.5 ! A.1197 at 1.77e+07

! T31
assign (resid  31 and name   HB ) (resid  31 and name   HN )  2.5  0.7  0.4 ! A.398  at 1.51e+08
assign (resid  31 and name   HA ) (resid  32 and name   HN )  4.0  2.2  2.0 ! A.1177 at 8.60e+06
assign (resid  31 and name HG2# ) (resid  32 and name   HN )  4.0  2.2  2.5 ! A.409  at 1.30e+07
assign (resid  31 and name   HA ) (resid  33 and name   HN )  4.0  2.2  2.0 ! A.417  at 3.07e+07
assign (resid  31 and name   HB ) (resid  33 and name   HN )  4.0  2.2  2.0 ! A.1181 at 1.46e+07
assign (resid  31 and name   HA ) (resid  34 and name   HN )  4.0  2.2  1.0 ! A.424  at -8.02e+07 (wd)
assign (resid  31 and name   HA ) (resid  35 and name   HN )  4.0  2.2  1.0 ! A.436  at 1.07e+08 (wd)

! A32
assign (resid  32 and name  HB# ) (resid  32 and name   HN )  4.0  2.2  1.5 ! A.411  at 6.92e+07
assign (resid  32 and name   HA ) (resid  33 and name   HN )  3.0  1.2  0.5 ! A.413  at 8.66e+07
assign (resid  32 and name  HB# ) (resid  33 and name   HN )  3.0  1.2  0.8 ! A.420  at 1.91e+08
assign (resid  32 and name   HA ) (resid  34 and name   HN )  4.0  2.2  1.0 ! A.426  at -5.33e+07

! A33
assign (resid  33 and name  HB# ) (resid  33 and name   HN )  2.5  0.7  0.9 ! A.419  at 4.60e+08
assign (resid  33 and name   HA ) (resid  34 and name   HN )  3.0  1.2  0.5 ! A.1187 at 1.22e+08
assign (resid  33 and name  HB# ) (resid  34 and name   HN )  3.0  1.2  1.0 ! A.430  at -1.47e+08
assign (resid  33 and name   HN ) (resid  34 and name  HA# )  4.0  2.2  2.5 ! A.416  at -1.95e+07
assign (resid  33 and name  HB# ) (resid  35 and name   HN )  4.0  2.2  2.5 ! A.442  at 8.06e+07 (wd,ov)
assign (resid  33 and name   HA ) (resid  35 and name   HN )  4.0  2.2  2.0 ! A.439  at -2.59e+07
assign (resid  33 and name   HN ) (resid  35 and name  HD1 )  4.0  2.2  2.0 ! A.1180 at -1.47e+07

! G34
assign (resid  34 and name   HN ) (resid  35 and name  HD1 )  4.0  2.2  2.0 ! A.423  at 2.25e+07
assign (resid  34 and name   HN ) (resid  35 and name  HB# )  4.0  2.2  2.5 ! A.1189 at 1.65e+07
assign (resid  34 and name   HN ) (resid  35 and name   HA )  4.0  2.2  2.0 ! A.428  at -2.24e+07
assign (resid  34 and name  HA# ) (resid  35 and name   HN )  4.0  2.2  1.5 ! A.438  at -6.45e+07

! F35
assign (resid  35 and name  HB# ) (resid  35 and name   HN )  4.0  2.2  1.5 ! A.441  at -7.03e+07
assign (resid  35 and name  HD1 ) (resid  35 and name   HN )  3.0  1.2  0.5 ! A.443  at -9.96e+07
assign (resid  35 and name   HA ) (resid  36 and name   HN )  2.5  0.7  0.4 ! A.250  at 1.86e+08
assign (resid  35 and name  HB# ) (resid  36 and name   HN )  4.0  2.2  1.5 ! A.254  at -5.11e+07

! K36
assign (resid  36 and name  HD# ) (resid  36 and name   HN )  4.0  2.2  2.5 ! A.257  at 2.60e+07
assign (resid  36 and name  HG# ) (resid  36 and name   HN )  4.0  2.2  1.5 ! A.256  at 4.73e+07
assign (resid  36 and name  HB# ) (resid  36 and name   HN )  4.0  2.2  1.5 ! A.258  at -5.94e+07
assign (resid  36 and name  HG# ) (resid  37 and name   HN )  4.0  2.2  1.5 ! A.447  at 5.07e+07
assign (resid  36 and name   HA ) (resid  37 and name   HN )  2.5  0.7  0.4 ! A.445  at 4.21e+08
assign (resid  36 and name  HB# ) (resid  37 and name   HN )  4.0  2.2  2.5 ! A.450  at -4.14e+07

! V37
assign (resid  37 and name   HB ) (resid  37 and name   HN )  3.0  1.2  0.8 ! A.451  at -1.39e+08
assign (resid  37 and name HG* ) (resid  37 and name   HN )  4.0  2.2  1.0 ! A.446  at 2.17e+08
assign (resid  37 and name HG* ) (resid  38 and name   HN )  4.0  2.2  1.0 ! A.119  at 2.40e+08 (wd)
assign (resid  37 and name   HA ) (resid  38 and name   HN )  2.5  0.7  0.4 ! A.117  at 3.31e+08
assign (resid  37 and name   HN ) (resid  38 and name   HA )  4.0  2.2  2.0 ! A.1206 at 8.13e+06

! I38
assign (resid  38 and name HG1# ) (resid  38 and name   HN )  3.0  1.2  1.0 ! A.118  at 1.07e+08
assign (resid  38 and name HG1# ) (resid  39 and name   HN )  4.0  2.2  1.5 ! A.458  at 5.72e+07
assign (resid  38 and name   HA ) (resid  39 and name   HN )  2.5  0.7  0.4 ! A.453  at 5.22e+08
assign (resid  38 and name   HB ) (resid  39 and name   HN )  4.0  2.2  2.0 ! A.455  at -3.40e+07
assign (resid  38 and name HD1# ) (resid  39 and name   HN )  4.0  2.2  2.0 ! A.1212 at 5.15e+07

! W39
assign (resid  39 and name  HB# ) (resid  39 and name   HN )  3.0  1.2  1.0 ! A.459  at 1.06e+08
assign (resid  39 and name  HE3 ) (resid  39 and name   HN )  4.0  2.2  2.0 ! A.1214 at -1.92e+07
assign (resid  39 and name   HA ) (resid  40 and name   HN )  2.5  0.7  0.4 ! A.114  at 2.23e+08
assign (resid  39 and name  HB# ) (resid  40 and name   HN )  4.0  2.2  2.5 ! A.276  at 2.35e+07
assign (resid  39 and name  HD1 ) (resid  40 and name   HN )  3.0  1.2  0.5 ! A.113  at -1.35e+08

! L40
assign (resid  40 and name  HB# ) (resid  40 and name   HN )  4.0  2.2  1.5 ! A.280  at -7.50e+07
assign (resid  40 and name   HA ) (resid  41 and name   HN )  2.5  0.7  0.4 ! A.462  at -3.12e+08
assign (resid  40 and name  HB# ) (resid  41 and name   HN )  3.0  1.2  1.0 ! A.463  at -9.34e+07
assign (resid  40 and name HD* ) (resid  42 and name   HN )  3.0  1.2  1.0 ! A.270  at 1.14e+08
assign (resid  40 and name  HB# ) (resid  42 and name   HN )  3.0  1.2  1.0 ! A.266  at -1.41e+08
assign (resid  40 and name HD* ) (resid  46 and name   HN )  3.0  1.2  1.0 ! A.492  at 1.18e+08
! assign (resid  40 and name   HG ) (resid  47 and name   HN )  4.0  2.2  1.5 ! A.528  at 8.33e+07 (wd) (Queen 050606)

! V41
! assign (resid  41 and name HG* ) (resid  41 and name   HN )  2.5  0.7  0.9 ! A.466  at 3.12e+08
assign (resid  41 and name HG* ) (resid  41 and name   HN )  2.5  0.7  0.9 ! A.467  at 1.59e+08
assign (resid  41 and name   HB ) (resid  41 and name   HN )  4.0  2.2  1.0 ! A.469  at 6.08e+07
assign (resid  41 and name   HB ) (resid  42 and name   HN )  4.0  2.2  1.0 ! A.269  at 4.83e+07
! assign (resid  41 and name HG* ) (resid  42 and name   HN )  4.0  2.2  1.5 ! A.273  at 6.76e+07
assign (resid  41 and name HG* ) (resid  42 and name   HN )  4.0  2.2  1.0 ! A.274  at 1.55e+08 (wd,ov)
assign (resid  41 and name   HA ) (resid  42 and name   HN )  3.0  1.2  0.5 ! A.264  at 1.08e+08

! D42
assign (resid  42 and name  HB# ) (resid  42 and name   HN )  3.0  1.2  1.0 ! A.267  at -8.10e+07
assign (resid  42 and name   HN ) (resid  43 and name  HA# )  4.0  2.2  2.5 ! A.275  at -1.25e+07
assign (resid  42 and name   HA ) (resid  43 and name   HN )  2.5  0.7  0.4 ! A.470  at -2.09e+08
assign (resid  42 and name  HB# ) (resid  43 and name   HN )  4.0  2.2  1.5 ! A.472  at -7.57e+07
assign (resid  42 and name   HA ) (resid  44 and name   HN )  4.0  2.2  2.5 ! A.1233 at -5.19e+07
assign (resid  42 and name   HN ) (resid  45 and name   HB )  4.0  2.2  2.0 ! A.265  at 2.34e+07

! G43
assign (resid  43 and name  HA# ) (resid  44 and name   HN )  4.0  2.2  1.5 ! A.1234 at -6.12e+07
assign (resid  43 and name  HA# ) (resid  46 and name   HN )  4.0  2.2  2.5 ! A.1242 at -3.59e+07
assign (resid  43 and name  HA# ) (resid  69 and name   HN )  4.0  2.2  2.5 ! A.1306 at -2.83e+07
assign (resid  43 and name   HN ) (resid  69 and name   HA )  4.0  2.2  2.0 ! A.1226 at 1.34e+07

! S44
assign (resid  44 and name  HB# ) (resid  44 and name   HN )  2.5  0.7  0.9 ! A.1239 at 3.16e+08
assign (resid  44 and name   HN ) (resid  45 and name   HB )  4.0  2.2  2.0 ! A.1232 at 1.97e+07
assign (resid  44 and name  HB# ) (resid  45 and name   HN )  3.0  1.2  1.0 ! A.484  at 1.18e+08
assign (resid  44 and name   HA ) (resid  47 and name   HN )  4.0  2.2  1.0 ! A.404  at 6.26e+07
assign (resid  44 and name   HA ) (resid  48 and name   HN )  4.0  2.2  2.0 ! A.1251 at 3.25e+07

! T45
assign (resid  45 and name HG2# ) (resid  45 and name   HN )  4.0  2.2  1.0 ! A.486  at 1.55e+08 (wd)
assign (resid  45 and name   HB ) (resid  45 and name   HN )  3.0  1.2  0.5 ! A.483  at 1.45e+08
assign (resid  45 and name HG2# ) (resid  46 and name   HN )  4.0  2.2  1.0 ! A.490  at 8.43e+07
assign (resid  45 and name   HA ) (resid  46 and name   HN )  3.0  1.2  0.5 ! A.488  at 8.71e+07
assign (resid  45 and name   HB ) (resid  46 and name   HN )  3.0  1.2  0.5 ! A.736  at 1.10e+08
assign (resid  45 and name   HA ) (resid  47 and name   HN )  4.0  2.2  2.0 ! A.1245 at 2.42e+07
assign (resid  45 and name   HA ) (resid  48 and name   HN )  4.0  2.2  1.0 ! A.497  at 7.42e+07
assign (resid  45 and name   HA ) (resid  49 and name   HN )  4.0  2.2  2.0 ! A.1258 at 1.59e+07
assign (resid  45 and name HG2# ) (resid  49 and name   HN )  4.0  2.2  2.5 ! A.1253 at 2.32e+07
assign (resid  45 and name HG2# ) (resid  49 and name HE21 )  4.0  2.2  1.0 ! A.549  at 1.02e+08

! A46
assign (resid  46 and name  HB# ) (resid  46 and name   HN )  2.5  0.7  0.9 ! A.489  at 5.02e+08
assign (resid  46 and name  HB# ) (resid  47 and name   HN )  2.5  0.7  0.9 ! A.405  at 2.96e+08
assign (resid  46 and name   HA ) (resid  47 and name   HN )  3.0  1.2  0.5 ! A.403  at 8.07e+07
assign (resid  46 and name   HA ) (resid  48 and name   HN )  4.0  2.2  2.0 ! A.1247 at 2.26e+07
assign (resid  46 and name   HA ) (resid  49 and name   HN )  4.0  2.2  1.0 ! A.505  at 6.56e+07
assign (resid  46 and name  HB# ) (resid  50 and name   HN )  4.0  2.2  2.5 ! A.1261 at 2.37e+07

! L47
assign (resid  47 and name   HG ) (resid  47 and name   HN )  2.5  0.7  0.9 ! A.408  at 1.93e+08 (wd,ov)
assign (resid  47 and name  HB# ) (resid  47 and name   HN )  2.5  0.7  0.9 ! A.406  at -6.27e+08
assign (resid  47 and name   HA ) (resid  48 and name   HN )  4.0  2.2  1.0 ! A.494  at 7.81e+07
assign (resid  47 and name   HG ) (resid  48 and name   HN )  4.0  2.2  1.0 ! A.501  at 4.78e+07
assign (resid  47 and name  HB# ) (resid  48 and name   HN )  2.5  0.7  0.9 ! A.498  at -3.08e+08
assign (resid  47 and name   HA ) (resid  49 and name   HN )  4.0  2.2  2.0 ! A.1254 at 2.17e+07
assign (resid  47 and name   HA ) (resid  50 and name   HN )  4.0  2.2  1.0 ! A.513  at 6.82e+07
assign (resid  47 and name HD* ) (resid  72 and name   HN )  4.0  2.2  1.5 ! A.592  at 7.84e+07
assign (resid  47 and name   HN ) (resid  72 and name HD* )  4.0  2.2  1.5 ! A.407  at 1.43e+08
assign (resid  47 and name HD* ) (resid  75 and name   HN )  4.0  2.2  2.5 ! A.17   at 7.24e+07

! D48
assign (resid  48 and name  HB# ) (resid  48 and name   HN )  2.5  0.7  0.9 ! A.496  at -3.68e+08
assign (resid  48 and name  HB# ) (resid  49 and name   HN )  3.0  1.2  1.0 ! A.506  at -1.09e+08

! Q49
assign (resid  49 and name  HB# ) (resid  49 and name   HN )  3.0  1.2  1.0 ! A.1252 at 9.53e+07
assign (resid  49 and name  HG# ) (resid  49 and name   HN )  2.5  0.7  0.9 ! A.504  at -2.69e+08
assign (resid  49 and name  HG# ) (resid  49 and name HE21 )  2.5  0.7  0.7 ! A.548  at -1.55e+08
assign (resid  49 and name  HB# ) (resid  50 and name   HN )  4.0  2.2  2.5 ! A.517  at 3.89e+07
assign (resid  49 and name  HG# ) (resid  50 and name   HN )  4.0  2.2  1.5 ! A.514  at -4.56e+07
assign (resid  49 and name   HN ) (resid  50 and name   HA )  4.0  2.2  2.0 ! A.1255 at 2.36e+07
assign (resid  49 and name  HB# ) (resid  52 and name   HN )  4.0  2.2  2.5 ! A.1157 at 9.74e+06
assign (resid  49 and name  HB# ) (resid  53 and name   HN )  4.0  2.2  2.5 ! A.1275 at 1.69e+07

! L50
assign (resid  50 and name  HB# ) (resid  50 and name   HN )  2.5  0.7  0.9 ! A.515  at -4.45e+08
assign (resid  50 and name   HA ) (resid  52 and name   HN )  4.0  2.2  2.0 ! A.323  at 3.43e+07
assign (resid  50 and name   HG ) (resid  53 and name   HN )  4.0  2.2  1.0 ! A.1274 at 1.69e+08 (wd)
assign (resid  50 and name   HA ) (resid  53 and name   HN )  4.0  2.2  1.0 ! A.527  at 6.29e+07
assign (resid  50 and name HD* ) (resid  54 and name   HN )  4.0  2.2  2.5 ! A.535  at 3.66e+07
assign (resid  50 and name   HA ) (resid  54 and name   HN )  4.0  2.2  1.0 ! A.536  at 4.85e+07
assign (resid  50 and name   HG ) (resid  54 and name   HN )  4.0  2.2  2.0 ! A.1278 at 2.66e+07

! D51
assign (resid  51 and name  HB# ) (resid  51 and name   HN )  2.5  0.7  0.9 ! A.519  at -4.21e+08
assign (resid  51 and name  HB# ) (resid  52 and name   HN )  2.5  0.7  0.9 ! A.328  at -2.12e+08
assign (resid  51 and name   HA ) (resid  54 and name HE21 )  3.0  1.2  0.3 ! A.1037 at 1.04e+08
assign (resid  51 and name  HB# ) (resid  54 and name HE21 )  4.0  2.2  2.5 ! A.1038 at -2.85e+07

! L52
assign (resid  52 and name   HG ) (resid  52 and name   HN )  2.5  0.7  0.4 ! A.333  at 1.98e+08
assign (resid  52 and name  HB# ) (resid  52 and name   HN )  2.5  0.7  0.9 ! A.331  at -3.08e+08
assign (resid  52 and name  HB# ) (resid  53 and name   HN )  3.0  1.2  1.0 ! A.526  at -1.45e+08
assign (resid  52 and name   HN ) (resid  54 and name  HG# )  4.0  2.2  2.5 ! A.325  at -3.29e+07

! L53
assign (resid  53 and name HD* ) (resid  53 and name   HN )  4.0  2.2  1.0 ! A.524  at 9.05e+07
assign (resid  53 and name  HB# ) (resid  53 and name   HN )  3.0  1.2  1.0 ! A.525  at -9.10e+07
assign (resid  53 and name   HG ) (resid  53 and name   HN )  3.0  1.2  0.5 ! A.520  at 1.09e+08
assign (resid  53 and name   HN ) (resid  54 and name  HG# )  4.0  2.2  2.5 ! A.1271 at -4.00e+07
assign (resid  53 and name  HB# ) (resid  54 and name   HN )  4.0  2.2  2.5 ! A.1056 at -3.54e+07
assign (resid  53 and name HD* ) (resid  54 and name   HN )  4.0  2.2  2.5 ! A.1277 at 2.16e+07
assign (resid  53 and name   HN ) (resid  55 and name  HD# )  4.0  2.2  2.5 ! A.1272 at -3.72e+07

! Q54
assign (resid  54 and name  HB# ) (resid  54 and name   HN )  3.0  1.2  1.0 ! A.532  at 1.19e+08
assign (resid  54 and name  HG# ) (resid  54 and name   HN )  2.5  0.7  0.9 ! A.531  at -1.98e+08
assign (resid  54 and name  HB# ) (resid  54 and name HE21 )  4.0  2.2  2.5 ! A.1036 at 2.99e+07
assign (resid  54 and name  HG# ) (resid  54 and name HE21 )  3.0  1.2  0.8 ! A.1035 at -1.35e+08
assign (resid  54 and name   HN ) (resid  55 and name  HD# )  3.0  1.2  1.0 ! A.534  at -1.10e+08

! P55
assign (resid  55 and name   HA ) (resid  56 and name   HN )  2.5  0.7  0.9 ! A.219  at 2.40e+08
assign (resid  55 and name  HB# ) (resid  56 and name   HN )  4.0  2.2  2.5 ! A.225  at 3.34e+07
assign (resid  55 and name  HG# ) (resid  57 and name   HN )  4.0  2.2  2.5 ! A.244  at 1.82e+07
assign (resid  55 and name  HB# ) (resid  57 and name   HN )  4.0  2.2  1.5 ! A.248  at 5.81e+07

! I56
assign (resid  56 and name HG1# ) (resid  56 and name   HN )  4.0  2.2  1.5 ! A.224  at 7.16e+07
assign (resid  56 and name HG2# ) (resid  56 and name   HN )  3.0  1.2  1.0 ! A.220  at 1.27e+08
assign (resid  56 and name HD1# ) (resid  56 and name   HN )  4.0  2.2  1.5 ! A.223  at 6.29e+07
assign (resid  56 and name   HB ) (resid  56 and name   HN )  4.0  2.2  1.0 ! A.221  at -6.84e+07
assign (resid  56 and name HD1# ) (resid  57 and name   HN )  4.0  2.2  1.5 ! A.249  at 4.73e+07
assign (resid  56 and name HG1# ) (resid  57 and name   HN )  4.0  2.2  1.5 ! A.245  at 7.45e+07
assign (resid  56 and name   HA ) (resid  57 and name   HN )  3.0  1.2  0.5 ! A.1283 at 9.99e+07
assign (resid  56 and name HG2# ) (resid  57 and name   HN )  4.0  2.2  1.0 ! A.241  at 8.29e+07
assign (resid  56 and name   HB ) (resid  57 and name   HN )  4.0  2.2  1.0 ! A.242  at -5.94e+07
assign (resid  56 and name   HN ) (resid  57 and name   HB )  4.0  2.2  2.0 ! A.222  at -1.67e+07

! V57
assign (resid  57 and name HG* ) (resid  57 and name   HN )  3.0  1.2  1.0 ! A.243  at 1.09e+08
assign (resid  57 and name   HB ) (resid  57 and name   HN )  3.0  1.2  0.5 ! A.240  at -8.58e+07
assign (resid  57 and name HG* ) (resid  58 and name   HN )  2.5  0.7  0.9 ! A.159  at 3.22e+08
assign (resid  57 and name   HB ) (resid  58 and name   HN )  4.0  2.2  2.0 ! A.152  at -3.26e+07
assign (resid  57 and name   HA ) (resid  87 and name   HN )  3.0  1.2  0.5 ! A.595  at 1.22e+08
assign (resid  57 and name HG* ) (resid  87 and name   HN )  4.0  2.2  1.0 ! A.679  at 8.03e+07

! I58
assign (resid  58 and name HG1# ) (resid  58 and name   HN )  3.0  1.2  1.0 ! A.162  at 8.43e+07
assign (resid  58 and name HD1# ) (resid  58 and name   HN )  4.0  2.2  1.5 ! A.155  at 4.66e+07
assign (resid  58 and name   HB ) (resid  58 and name   HN )  2.5  0.7  0.4 ! A.153  at -1.55e+08
assign (resid  58 and name HG2# ) (resid  59 and name   HN )  2.5  0.7  0.9 ! A.173  at 1.61e+08
assign (resid  58 and name HG2# ) (resid  60 and name   HN )  4.0  2.2  1.5 ! A.184  at 4.82e+07
assign (resid  58 and name   HN ) (resid  86 and name  HB# )  4.0  2.2  2.5 ! A.164  at 1.78e+07
assign (resid  58 and name HD1# ) (resid  87 and name   HN )  4.0  2.2  2.5 ! A.1264 at 1.27e+07
assign (resid  58 and name   HN ) (resid  88 and name HG* )  4.0  2.2  2.5 ! A.154  at 2.84e+07
assign (resid  58 and name   HN ) (resid  88 and name   HA )  3.0  1.2  0.5 ! A.151  at 9.57e+07
assign (resid  58 and name HG2# ) (resid  89 and name   HN )  4.0  2.2  2.5 ! A.691  at 2.88e+07
assign (resid  58 and name   HB ) (resid  89 and name   HN )  4.0  2.2  2.0 ! A.686  at -3.18e+07

! L59
assign (resid  59 and name HD* ) (resid  59 and name   HN )  4.0  2.2  1.5 ! A.170  at 6.18e+07
assign (resid  59 and name  HB# ) (resid  59 and name   HN )  4.0  2.2  1.5 ! A.167  at -6.48e+07
assign (resid  59 and name HD* ) (resid  60 and name   HN )  4.0  2.2  1.5 ! A.186  at 7.65e+07
assign (resid  59 and name   HG ) (resid  60 and name   HN )  4.0  2.2  1.0 ! A.181  at 4.64e+07
assign (resid  59 and name  HB# ) (resid  60 and name   HN )  4.0  2.2  1.5 ! A.189  at -4.58e+07
assign (resid  59 and name   HA ) (resid  60 and name   HN )  2.5  0.7  0.4 ! A.176  at -3.95e+08
assign (resid  59 and name   HA ) (resid  89 and name   HN )  3.0  1.2  0.5 ! A.684  at -8.25e+07

! M60
assign (resid  60 and name  HG# ) (resid  60 and name   HN )  4.0  2.2  2.5 ! A.1287 at 1.57e+07
assign (resid  60 and name  HB# ) (resid  60 and name   HN )  4.0  2.2  1.5 ! A.183  at -5.87e+07
assign (resid  60 and name   HA ) (resid  61 and name   HN )  2.5  0.7  0.4 ! A.202  at 3.60e+08
assign (resid  60 and name  HG# ) (resid  61 and name   HN )  4.0  2.2  1.5 ! A.192  at 5.48e+07
assign (resid  60 and name  HB# ) (resid  61 and name   HN )  4.0  2.2  2.5 ! A.197  at -3.16e+07
assign (resid  60 and name  HE# ) (resid  73 and name   HN )  4.0  2.2  1.5 ! A.600  at 6.71e+07
assign (resid  60 and name   HN ) (resid  89 and name  HB# )  4.0  2.2  2.5 ! A.188  at -2.91e+07
assign (resid  60 and name   HN ) (resid  90 and name   HA )  4.0  2.2  1.0 ! A.179  at 7.66e+07
assign (resid  60 and name   HN ) (resid  90 and name  HD# )  4.0  2.2  2.0 ! A.177  at -2.14e+07
assign (resid  60 and name   HN ) (resid  91 and name HD* )  4.0  2.2  2.5 ! A.187  at 3.82e+07

! A61
assign (resid  61 and name  HB# ) (resid  61 and name   HN )  2.5  0.7  0.9 ! A.190  at 3.14e+08
assign (resid  61 and name  HB# ) (resid  62 and name   HN )  3.0  1.2  0.5 ! A.206  at 1.94e+08
assign (resid  61 and name   HA ) (resid  62 and name   HN )  2.5  0.7  0.4 ! A.217  at -4.71e+08
assign (resid  61 and name   HN ) (resid  63 and name  HD# )  4.0  2.2  2.5 ! A.194  at -2.26e+07
assign (resid  61 and name   HA ) (resid  91 and name   HN )  3.0  1.2  0.5 ! A.260  at -1.24e+08
assign (resid  61 and name  HB# ) (resid  91 and name   HN )  4.0  2.2  2.5 ! A.360  at 4.13e+07

! W62
assign (resid  62 and name  HB# ) (resid  62 and name   HN )  4.0  2.2  1.5 ! A.208  at 7.78e+07
assign (resid  62 and name   HN ) (resid  90 and name   HA )  4.0  2.2  2.0 ! A.214  at 2.44e+07
assign (resid  62 and name  HB# ) (resid  91 and name   HN )  4.0  2.2  2.5 ! A.363  at 2.39e+07
assign (resid  62 and name   HN ) (resid  91 and name  HB# )  4.0  2.2  2.5 ! A.218  at -2.78e+07
assign (resid  62 and name   HN ) (resid  92 and name  HA# )  4.0  2.2  2.5 ! A.216  at -3.45e+07
assign (resid  62 and name  HB# ) (resid  93 and name   HN )  4.0  2.2  2.5 ! A.1343 at 2.59e+07
assign (resid  62 and name  HD1 ) (resid  93 and name   HN )  4.0  2.2  2.0 ! A.719  at -3.42e+07
assign (resid  62 and name  HE1 ) (resid  95 and name   HA )  3.0  1.2  1.0 ! A.998  at 2.89e+08 (wd)
assign (resid  62 and name  HE1 ) (resid  95 and name  HB# )  4.0  2.2  1.5 ! A.1004 at 6.45e+07
assign (resid  62 and name  HE1 ) (resid  95 and name  HG# )  4.0  2.2  2.5 ! A.1003 at 1.58e+07
assign (RESid  62 and name  HE1 ) (resid  96 and name HG* )  4.0  2.2  2.5 ! A.1000 at 2.90e+07
! (Queen 050606)
assign (resid  62 and name  HE1 ) (resid  70 and name  HD* )  4.0  2.2  2.5 ! A.1513 at 1.07e+07
assign (resid  62 and name  HE1 ) (resid  100 and name  HD* )  4.0  2.2  2.5 ! A.1512 at 1.66e+07
assign (resid  62 and name  HE1 ) (resid  62 and name HA )  4.0  2.2  2.5 ! A.1515 at 1.01e+07
assign (resid  62 and name  HE1 ) (resid  95 and name  HD#)  4.0  2.2  2.5 ! A.1519 at 1.06e+07

! P63

! P64
assign (resid  64 and name  HG# ) (resid  66 and name   HN )  4.0  2.2  2.5 ! A.544  at 4.19e+07
assign (resid  64 and name  HB# ) (resid  66 and name   HN )  3.0  1.2  1.0 ! A.546  at 1.30e+08
assign (resid  64 and name   HA ) (resid  66 and name   HN )  4.0  2.2  2.0 ! A.540  at 4.18e+07

! P65
assign (resid  65 and name  HG# ) (resid  66 and name   HN )  3.0  1.2  1.0 ! A.545  at 1.27e+08
assign (resid  65 and name   HA ) (resid  66 and name   HN )  3.0  1.2  0.5 ! A.538  at 1.01e+08
assign (resid  65 and name  HB# ) (resid  66 and name   HN )  4.0  2.2  1.5 ! A.547  at 6.29e+07
assign (resid  65 and name  HD# ) (resid  66 and name   HN )  4.0  2.2  1.5 ! A.542  at -5.20e+07

! D66
assign (resid  66 and name  HB# ) (resid  66 and name   HN )  3.0  1.2  1.0 ! A.539  at -8.21e+07
assign (resid  66 and name  HB# ) (resid  67 and name   HN )  4.0  2.2  2.5 ! A.552  at -2.90e+07
assign (resid  66 and name   HA ) (resid  67 and name   HN )  4.0  2.2  2.0 ! A.551  at -3.79e+07
assign (resid  66 and name   HN ) (resid  67 and name   HA )  4.0  2.2  2.0 ! A.1291 at 2.55e+07
assign (resid  66 and name  HB# ) (resid  68 and name   HN )  4.0  2.2  2.5 ! A.559  at -1.94e+07
assign (resid  66 and name   HA ) (resid  68 and name   HN )  4.0  2.2  2.0 ! A.1297 at -1.28e+07

! Q67
assign (resid  67 and name  HG# ) (resid  67 and name   HN )  4.0  2.2  2.5 ! A.1295 at -2.62e+07
assign (resid  67 and name  HB# ) (resid  67 and name   HN )  4.0  2.2  2.5 ! A.554  at 3.84e+07
assign (resid  67 and name  HB# ) (resid  67 and name HE21 )  4.0  2.2  2.5 ! A.1046 at 2.43e+07
assign (resid  67 and name  HG# ) (resid  67 and name HE22 )  4.0  2.2  2.5 ! A.1047 at -4.20e+07
assign (resid  67 and name  HB# ) (resid  68 and name   HN )  4.0  2.2  2.5 ! A.561  at 2.42e+07
assign (resid  67 and name   HA ) (resid  68 and name   HN )  4.0  2.2  2.0 ! A.558  at 2.23e+07
assign (resid  67 and name  HG# ) (resid  68 and name   HN )  4.0  2.2  2.5 ! A.560  at -2.01e+07
assign (resid  67 and name   HA ) (resid  69 and name   HN )  4.0  2.2  1.0 ! A.564  at 5.38e+07
assign (resid  67 and name  HG# ) (resid  69 and name   HN )  4.0  2.2  2.5 ! A.1304 at -1.44e+07

! S68
assign (resid  68 and name  HB# ) (resid  68 and name   HN )  4.0  2.2  2.5 ! A.557  at 2.81e+07
assign (resid  68 and name   HA ) (resid  69 and name   HN )  4.0  2.2  2.0 ! A.563  at 4.39e+07
assign (resid  68 and name  HB# ) (resid  69 and name   HN )  4.0  2.2  2.5 ! A.566  at 2.15e+07
assign (resid  68 and name   HA ) (resid  70 and name   HN )  4.0  2.2  2.0 ! A.1309 at 2.54e+07
assign (resid  68 and name   HA ) (resid  71 and name   HN )  3.0  1.2  0.5 ! A.580  at 9.13e+07

! C69
assign (resid  69 and name  HB# ) (resid  69 and name   HN )  3.0  1.2  1.0 ! A.567  at 1.17e+08
assign (resid  69 and name  HB# ) (resid  70 and name   HN )  4.0  2.2  2.5 ! A.574  at 3.73e+07
assign (resid  69 and name   HA ) (resid  71 and name   HN )  4.0  2.2  2.0 ! A.1313 at 2.40e+07
assign (resid  69 and name   HA ) (resid  72 and name   HN )  4.0  2.2  1.0 ! A.588  at 5.61e+07
assign (resid  69 and name   HA ) (resid  73 and name   HN )  4.0  2.2  2.0 ! A.1315 at 2.02e+07
! Queen 050606
assign (resid  69 and name   HN ) (resid  70 and name   HG )  4.0  2.2  2.0 ! A.1540 at 1.87e+07
assign (resid  69 and name   HN ) (resid  71 and name   HG )  4.0  2.2  2.0 ! A.1541 at 2.09e+07
assign (resid  69 and name   HN ) (resid  70 and name   HB# )  4.0  2.2  2.0 ! A.1538 at -2.60 e+07
assign (resid  69 and name   HN ) (resid  70 and name   HD* )  4.0  2.2  2.5 ! A.1552 at 1.66e+07
assign (resid  69 and name   HN ) (resid  67 and name   HB# )  4.0  2.2  2.5 ! A.1554 at 1.45e+07

! L70
assign (resid  70 and name HD* ) (resid  70 and name   HN )  4.0  2.2  1.0 ! A.576  at 9.16e+07
! assign (resid  70 and name HD* ) (resid  70 and name   HN )  3.0  1.2  1.0 ! A.575  at 9.10e+07
assign (resid  70 and name   HG ) (resid  70 and name   HN )  2.5  0.7  0.4 ! A.573  at 1.65e+08
assign (resid  70 and name  HB# ) (resid  70 and name   HN )  2.5  0.7  0.9 ! A.571  at -1.60e+08
assign (resid  70 and name   HG ) (resid  71 and name   HN )  4.0  2.2  2.0 ! A.581  at 3.81e+07
assign (resid  70 and name  HB# ) (resid  71 and name   HN )  3.0  1.2  1.0 ! A.584  at -9.23e+07
assign (resid  70 and name   HA ) (resid  73 and name   HN )  4.0  2.2  1.0 ! A.597  at 6.87e+07

! L71
assign (resid  71 and name HD* ) (resid  71 and name   HN )  3.0  1.2  1.0 ! A.582  at 8.78e+07
assign (resid  71 and name  HB# ) (resid  71 and name   HN )  2.5  0.7  0.9 ! A.583  at -1.65e+08
! assign (resid  71 and name HD* ) (resid  71 and name   HN )  4.0  2.2  1.0 ! A.578  at 8.10e+07 (wd)
assign (resid  71 and name   HG ) (resid  71 and name   HN )  2.5  0.7  0.4 ! A.579  at 1.91e+08
assign (resid  71 and name   HA ) (resid  72 and name   HN )  4.0  2.2  1.0 ! A.587  at 6.67e+07
assign (resid  71 and name  HB# ) (resid  72 and name   HN )  3.0  1.2  1.0 ! A.591  at -8.07e+07
assign (resid  71 and name   HA ) (resid  74 and name   HN )  3.0  1.2  0.5 ! A.607  at 1.33e+08

! L72
! assign (resid  72 and name HD* ) (resid  72 and name   HN )  4.0  2.2  1.0 ! A.511  at 1.15e+08
assign (resid  72 and name HD* ) (resid  72 and name   HN )  4.0  2.2  1.5 ! A.593  at 7.52e+07
assign (resid  72 and name  HB# ) (resid  72 and name   HN )  3.0  1.2  1.0 ! A.590  at -9.85e+07
assign (resid  72 and name HD* ) (resid  73 and name   HN )  4.0  2.2  2.5 ! A.602  at 4.02e+07
assign (resid  72 and name   HG ) (resid  73 and name   HN )  4.0  2.2  1.0 ! A.605  at 4.51e+07
! assign (resid  72 and name HD* ) (resid  73 and name   HN )  4.0  2.2  1.5 ! A.603  at 5.62e+07
assign (resid  72 and name   HA ) (resid  75 and name   HN )  4.0  2.2  1.0 ! A.615  at 7.51e+07
assign (resid  72 and name  HB# ) (resid  75 and name   HN )  4.0  2.2  2.5 ! A.12   at -2.46e+07

! L73
assign (resid  73 and name HD* ) (resid  73 and name   HN )  4.0  2.2  1.0 ! A.601  at 8.64e+07
assign (resid  73 and name  HB# ) (resid  73 and name   HN )  4.0  2.2  1.5 ! A.598  at -6.38e+07
assign (resid  73 and name   HG ) (resid  74 and name   HN )  4.0  2.2  2.0 ! A.614  at 3.45e+07
assign (resid  73 and name   HA ) (resid  74 and name   HN )  4.0  2.2  1.0 ! A.608  at 5.58e+07
assign (resid  73 and name  HB# ) (resid  74 and name   HN )  4.0  2.2  1.5 ! A.610  at -5.51e+07
! assign (resid  73 and name   HG ) (resid  77 and name   HN )  4.0  2.2  2.0 ! A.909  at 3.90e+07 (Queen 041706)

! Q74
assign (resid  74 and name  HB# ) (resid  74 and name   HN )  2.5  0.7  0.9 ! A.613  at 2.63e+08
assign (resid  74 and name  HG# ) (resid  74 and name   HN )  4.0  2.2  1.0 ! A.609  at -1.66e+08 (wd)
assign (resid  74 and name  HG# ) (resid  74 and name HE22 )  3.0  1.2  0.8 ! A.1052 at -9.82e+07
assign (resid  74 and name  HB# ) (resid  74 and name HE21 )  4.0  2.2  2.5 ! A.1054 at 4.46e+07
assign (resid  74 and name  HG# ) (resid  74 and name HE21 )  2.5  0.7  0.7 ! A.1053 at -1.74e+08
assign (resid  74 and name  HB# ) (resid  74 and name HE22 )  4.0  2.2  2.5 ! A.1050 at 2.56e+07
assign (resid  74 and name  HB# ) (resid  75 and name   HN )  3.0  1.2  1.0 ! A.15   at 1.27e+08
assign (resid  74 and name   HA ) (resid  75 and name   HN )  4.0  2.2  1.0 ! A.616  at 5.55e+07
assign (resid  74 and name  HG# ) (resid  75 and name   HN )  4.0  2.2  1.0 ! A.11   at -8.72e+07
assign (resid  74 and name   HN ) (resid  75 and name  HB# )  4.0  2.2  2.5 ! A.1318 at 1.66e+07
assign (resid  74 and name   HA ) (resid  77 and name   HN )  4.0  2.2  1.0 ! A.627  at 7.62e+07
assign (resid  74 and name   HA ) (resid  78 and name   HN )  4.0  2.2  2.0 ! A.376  at 2.42e+07

! H75
assign (resid  75 and name  HB# ) (resid  75 and name   HN )  2.5  0.7  0.9 ! A.14   at 1.66e+08
assign (resid  75 and name  HD2 ) (resid  75 and name   HN )  4.0  2.2  2.0 ! A.18   at -2.13e+07
assign (resid  75 and name   HN ) (resid  76 and name   HG )  4.0  2.2  2.0 ! A.16   at 1.21e+07
assign (resid  75 and name   HA ) (resid  76 and name   HN )  4.0  2.2  2.0 ! A.620  at 4.40e+07
assign (resid  75 and name  HB# ) (resid  76 and name   HN )  4.0  2.2  1.5 ! A.622  at 7.76e+07
assign (resid  75 and name  HD2 ) (resid  76 and name   HN )  4.0  2.2  2.0 ! A.625  at -3.36e+07
assign (resid  75 and name   HA ) (resid  78 and name   HN )  4.0  2.2  1.0 ! A.377  at 4.72e+07
assign (resid  75 and name   HA ) (resid  79 and name   HN )  4.0  2.2  2.0 ! A.643  at 1.89e+07

! L76
assign (resid  76 and name   HG ) (resid  76 and name   HN )  3.0  1.2  0.5 ! A.623  at 1.25e+08
assign (resid  76 and name HD* ) (resid  77 and name   HN )  4.0  2.2  2.5 ! A.636  at 3.20e+07
assign (resid  76 and name   HA ) (resid  77 and name   HN )  4.0  2.2  1.0 ! A.628  at 7.84e+07
assign (resid  76 and name  HB# ) (resid  77 and name   HN )  4.0  2.2  1.5 ! A.630  at -6.37e+07
assign (resid  76 and name   HN ) (resid  77 and name  HB# )  4.0  2.2  2.5 ! A.1265 at -1.40e+07

! R77
assign (resid  77 and name  HB# ) (resid  77 and name   HE )  4.0  2.2  2.5 ! A.1015 at 1.41e+07
assign (resid  77 and name  HG# ) (resid  77 and name   HN )  4.0  2.2  1.5 ! A.633  at 6.63e+07
assign (resid  77 and name  HB# ) (resid  77 and name   HN )  3.0  1.2  1.0 ! A.635  at 1.24e+08
assign (resid  77 and name  HD# ) (resid  77 and name   HN )  4.0  2.2  2.5 ! A.631  at -3.47e+07
assign (resid  77 and name   HA ) (resid  78 and name   HN )  4.0  2.2  1.0 ! A.375  at 5.30e+07
assign (resid  77 and name   HA ) (resid  79 and name   HN )  4.0  2.2  2.0 ! A.1324 at 3.04e+07
assign (resid  77 and name   HA ) (resid  80 and name   HN )  4.0  2.2  2.0 ! A.291  at 2.09e+07

! E78
assign (resid  78 and name  HB# ) (resid  78 and name   HN )  2.5  0.7  0.9 ! A.379  at 2.20e+08
assign (resid  78 and name  HG# ) (resid  78 and name   HN )  4.0  2.2  1.0 ! A.381  at -1.43e+08 (wd)
assign (resid  78 and name   HN ) (resid  79 and name  HB# )  4.0  2.2  2.5 ! A.1163 at 1.41e+07
assign (resid  78 and name   HN ) (resid  79 and name   HA )  4.0  2.2  2.0 ! A.384  at 1.39e+07
assign (resid  78 and name   HN ) (resid  79 and name  HD2 )  4.0  2.2  2.0 ! A.382  at -2.09e+07
assign (resid  78 and name  HB# ) (resid  79 and name   HN )  4.0  2.2  1.5 ! A.646  at 5.87e+07
assign (resid  78 and name   HA ) (resid  79 and name   HN )  3.0  1.2  1.0 ! A.1326 at 1.39e+08 (wd)
assign (resid  78 and name  HG# ) (resid  79 and name   HN )  4.0  2.2  2.5 ! A.642  at -2.51e+07

! H79
assign (resid  79 and name  HB# ) (resid  79 and name   HN )  3.0  1.2  1.0 ! A.645  at 1.23e+08
assign (resid  79 and name  HD2 ) (resid  79 and name   HN )  4.0  2.2  1.0 ! A.638  at -5.08e+07
assign (resid  79 and name   HA ) (resid  80 and name   HN )  4.0  2.2  1.0 ! A.288  at 7.24e+07
assign (resid  79 and name  HB# ) (resid  80 and name   HN )  4.0  2.2  2.5 ! A.293  at 1.26e+07
assign (resid  79 and name   HA ) (resid  81 and name   HN )  4.0  2.2  2.0 ! A.650  at 3.60e+07

! Q80
assign (resid  80 and name  HB# ) (resid  80 and name   HN )  2.5  0.7  0.9 ! A.292  at 2.51e+08
assign (resid  80 and name  HG# ) (resid  80 and name   HN )  4.0  2.2  1.0 ! A.289  at -1.23e+08
assign (resid  80 and name   HN ) (resid  81 and name  HB# )  4.0  2.2  2.5 ! A.290  at 2.67e+07
assign (resid  80 and name  HB# ) (resid  81 and name   HN )  4.0  2.2  1.5 ! A.654  at 5.54e+07
assign (resid  80 and name   HA ) (resid  81 and name   HN )  4.0  2.2  1.0 ! A.649  at 7.23e+07
assign (resid  80 and name  HG# ) (resid  81 and name   HN )  4.0  2.2  2.5 ! A.651  at -4.44e+07
assign (resid  80 and name   HA ) (resid  82 and name   HN )  4.0  2.2  2.5 ! A.656  at 8.92e+07 (wd)

! A81
assign (resid  81 and name  HB# ) (resid  81 and name   HN )  2.5  0.7  0.9 ! A.653  at 3.26e+08
assign (resid  81 and name  HB# ) (resid  82 and name   HN )  3.0  1.2  1.0 ! A.663  at 1.34e+08
assign (resid  81 and name   HA ) (resid  82 and name   HN )  3.0  1.2  0.5 ! A.658  at -1.38e+08
assign (resid  81 and name   HN ) (resid  82 and name  HB# )  4.0  2.2  2.5 ! A.652  at -1.86e+07

! D82
assign (resid  82 and name  HB# ) (resid  82 and name   HN )  2.5  0.7  0.9 ! A.664  at -2.95e+08
assign (resid  82 and name   HN ) (resid  85 and name  HG# )  4.0  2.2  2.5 ! A.662  at 3.11e+07
assign (resid  82 and name   HN ) (resid  85 and name  HD# )  4.0  2.2  1.5 ! A.661  at -5.66e+07

! P83
assign (resid  83 and name  HB# ) (resid  84 and name   HN )  4.0  2.2  1.5 ! A.670  at 7.06e+07
assign (resid  83 and name   HA ) (resid  84 and name   HN )  3.0  1.2  1.0 ! A.1331 at 3.47e+08
assign (resid  83 and name  HG# ) (resid  84 and name   HN )  4.0  2.2  1.5 ! A.668  at 7.86e+07

! H84
assign (resid  84 and name  HD2 ) (resid  84 and name   HN )  4.0  2.2  2.0 ! A.1332 at -1.92e+07
assign (resid  84 and name  HB# ) (resid  84 and name   HN )  3.0  1.2  1.0 ! A.671  at 1.40e+08
assign (resid  84 and name   HN ) (resid  85 and name  HD# )  3.0  1.2  1.0 ! A.672  at -1.27e+08

! P85

! P86
assign (resid  86 and name  HB# ) (resid  87 and name   HN )  4.0  2.2  1.5 ! A.677  at 4.73e+07
assign (resid  86 and name   HA ) (resid  87 and name   HN )  3.0  1.2  1.0 ! A.675  at 3.96e+08

! L87
assign (resid  87 and name HD* ) (resid  87 and name   HN )  3.0  1.2  1.0 ! A.680  at 9.42e+07
assign (resid  87 and name   HG ) (resid  87 and name   HN )  4.0  2.2  1.5 ! A.678  at 1.38e+08
assign (resid  87 and name  HB# ) (resid  87 and name   HN )  4.0  2.2  1.5 ! A.681  at -7.36e+07
assign (resid  87 and name HD* ) (resid  88 and name   HN )  4.0  2.2  1.5 ! A.1083 at 1.12e+08 (wd,ov)
assign (resid  87 and name   HA ) (resid  88 and name   HN )  2.5  0.7  0.4 ! A.1071 at 3.48e+08
assign (resid  87 and name   HG ) (resid  88 and name   HN )  4.0  2.2  2.0 ! A.1075 at 2.37e+07
assign (resid  87 and name  HB# ) (resid  88 and name   HN )  3.0  1.2  1.0 ! A.1080 at -8.14e+07
assign (resid  87 and name   HA ) (resid 105 and name   HN )  4.0  2.2  2.0 ! A.1363 at 2.18e+07
! assign (resid  87 and name HD* ) (resid 124 and name   HN )  4.0  2.2  2.5 ! A.942  at 9.76e+07 (wd)(Queen 041706)

! V88
assign (resid  88 and name HG* ) (resid  88 and name   HN )  3.0  1.2  1.0 ! A.1076 at 8.60e+07
assign (resid  88 and name   HB ) (resid  88 and name   HN )  2.5  0.7  0.9 ! A.1072 at -1.89e+08
assign (resid  88 and name HG* ) (resid  89 and name   HN )   4.0  2.2  1.0 ! A.688  at 1.50e+08 (wd)
assign (resid  88 and name   HA ) (resid  89 and name   HN )  2.5  0.7  0.4 ! A.683  at 4.15e+08
assign (resid  88 and name   HB ) (resid  89 and name   HN )  4.0  2.2  2.0 ! A.685  at -2.32e+07
assign (resid  88 and name   HN ) (resid 104 and name   HA )  4.0  2.2  2.0 ! A.1070 at -4.26e+07
assign (resid  88 and name   HN ) (resid 105 and name  HB# )  4.0  2.2  2.5 ! A.1074 at 1.76e+07
! assign (resid  88 and name HG* ) (resid 105 and name   HN )  4.0  2.2  2.5 ! A.1365 at 2.19e+07
assign (resid  88 and name HG* ) (resid 105 and name   HN )  4.0  2.2  2.5 ! A.808  at 4.14e+07
assign (resid  88 and name   HB ) (resid 105 and name   HN )  4.0  2.2  2.5 ! A.806  at -5.35e+07

! L89
assign (resid  89 and name   HG ) (resid  89 and name   HN )  4.0  2.2  2.0 ! A.692  at 3.62e+07
! assign (resid  89 and name HD* ) (resid  89 and name   HN )  4.0  2.2  1.5 ! A.689  at 9.62e+07
assign (resid  89 and name HD* ) (resid  89 and name   HN )  4.0  2.2  2.5 ! A.694  at 3.27e+07
assign (resid  89 and name  HB# ) (resid  89 and name   HN )  3.0  1.2  1.0 ! A.690  at -1.11e+08
assign (resid  89 and name   HA ) (resid  90 and name   HN )  2.5  0.7  0.4 ! A.697  at 3.27e+08
assign (resid  89 and name  HB# ) (resid  90 and name   HN )  3.0  1.2  1.0 ! A.702  at -8.27e+07
assign (resid  89 and name   HG ) (resid  90 and name   HN )  4.0  2.2  2.0 ! A.1336 at 4.36e+07
assign (resid  89 and name   HA ) (resid 105 and name   HN )  4.0  2.2  1.0 ! A.1064 at 4.79e+07
assign (resid  89 and name   HG ) (resid 105 and name   HN )  4.0  2.2  2.5 ! A.1362 at 1.95e+07 (wd)
assign (resid  89 and name   HG ) (resid 106 and name   HN )  4.0  2.2  2.5 ! A.820  at 1.22e+08 (wd,ov)
assign (resid  89 and name   HA ) (resid 106 and name   HN )  3.0  1.2  1.0 ! A.812  at 1.69e+08 (wd)
assign (resid  89 and name HD* ) (resid 106 and name   HN )  4.0  2.2  1.5 ! A.818  at 5.92e+07

! F90
assign (resid  90 and name  HB# ) (resid  90 and name   HN )  4.0  2.2  2.5 ! A.698  at -4.45e+07
assign (resid  90 and name  HD# ) (resid  90 and name   HN )  4.0  2.2  2.0 ! A.1338 at -2.89e+07
assign (resid  90 and name   HA ) (resid  91 and name   HN )  2.5  0.7  0.4 ! A.364  at 3.15e+08
! assign (resid  90 and name  HD# ) (resid  91 and name   HN )  4.0  2.2  2.0 ! A.1162 at -4.29e+07
assign (resid  90 and name  HB# ) (resid  91 and name   HN )  4.0  2.2  1.5 ! A.359  at -4.84e+07
assign (resid  90 and name  HE# ) (resid 104 and name   HN )  4.0  2.2  2.0 ! A.311  at -2.76e+07
assign (resid  90 and name   HN ) (resid 104 and name  HB# )  4.0  2.2  1.5 ! A.700  at 7.91e+07
assign (resid  90 and name   HN ) (resid 107 and name   HA )  3.0  1.2  0.5 ! A.696  at 1.10e+08
assign (resid  90 and name   HN ) (resid 107 and name HG2# )  4.0  2.2  1.5 ! A.699  at 5.21e+07
assign (resid  90 and name   HN ) (resid 107 and name HG1# )  4.0  2.2  2.5 ! A.703  at 2.99e+07
assign (resid  90 and name   HN ) (resid 107 and name HD1# )  4.0  2.2  2.5 ! A.705  at 3.62e+07
assign (resid  90 and name  HB# ) (resid 108 and name   HN )  4.0  2.2  2.5 ! A.1369 at -1.54e+07

! L91
assign (resid  91 and name HD* ) (resid  91 and name   HN )  4.0  2.2  1.5 ! A.368  at 6.77e+07
assign (resid  91 and name   HG ) (resid  91 and name   HN )  3.0  1.2  0.5 ! A.369  at 1.02e+08
! assign (resid  91 and name HD* ) (resid  91 and name   HN )  4.0  2.2  1.5 ! A.367  at 6.12e+07
assign (resid  91 and name  HB# ) (resid  91 and name   HN )  4.0  2.2  1.5 ! A.365  at -7.00e+07
assign (resid  91 and name HD* ) (resid  92 and name   HN )  4.0  2.2  1.0 ! A.712  at 1.01e+08 (wd)
assign (resid  91 and name   HG ) (resid  92 and name   HN )  4.0  2.2  2.0 ! A.1340 at 1.69e+07
assign (resid  91 and name   HA ) (resid  92 and name   HN )  2.5  0.7  0.4 ! A.714  at -4.15e+08
assign (resid  91 and name  HB# ) (resid  92 and name   HN )  4.0  2.2  2.5 ! A.711  at -3.91e+07
assign (resid  91 and name   HA ) (resid 108 and name   HN )  4.0  2.2  1.0 ! A.832  at -8.00e+07
! Queen 041706
! assign (resid  91 and name   HA ) (resid 110 and name   HN )  4.0  2.2  2.0 ! A.1375 at -1.43e+07

! G92
assign (resid  92 and name  HA# ) (resid  93 and name   HN )  2.5  0.7  0.9 ! A.717  at -2.66e+08
assign (resid  92 and name   HN ) (resid 109 and name  HB# )  4.0  2.2  2.5 ! A.710  at 2.72e+07
assign (resid  92 and name   HN ) (resid 109 and name   HA )  3.0  1.2  0.5 ! A.706  at 1.14e+08

! E93
assign (resid  93 and name  HB# ) (resid  93 and name   HN )  2.5  0.7  0.9 ! A.722  at 2.32e+08
assign (resid  93 and name  HG# ) (resid  93 and name   HN )  2.5  0.7  0.9 ! A.716  at -2.77e+08

! P94

! P95
assign (resid  95 and name   HA ) (resid  96 and name   HN )  2.5  0.7  0.9 ! A.724  at 4.57e+08
assign (resid  95 and name  HB# ) (resid  96 and name   HN )  3.0  1.2  1.0 ! A.727  at 1.03e+08
assign (resid  95 and name  HD# ) (resid  96 and name   HN )  4.0  2.2  2.5 ! A.1165 at -1.04e+07
assign (resid  95 and name  HB# ) (resid  97 and name   HN )  4.0  2.2  2.0 ! A.491  at 1.34e+08 (wd)
assign (resid  95 and name  HB# ) (resid 100 and name   HN )  4.0  2.2  2.5 ! A.763  at 2.84e+07
assign (resid  95 and name  HB# ) (resid 101 and name   HN )  4.0  2.2  1.5 ! A.770  at 5.96e+07
assign (resid  95 and name  HG# ) (resid 101 and name   HN )  4.0  2.2  2.5 ! A.1354 at 2.32e+07

! V96
assign (resid  96 and name   HB ) (resid  96 and name   HN )  2.5  0.7  0.9 ! A.728  at 1.88e+08 (wd)
assign (resid  96 and name HG* ) (resid  96 and name   HN )  3.0  1.2  1.0 ! A.726  at 3.75e+08 (ov,wd)
assign (resid  96 and name HG* ) (resid  97 and name   HN )  3.0  1.2  1.0 ! A.731  at 2.09e+08 (ov,wd)
assign (resid  96 and name   HB ) (resid  97 and name   HN )  3.0  1.2  1.0 ! A.733  at 1.41e+08
assign (resid  96 and name   HA ) (resid  97 and name   HN )  3.0  1.2  1.0 ! A.1347 at 2.21e+08 (wd)
assign (resid  96 and name   HN ) (resid  97 and name  HB# )  4.0  2.2  2.5 ! A.725  at -3.16e+07

! D97
assign (resid  97 and name  HB# ) (resid  97 and name   HN )  2.5  0.7  0.9 ! A.730  at -3.90e+08
assign (resid  97 and name   HN ) (resid  98 and name  HD# )  4.0  2.2  1.5 ! A.734  at -5.30e+07
assign (resid  97 and name  HB# ) (resid  99 and name   HN )  4.0  2.2  2.5 ! A.740  at -3.31e+07
assign (resid  97 and name   HA ) (resid  99 and name   HN )  4.0  2.2  1.0 ! A.750  at -4.91e+07
assign (resid  97 and name   HN ) (resid 100 and name   HG )  4.0  2.2  2.0 ! A.732  at 4.35e+07
assign (resid  97 and name  HB# ) (resid 100 and name   HN )  4.0  2.2  1.5 ! A.756  at -6.41e+07
assign (resid  97 and name   HA ) (resid 100 and name   HN )  4.0  2.2  2.0 ! A.1352 at -2.11e+07

! P98
assign (resid  98 and name  HB# ) (resid  99 and name   HN )  3.0  1.2  1.0 ! A.747  at 9.80e+07
assign (resid  98 and name   HA ) (resid  99 and name   HN )  3.0  1.2  0.8        ! A.739  at 8.30e+07
assign (resid  98 and name  HG# ) (resid  99 and name   HN )  2.5  0.7  0.9 ! A.746  at 1.81e+08
assign (resid  98 and name  HD# ) (resid  99 and name   HN )  3.0  1.2  1.0 ! A.749  at -1.09e+08
assign (resid  98 and name   HA ) (resid 100 and name   HN )  4.0  2.2  2.0 ! A.754  at 4.02e+07
assign (resid  98 and name   HA ) (resid 101 and name   HN )  3.0  1.2  0.8 ! A.768  at 1.50e+08 (wd)
assign (resid  98 and name   HA ) (resid 102 and name   HN )  4.0  2.2  1.0 ! A.782  at 7.90e+07

! L99
assign (resid  99 and name   HG ) (resid  99 and name   HN )  4.0  2.2  1.0 ! A.745  at 1.78e+08 (wd)
assign (resid  99 and name  HB# ) (resid  99 and name   HN )  2.5  0.7  0.9 ! A.743  at -2.12e+08
assign (resid  99 and name HD* ) (resid 100 and name   HN )  4.0  2.2  2.5 ! A.418  at 3.53e+07
assign (resid  99 and name   HA ) (resid 100 and name   HN )  4.0  2.2  1.0 ! A.753  at 7.33e+07
assign (resid  99 and name  HB# ) (resid 100 and name   HN )  4.0  2.2  1.5 ! A.758  at -6.72e+07
assign (resid  99 and name   HA ) (resid 101 and name   HN )  4.0  2.2  2.0 ! A.777  at 2.60e+07
assign (resid  99 and name   HA ) (resid 102 and name   HN )  3.0  1.2  0.5 ! A.779  at 9.21e+07

! L100
! assign (resid 100 and name HD* ) (resid 100 and name   HN )  3.0  1.2  1.0 ! A.760  at 9.65e+07
assign (resid 100 and name   HG ) (resid 100 and name   HN )  4.0  2.2  2.0 ! A.762  at 1.65e+08 (wd,ov)
assign (resid 100 and name HD* ) (resid 100 and name   HN )  4.0  2.2  2.0 ! A.761  at 9.24e+07 (wd,ov)
assign (resid 100 and name  HB# ) (resid 100 and name   HN )  4.0  2.2  1.5 ! A.757  at -7.75e+07
assign (resid 100 and name   HN ) (resid 101 and name   HB )  4.0  2.2  2.0 ! A.755  at 3.16e+07
assign (resid 100 and name   HN ) (resid 101 and name   HA )  4.0  2.2  2.0 ! A.1350 at 1.69e+07
assign (resid 100 and name   HG ) (resid 101 and name   HN )  4.0  2.2  1.0 ! A.769  at 5.09e+07
assign (resid 100 and name HD* ) (resid 101 and name   HN )  4.0  2.2  2.5 ! A.772  at 3.50e+07
assign (resid 100 and name   HA ) (resid 101 and name   HN )  3.0  1.2  1.0 ! A.776  at 8.50e+07
assign (resid 100 and name  HB# ) (resid 101 and name   HN )  3.0  1.2  1.0 ! A.774  at -9.06e+07
assign (resid 100 and name   HA ) (resid 102 and name   HN )  4.0  2.2  2.0 ! A.780  at 2.93e+07
assign (resid 100 and name   HA ) (resid 103 and name   HN )  3.0  1.2  0.5 ! A.789  at 8.93e+07
assign (resid 100 and name   HA ) (resid 104 and name   HN )  4.0  2.2  2.0 ! A.1068 at 2.01e+07

! T101
assign (resid 101 and name HG2# ) (resid 101 and name   HN )  4.0  2.2  1.0 ! A.771  at 1.94e+08 (wd)
assign (resid 101 and name   HB ) (resid 101 and name   HN )  2.5  0.7  0.4 ! A.766  at 2.37e+08
assign (resid 101 and name   HA ) (resid 102 and name   HN )  4.0  2.2  1.0 ! A.783  at 7.22e+07
assign (resid 101 and name HG2# ) (resid 102 and name   HN )  4.0  2.2  1.0 ! A.1067 at 1.10e+08
assign (resid 101 and name   HB ) (resid 102 and name   HN )  2.5  0.7  0.4 ! A.784  at 2.19e+08
assign (resid 101 and name   HB ) (resid 103 and name   HN )  4.0  2.2  2.0 ! A.793  at 1.96e+07
assign (resid 101 and name   HA ) (resid 103 and name   HN )  4.0  2.2  2.0 ! A.792  at 3.60e+07

! A102
assign (resid 102 and name  HB# ) (resid 102 and name   HN )  2.5  0.7  0.9 ! A.786  at 8.83e+08
assign (resid 102 and name  HB# ) (resid 103 and name   HN )  3.0  1.2  1.0 ! A.794  at 2.29e+08

! Q103
assign (resid 103 and name  HB# ) (resid 103 and name   HN )  2.5  0.7  0.9 ! A.798  at 2.01e+08
assign (resid 103 and name  HG# ) (resid 103 and name   HN )  4.0  2.2  1.0 ! A.788  at -1.83e+08 (wd)
assign (resid 103 and name  HG# ) (resid 103 and name HE21 )  3.0  1.2  0.8 ! A.1021 at -1.40e+08
assign (resid 103 and name  HG# ) (resid 103 and name HE22 )  4.0  2.2  1.5 ! A.1028 at -6.40e+07
assign (resid 103 and name  HB# ) (resid 104 and name   HN )  4.0  2.2  1.5 ! A.312  at 6.88e+07
assign (resid 103 and name  HG# ) (resid 104 and name   HN )  4.0  2.2  1.5 ! A.307  at -6.48e+07
assign (resid 103 and name   HN ) (resid 104 and name  HB# )  4.0  2.2  1.5 ! A.795  at 7.41e+07
assign (resid 103 and name   HN ) (resid 104 and name   HA )  4.0  2.2  2.0 ! A.800  at -2.15e+07

! A104
assign (resid 104 and name  HB# ) (resid 104 and name   HN )  2.5  0.7  0.9 ! A.316  at 6.28e+08
assign (resid 104 and name  HB# ) (resid 105 and name   HN )  2.5  0.7  0.9 ! A.807  at 1.94e+08
assign (resid 104 and name   HA ) (resid 105 and name   HN )  2.5  0.7  0.4 ! A.803  at -4.22e+08
assign (resid 104 and name  HB# ) (resid 106 and name   HN )  3.0  1.2  1.0 ! A.816  at 2.96e+08
assign (resid 104 and name   HA ) (resid 106 and name   HN )  4.0  2.2  2.0  ! A.1065 at -1.38e+08 (wd,ov)

! S105
assign (resid 105 and name  HB# ) (resid 105 and name   HN )  3.0  1.2  1.0 ! A.802  at 9.97e+07
assign (resid 105 and name  HB# ) (resid 106 and name   HN )  3.0  1.2  1.0 ! A.814  at 9.45e+07
assign (resid 105 and name   HA ) (resid 106 and name   HN )  3.0  1.2  0.5 ! A.813  at 8.27e+07

! A106
assign (resid 106 and name  HB# ) (resid 106 and name   HN )  3.0  1.2  1.0 ! A.817  at 2.55e+08
assign (resid 106 and name  HB# ) (resid 107 and name   HN )  3.0  1.2  1.0 ! A.827  at 5.38e+08 (wd,ov)
assign (resid 106 and name   HA ) (resid 107 and name   HN )  2.5  0.7  0.4 ! A.751  at -7.91e+08
assign (resid 106 and name   HN ) (resid 107 and name HD1# )  4.0  2.2  2.5 ! A.1086 at 2.87e+07

! I107
assign (resid 107 and name HG2# ) (resid 107 and name   HN )  4.0  2.2  1.0 ! A.826  at 9.90e+07
assign (resid 107 and name HG1# ) (resid 107 and name   HN )  4.0  2.2  1.5 ! A.829  at 4.91e+07
assign (resid 107 and name HD1# ) (resid 107 and name   HN )  4.0  2.2  1.5 ! A.825  at 1.02e+08 (wd,ov)
assign (resid 107 and name   HB ) (resid 107 and name   HN )  2.5  0.7  0.4 ! A.824  at -2.47e+08
assign (resid 107 and name HG2# ) (resid 108 and name   HN )  3.0  1.2  1.0 ! A.834  at 1.73e+08
assign (resid 107 and name HG1# ) (resid 108 and name   HN )  4.0  2.2  2.5 ! A.1370 at 2.72e+07
assign (resid 107 and name   HA ) (resid 108 and name   HN )  2.5  0.7  0.4 ! A.831  at 3.24e+08
assign (resid 107 and name HD1# ) (resid 108 and name   HN )  4.0  2.2  2.5 ! A.833  at 3.31e+07
assign (resid 107 and name   HB ) (resid 108 and name   HN )  4.0  2.2  2.0 ! A.1368 at -2.41e+07
assign (resid 107 and name   HN ) (resid 108 and name HD* )  4.0  2.2  1.0 ! A.744  at 1.13e+08

! L108
assign (resid 108 and name HD* ) (resid 108 and name   HN )  4.0  2.2  1.0 ! A.839  at 8.89e+07
assign (resid 108 and name   HG ) (resid 108 and name   HN )  3.0  1.2  1.0 ! A.837  at 9.00e+07(wd)
! assign (resid 108 and name HD* ) (resid 108 and name   HN )  4.0  2.2  1.0 ! A.836  at 1.14e+08(wd,ov)
assign (resid 108 and name  HB# ) (resid 108 and name   HN )  3.0  1.2  1.0 ! A.835  at -1.45e+08
assign (resid 108 and name   HG ) (resid 109 and name   HN )  4.0  2.2  1.5 ! A.1372 at 6.17e+07
assign (resid 108 and name HD* ) (resid 109 and name   HN )  4.0  2.2  2.5 ! A.1373 at 8.52e+07(wd,ov)
! assign (resid 108 and name HD* ) (resid 109 and name   HN )  4.0  2.2  2.0 ! A.479  at 1.47e+08(wd,ov)
assign (resid 108 and name   HA ) (resid 109 and name   HN )  2.5  0.7  0.4 ! A.1371 at 4.99e+08
assign (resid 108 and name  HB# ) (resid 109 and name   HN )  3.0  1.2  1.0 ! A.477  at -1.43e+08

! S109
assign (resid 109 and name  HB# ) (resid 109 and name   HN )  2.5  0.7  0.9 ! A.474  at 4.47e+08
assign (resid 109 and name   HA ) (resid 110 and name   HN )  3.0  1.2  1.0 ! A.840  at 4.61e+08(wd,ov)

! K110
assign (resid 110 and name  HG# ) (resid 110 and name   HN )  4.0  2.2  1.5 ! A.843  at 7.35e+07
assign (resid 110 and name  HB# ) (resid 110 and name   HN )  3.0  1.2  1.0 ! A.845  at -1.14e+08
assign (resid 110 and name   HN ) (resid 111 and name   HA )  4.0  2.2  2.0 ! A.1377 at 2.90e+07
assign (resid 110 and name  HG# ) (resid 112 and name   HN )  4.0  2.2  2.5 ! A.858  at 3.41e+07

! P111
assign (resid 111 and name   HA ) (resid 112 and name   HN )  2.5  0.7  0.4 ! A.849  at 2.63e+08
assign (resid 111 and name  HB# ) (resid 112 and name   HN )  4.0  2.2  1.5 ! A.853  at -6.07e+07

! L112
assign (resid 112 and name HD* ) (resid 112 and name   HN )  4.0  2.2  1.5 ! A.857  at 5.39e+07
assign (resid 112 and name  HB# ) (resid 112 and name   HN )  3.0  1.2  1.0 ! A.856  at -1.42e+08
assign (resid 112 and name   HN ) (resid 113 and name  HB# )  4.0  2.2  2.5 ! A.1378 at -1.70e+07
assign (resid 112 and name  HB# ) (resid 113 and name   HN )  3.0  1.2  1.0 ! A.863  at -8.21e+07
assign (resid 112 and name HD* ) (resid 113 and name   HN )  3.0  1.2  1.0 ! A.864  at 1.07e+08
assign (resid 112 and name   HA ) (resid 113 and name   HN )  3.0  1.2  1.0 ! A.861  at 7.06e+08(wd)
! (Queen 041706)
! assign (resid 112 and name   HN ) (resid 117 and name   HG )  4.0  2.2  1.5 ! A.860  at 8.46e+07

! D113
assign (resid 113 and name  HB# ) (resid 113 and name   HN )  2.5  0.7  0.9 ! A.867  at -1.59e+08
assign (resid 113 and name   HN ) (resid 114 and name  HD# )  4.0  2.2  2.5 ! A.868  at -3.03e+07
assign (resid 113 and name   HN ) (resid 114 and name   HA )  4.0  2.2  2.0 ! A.1384 at 1.45e+07
assign (resid 113 and name   HA ) (resid 115 and name   HN )  4.0  2.2  2.0 ! A.871  at -4.34e+07
assign (resid 113 and name   HA ) (resid 116 and name   HN )  4.0  2.2  2.0 ! A.885  at -2.14e+07
assign (resid 113 and name  HB# ) (resid 116 and name   HN )  4.0  2.2  1.5 ! A.1400 at -5.34e+07

! P114
assign (resid 114 and name  HB# ) (resid 115 and name   HN )  4.0  2.2  1.5 ! A.878  at 1.51e+08(wd,ov)
assign (resid 114 and name   HA ) (resid 115 and name   HN )  4.0  2.2  1.0 ! A.870  at 6.59e+07
assign (resid 114 and name  HD# ) (resid 115 and name   HN )  3.0  1.2  1.0 ! A.872  at -1.24e+08
assign (resid 114 and name   HA ) (resid 116 and name   HN )  4.0  2.2  2.0 ! A.884  at 3.32e+07
assign (resid 114 and name   HA ) (resid 117 and name   HN )  3.0  1.2  0.5 ! A.896  at 8.25e+07
assign (resid 114 and name  HB# ) (resid 118 and name   HN )  4.0  2.2  2.5 ! A.1414 at 1.29e+07
assign (resid 114 and name   HA ) (resid 118 and name   HN )  4.0  2.2  2.0 ! A.1412 at 3.44e+07

! Q115
assign (resid 115 and name  HB# ) (resid 115 and name   HN )  2.5  0.7  0.9 ! A.877  at 5.48e+08
assign (resid 115 and name  HG# ) (resid 115 and name   HN )  2.5  0.7  0.9 ! A.875  at -2.16e+08
assign (resid 115 and name  HG# ) (resid 115 and name HE21 )  2.5  0.7  0.7 ! A.1042 at -1.92e+08
assign (resid 115 and name  HB# ) (resid 116 and name   HN )  2.5  0.7  0.9 ! A.892  at 2.74e+08
assign (resid 115 and name   HA ) (resid 116 and name   HN )  3.0  1.2  0.5 ! A.881  at 9.15e+07
assign (resid 115 and name  HG# ) (resid 116 and name   HN )  4.0  2.2  1.0 ! A.883  at -8.79e+07
assign (resid 115 and name   HN ) (resid 116 and name  HB# )  4.0  2.2  2.5 ! A.876  at -2.75e+07
assign (resid 115 and name  HB# ) (resid 117 and name   HN )  4.0  2.2  2.5 ! A.1109 at 2.40e+07
assign (resid 115 and name   HN ) (resid 118 and name  HB# )  4.0  2.2  2.5 ! A.1396 at -2.64e+07
assign (resid 115 and name   HA ) (resid 119 and name   HN )  4.0  2.2  2.0 ! A.922  at 3.22e+07

! L116
assign (resid 116 and name HD* ) (resid 116 and name   HN )  4.0  2.2  1.0 ! A.890  at 9.21e+07
assign (resid 116 and name   HG ) (resid 116 and name   HN )  4.0  2.2  1.0 ! A.891  at 6.70e+07
assign (resid 116 and name  HB# ) (resid 116 and name   HN )  2.5  0.7  0.9 ! A.886  at -2.27e+08
assign (resid 116 and name   HA ) (resid 117 and name   HN )  4.0  2.2  2.0 ! A.895  at 4.45e+07
assign (resid 116 and name  HB# ) (resid 117 and name   HN )  3.0  1.2  1.0 ! A.904  at -1.17e+08
assign (resid 116 and name   HN ) (resid 119 and name   HB )  4.0  2.2  2.0 ! A.1399 at 1.41e+07
assign (resid 116 and name   HA ) (resid 119 and name   HN )  4.0  2.2  1.0 ! A.921  at 7.53e+07
assign (resid 116 and name   HA ) (resid 120 and name   HN )  4.0  2.2  1.0 ! A.617  at 5.31e+07
assign (resid 116 and name   HG ) (resid 120 and name   HN )  4.0  2.2  2.0 ! A.930  at 3.46e+07

! L117
assign (resid 117 and name   HG ) (resid 117 and name   HN )  4.0  2.2  1.0 ! A.934  at 9.46e+07(wd)
assign (resid 117 and name HD* ) (resid 117 and name   HN )  4.0  2.2  1.5 ! A.905  at 7.34e+07
assign (resid 117 and name  HB# ) (resid 117 and name   HN )  3.0  1.2  1.0 ! A.902  at -1.34e+08
assign (resid 117 and name  HB# ) (resid 118 and name   HN )  4.0  2.2  2.5 ! A.913  at -4.09e+07
assign (resid 117 and name   HA ) (resid 120 and name   HN )  4.0  2.2  1.0 ! A.927  at 7.43e+07

! L118
assign (resid 118 and name HD* ) (resid 118 and name   HN )  4.0  2.2  1.5 ! A.912  at 6.56e+07
assign (resid 118 and name   HG ) (resid 118 and name   HN )  4.0  2.2  1.5 ! A.908  at 8.85e+07
assign (resid 118 and name  HB# ) (resid 118 and name   HN )  2.5  0.7  0.9 ! A.911  at -1.53e+08
assign (resid 118 and name   HN ) (resid 119 and name   HB )  4.0  2.2  2.0 ! A.502  at 2.11e+07
assign (resid 118 and name  HB# ) (resid 119 and name   HN )  4.0  2.2  1.5 ! A.919  at -7.54e+07
assign (resid 118 and name   HA ) (resid 119 and name   HN )  4.0  2.2  1.0 ! A.924  at 6.90e+07
assign (resid 118 and name   HG ) (resid 119 and name   HN )  4.0  2.2  1.0 ! A.923  at 5.12e+07
assign (resid 118 and name HD* ) (resid 122 and name   HN )  4.0  2.2  2.5 ! A.1423 at 2.75e+07

! T119
assign (resid 119 and name HG2# ) (resid 119 and name   HN )  4.0  2.2  1.0 ! A.918  at 2.08e+08(wd)
assign (resid 119 and name   HB ) (resid 119 and name   HN )  2.5  0.7  0.4 ! A.917  at 2.27e+08
assign (resid 119 and name HG2# ) (resid 120 and name   HN )  4.0  2.2  1.5 ! A.928  at 7.88e+07
assign (resid 119 and name   HA ) (resid 122 and name   HN )  4.0  2.2  1.0 ! A.348  at 6.61e+07

! T120
assign (resid 120 and name HG2# ) (resid 120 and name   HN )  4.0  2.2  1.0 ! A.618  at 1.09e+08
assign (resid 120 and name   HB ) (resid 120 and name   HN )  2.5  0.7  0.4 ! A.925  at 2.67e+08
assign (resid 120 and name HG2# ) (resid 121 and name   HN )  4.0  2.2  1.5 ! A.937  at 7.13e+07
assign (resid 120 and name   HB ) (resid 121 and name   HN )  3.0  1.2  0.5 ! A.932  at 9.56e+07
assign (resid 120 and name   HA ) (resid 121 and name   HN )  4.0  2.2  2.0 ! A.933  at 3.36e+07
assign (resid 120 and name   HB ) (resid 122 and name   HN )  4.0  2.2  2.0 ! A.349  at 2.43e+07
! assign (resid 120 and name HG2# ) (resid 124 and name   HN )  4.0  2.2  2.5 ! A.1066 at 1.98e+07 (Queen 042806) 

! L121
assign (resid 121 and name HD* ) (resid 121 and name   HN )  4.0  2.2  2.5 ! A.1092 at 9.39e+06
! assign (resid 121 and name HD* ) (resid 121 and name   HN )  4.0  2.2  1.5 ! A.936  at 5.31e+07
assign (resid 121 and name  HB# ) (resid 121 and name   HN )  2.5  0.7  0.9 ! A.938  at -1.49e+08
assign (resid 121 and name   HN ) (resid 122 and name  HG# )  4.0  2.2  2.5 ! A.1407 at -1.27e+07
assign (resid 121 and name   HA ) (resid 122 and name   HN )  4.0  2.2  1.0 ! A.344  at 7.72e+07
assign (resid 121 and name   HG ) (resid 122 and name   HN )  4.0  2.2  2.0 ! A.350  at 3.01e+07
assign (resid 121 and name  HB# ) (resid 122 and name   HN )  4.0  2.2  1.5 ! A.346  at -7.71e+07
assign (resid 121 and name   HA ) (resid 123 and name   HN )  4.0  2.2  2.0 ! A.1426 at -3.77e+07
assign (resid 121 and name   HA ) (resid 124 and name   HN )  4.0  2.2  1.0 ! A.941  at 7.49e+07

! Q122
assign (resid 122 and name  HB# ) (resid 122 and name   HN )  3.0  1.2  1.0 ! A.351  at 1.29e+08
assign (resid 122 and name  HG# ) (resid 122 and name   HN )  3.0  1.2  1.0 ! A.342  at -1.02e+08
assign (resid 122 and name  HG# ) (resid 123 and name   HN )  4.0  2.2  2.5 ! A.1190 at 2.13e+07
assign (resid 122 and name   HA ) (resid 123 and name   HN )  4.0  2.2  1.0 ! A.939  at -5.95e+07
assign (resid 122 and name  HB# ) (resid 123 and name   HN )  4.0  2.2  1.5 ! A.433  at -4.67e+07
assign (resid 122 and name   HA ) (resid 124 and name   HN )  4.0  2.2  2.0 ! A.1429 at 2.54e+07
 assign (resid 122 and name   HA ) (resid 125 and name   HN )  4.0  2.2  1.0 ! A.952  at 5.44e+07

! G123
assign (resid 123 and name  HA# ) (resid 124 and name   HN )  4.0  2.2  1.5 ! A.948  at -4.91e+07

! L124
assign (resid 124 and name   HG ) (resid 124 and name   HN )  4.0  2.2  1.5 ! A.946  at 1.09e+08
assign (resid 124 and name  HB# ) (resid 124 and name   HN )  3.0  1.2  1.0 ! A.943  at -9.07e+07
 assign (resid 124 and name   HN ) (resid 125 and name   HA )  4.0  2.2  2.5 ! A.940  at 2.33e+07
assign (resid 124 and name   HN ) (resid 125 and name  HB# )  4.0  2.2  2.5 ! A.1430 at 2.10e+07
assign (resid 124 and name HD* ) (resid 125 and name   HN )  4.0  2.2  2.5 ! A.953  at 5.37e+07
assign (resid 124 and name   HA ) (resid 125 and name   HN )  3.0  1.2  0.5 ! A.951  at 1.00e+08
assign (resid 124 and name  HB# ) (resid 125 and name   HN )  4.0  2.2  1.5 ! A.955  at -7.25e+07

! C125
 assign (resid 125 and name  HB# ) (resid 125 and name   HN )  2.5  0.7  0.9 ! A.956  at 1.98e+08
  assign (resid 125 and name   HN ) (resid 126 and name   HA )  4.0  2.2  2.0 ! A.1145 at 1.03e+07
  assign (resid 125 and name   HN ) (resid 126 and name  HD# )  4.0  2.2  1.5 ! A.957  at -7.97e+07

! H12
! Queen 041706
! assign (resid  12 and name   HN ) (resid  57 and name   HN )  4.0  2.2  2.0 ! A.221  at 3.36e+06

! I13
assign (resid  13 and name   HN ) (resid  14 and name   HN )  4.0  2.2  1.0 ! A.25   at 4.91e+06
! assign (resid  13 and name   HN ) (resid  37 and name HG* )  4.0  2.2  2.0 ! A.24   at 1.13e+07
assign (resid  13 and name   HN ) (resid  38 and name   HN )  4.0  2.2  1.0 ! A.201  at 6.19e+06

! L14
assign (resid  14 and name   HG ) (resid  14 and name   HN )  4.0  2.2  1.0 ! A.209  at 8.22e+06
assign (resid  14 and name   HN ) (resid  57 and name   HN )  4.0  2.2  1.0 ! A.257  at 6.79e+06
assign (resid  14 and name   HN ) (resid  58 and name   HA )  3.0  1.2  0.5 ! A.207  at 2.45e+07
assign (resid  14 and name   HN ) (resid  59 and name   HN )  4.0  2.2  1.0 ! A.229  at 9.26e+06

! L15

! L16
assign (resid  16 and name   HN ) (resid  60 and name   HA )  2.5  0.7  0.4 ! A.212  at 9.33e+07
assign (resid  16 and name   HN ) (resid  61 and name   HN )  4.0  2.2  1.0 ! A.213  at 9.39e+06

! E17

! E18

! E19

! D20

! E21

! A22
assign (resid  22 and name   HA ) (resid  26 and name   HN )  4.0  2.2  1.0 ! A.165  at 1.23e+07

! A23
assign (resid  23 and name   HN ) (resid  24 and name   HN )  3.0  1.2  0.5 ! A.147  at 2.34e+07
assign (resid  23 and name   HN ) (resid  25 and name   HN )  4.0  2.2  1.0 ! A.394  at 8.80e+06

! T24
assign (resid  24 and name   HN ) (resid  25 and name   HN )  4.0  2.2  1.0 ! A.148  at 1.71e+07

! V25
assign (resid  25 and name   HN ) (resid  26 and name   HN )  3.0  1.2  0.5 ! A.52   at 3.14e+07

! V26
assign (resid  26 and name   HN ) (resid  27 and name   HN )  3.0  1.2  0.5 ! A.51   at 2.59e+07

! C27

! E28
assign (resid  28 and name   HN ) (resid  29 and name   HN )  3.0  1.2  0.5 ! A.175  at 2.57e+07

! M29
assign (resid  29 and name  HB# ) (resid  29 and name   HN )  3.0  1.2  1.0 ! A.187  at 6.96e+07
assign (resid  29 and name   HN ) (resid  30 and name   HN )  4.0  2.2  1.0 ! A.190  at 1.73e+07

! L30
assign (resid  30 and name   HN ) (resid  31 and name   HN )  3.0  1.2  0.5 ! A.189  at 2.06e+07

! T31

! A32

! A33
assign (resid  33 and name   HN ) (resid  34 and name   HN )  3.0  1.2  0.5 ! A.273  at 6.48e+07
assign (resid  33 and name   HN ) (resid  35 and name   HN )  4.0  2.2  1.0 ! A.274  at 7.96e+06

! G34
! assign (resid  34 and name   HN ) (resid  35 and name   HN )  3.0  1.2  0.5 ! A.279  at 6.58e+07

! F35

! K36

! V37
assign (resid  37 and name   HN ) (resid  38 and name   HN )  4.0  2.2  1.0 ! A.484  at 5.66e+06

! I38
assign (resid  38 and name   HN ) (resid  39 and name   HN )  4.0  2.2  1.0 ! A.286  at 1.18e+07

! W39

! L40
assign (resid  40 and name   HN ) (resid  41 and name   HN )  4.0  2.2  1.0 ! A.266  at 6.54e+06

! V41
assign (resid  41 and name   HN ) (resid  42 and name   HN )  3.0  1.2  1.0 ! A.289  at 7.79e+07(wd)

! D42

! G43
assign (resid  43 and name   HN ) (resid  44 and name   HN )  4.0  2.2  1.0 ! A.290  at 1.32e+07

! S44
assign (resid  44 and name   HN ) (resid  45 and name   HN )  3.0  1.2  0.5 ! A.291  at 3.39e+07
assign (resid  44 and name   HN ) (resid  46 and name   HN )  4.0  2.2  1.0 ! A.297  at 1.09e+07

! T45
assign (resid  45 and name   HN ) (resid  46 and name   HN )  3.0  1.2  0.5 ! A.292  at 4.63e+07

! A46
assign (resid  46 and name   HN ) (resid  47 and name   HN )  3.0  1.2  0.5 ! A.301  at 4.59e+07

! L47
assign (resid  47 and name   HN ) (resid  48 and name   HN )  3.0  1.2  0.5 ! A.300  at 5.91e+07

! D48

! Q49
assign (resid  49 and name   HA ) (resid  50 and name   HN )  3.0  1.2  0.5 ! A.457  at 2.22e+07
assign (resid  49 and name   HN ) (resid  51 and name   HN )  4.0  2.2  1.0 ! A.302  at 1.12e+07

! L50
assign (resid  50 and name   HN ) (resid  51 and name   HN )  3.0  1.2  0.5 ! A.303  at 2.93e+07

! D51
assign (resid  51 and name   HA ) (resid  52 and name   HN )  3.0  1.2  0.5 ! A.53   at 2.17e+07

! L52
assign (resid  52 and name   HN ) (resid  53 and name   HN )  2.5  0.7  0.4 ! A.309  at 7.21e+07
assign (resid  52 and name   HA ) (resid  53 and name   HN )  4.0  2.2  1.0 ! A.459  at 1.78e+07

! L53
assign (resid  53 and name   HN ) (resid  54 and name   HN )  3.0  1.2  0.5 ! A.310  at 4.86e+07

! Q54

! P55
assign (resid  55 and name   HA ) (resid  57 and name   HN )  4.0  2.2  1.5 ! A.510  at 1.78e+07(wd)

! I56
assign (resid  56 and name   HN ) (resid  57 and name   HN )  3.0  1.2  0.5 ! A.253  at 3.66e+07

! V57

! I58
assign (resid  58 and name   HN ) (resid  89 and name   HN )  4.0  2.2  1.0 ! A.222  at 1.47e+07

! L59
assign (resid  59 and name   HN ) (resid  60 and name   HN )  4.0  2.2  1.0 ! A.230  at 7.63e+06

! M60
assign (resid  60 and name   HN ) (resid  91 and name   HN )  4.0  2.2  1.0 ! A.369  at 1.32e+07

! A61

! W62
assign (resid  62 and name   HN ) (resid  91 and name   HN )  4.0  2.2  1.0 ! A.26   at 2.48e+07
assign (resid  62 and name   HN ) (resid  93 and name   HN )  4.0  2.2  1.0 ! A.27   at 7.42e+06

! P63

! P64

! P65

! D66

! Q67
assign (resid  67 and name   HN ) (resid  68 and name   HN )  4.0  2.2  1.0 ! A.317  at 1.10e+07

! S68
assign (resid  68 and name   HN ) (resid  69 and name   HN )  3.0  1.2  0.5 ! A.316  at 2.13e+07

! C69
assign (resid  69 and name   HN ) (resid  70 and name   HN )  3.0  1.2  0.5 ! A.324  at 5.44e+07

! L70
assign (resid  70 and name   HN ) (resid  71 and name   HN )  3.0  1.2  0.5 ! A.322  at 5.93e+07
assign (resid  70 and name   HN ) (resid  72 and name   HN )  4.0  2.2  1.0 ! A.323  at 1.44e+07

! L71
assign (resid  71 and name   HN ) (resid  72 and name   HN )  2.5  0.7  0.4 ! A.325  at 7.18e+07
assign (resid  71 and name   HN ) (resid  74 and name   HN )  4.0  2.2  1.0 ! A.347  at 6.71e+06

! L72
! assign (resid  72 and name   HG ) (resid  72 and name   HN )  3.0  1.2  0.5 ! A.5    at 4.81e+07
assign (resid  72 and name   HN ) (resid  73 and name   HN )  3.0  1.2  0.5 ! A.330  at 3.14e+07

! L73
assign (resid  73 and name   HN ) (resid  74 and name   HN )  3.0  1.2  0.5 ! A.329  at 3.38e+07
assign (resid  73 and name   HN ) (resid  75 and name   HN )  4.0  2.2  1.0 ! A.331  at 8.78e+06

! Q74
assign (resid  74 and name   HN ) (resid  75 and name   HN )  3.0  1.2  0.5 ! A.348  at 3.79e+07
assign (resid  74 and name   HN ) (resid  76 and name   HN )  4.0  2.2  1.0 ! A.343  at 1.81e+07

! H75
assign (resid  75 and name   HN ) (resid  76 and name   HN )  3.0  1.2  0.5 ! A.481  at 3.67e+07
assign (resid  75 and name   HN ) (resid  77 and name   HN )  4.0  2.2  1.0 ! A.512  at 8.47e+06

! L76
assign (resid  76 and name   HN ) (resid  77 and name   HN )  3.0  1.2  0.5 ! A.357  at 3.21e+07

! R77
assign (resid  77 and name   HN ) (resid  78 and name   HN )  3.0  1.2  0.5 ! A.355  at 4.57e+07

! E78
assign (resid  78 and name   HN ) (resid  79 and name   HN )  3.0  1.2  0.5 ! A.334  at 5.93e+07

! H79
assign (resid  79 and name   HN ) (resid  80 and name   HN )  3.0  1.2  0.5 ! A.332  at 3.14e+07

! Q80

! A81
! assign (resid  81 and name   HN ) (resid  82 and name   HN )  3.0  1.2  1.0 ! A.359  at 6.08e+07(wd)

! D82

! P83
! assign (resid  83 and name   HA ) (resid  84 and name   HN )  2.5  0.7  0.4 ! A.542  at 8.30e+07

! H84

! P85

! P86

! L87
assign (resid  87 and name   HN ) (resid  88 and name   HN )  4.0  2.2  1.0 ! A.495  at 5.08e+06

! V88
assign (resid  88 and name   HN ) (resid 106 and name   HN )  4.0  2.2  1.0 ! A.399  at 8.36e+06

! L89
assign (resid  89 and name   HN ) (resid  90 and name   HN )  4.0  2.2  1.0 ! A.364  at 1.11e+07

! F90
assign (resid  90 and name   HN ) (resid  91 and name   HN )  4.0  2.2  1.0 ! A.363  at 9.04e+06
assign (resid  90 and name   HN ) (resid 108 and name   HN )  4.0  2.2  1.0 ! A.365  at 1.00e+07

! V96
assign (resid  96 and name   HN ) (resid  97 and name   HN )  3.0  1.2  1.0 ! A.335  at 6.88e+07(wd)

! D97

! P98

! L99
assign (resid  99 and name   HN ) (resid 100 and name   HN )  2.5  0.7  0.4 ! A.338  at 8.09e+07
assign (resid  99 and name   HN ) (resid 101 and name   HN )  4.0  2.2  1.0 ! A.387  at 1.83e+07

! L100
assign (resid 100 and name   HN ) (resid 101 and name   HN )  2.5  0.7  0.4 ! A.389  at 9.97e+07

! T101
assign (resid 101 and name   HN ) (resid 102 and name   HN )  3.0  1.2  0.5 ! A.388  at 6.58e+07
assign (resid 101 and name   HN ) (resid 103 and name   HN )  3.0  1.2  1.0 ! A.390  at 1.96e+07(wd)

! A102
assign (resid 102 and name   HN ) (resid 103 and name   HN )  3.0  1.2  0.5 ! A.392  at 5.63e+07

! Q103

! A104

! S105
assign (resid 105 and name   HN ) (resid 106 and name   HN )  3.0  1.2  0.5 ! A.397  at 6.63e+07

! A106
assign (resid 106 and name   HN ) (resid 107 and name   HN )  4.0  2.2  1.0 ! A.398  at 1.25e+07

! I107
assign (resid 107 and name   HN ) (resid 108 and name   HN )  4.0  2.2  1.0 ! A.402  at 8.39e+06

! L108
assign (resid 108 and name   HN ) (resid 109 and name   HN )  4.0  2.2  1.0 ! A.403  at 8.70e+06

assign (resid 115 and name   HN ) (resid 116 and name   HN )  2.5  0.7  0.4 ! A.409  at 8.19e+07
assign (resid 115 and name   HN ) (resid 117 and name   HN )  4.0  2.2  1.0 ! A.410  at 1.56e+07

! L116
assign (resid 116 and name   HN ) (resid 117 and name   HN )  3.0  1.2  0.5 ! A.381  at 5.68e+07

! L117
assign (resid 117 and name   HN ) (resid 118 and name   HN )  3.0  1.2  0.5 ! A.421  at 2.83e+07

! L118
assign (resid 118 and name   HN ) (resid 119 and name   HN )  3.0  1.2  0.5 ! A.424  at 2.65e+07

! T119
assign (resid 119 and name   HN ) (resid 120 and name   HN )  3.0  1.2  0.5 ! A.422  at 4.02e+07
assign (resid 119 and name   HN ) (resid 121 and name   HN )  4.0  2.2  1.0 ! A.423  at 7.68e+06

! T120
assign (resid 120 and name   HN ) (resid 121 and name   HN )  3.0  1.2  0.5 ! A.427  at 3.05e+07

! L121
assign (resid 121 and name   HN ) (resid 122 and name   HN )  3.0  1.2  0.5 ! A.340  at 2.97e+07

! Q122
assign (resid 122 and name   HN ) (resid 123 and name   HN )  3.0  1.2  0.5 ! A.339  at 2.76e+07

! G123
assign (resid 123 and name   HN ) (resid 124 and name   HN )  3.0  1.2  0.5 ! A.428  at 4.20e+07

! L124
 assign (resid 124 and name   HN ) (resid 125 and name   HN )  4.0  2.2  2.5 ! A.430  at 5.52e+07

! C125