*HEADER    TRANSPORT PROTEIN                       28-OCT-04   1WAZ
*TITLE     NMR STRUCTURE DETERMINATION OF THE BACTERIAL MERCURY
*TITLE    2 TRANSPORTER, MERF, IN MICELLES
*COMPND    MOL_ID: 1;
*COMPND   2 MOLECULE: MERF;
*COMPND   3 CHAIN: A;
*COMPND   4 FRAGMENT: HELIX-LOOP-HELIX CORE, RESIDUES 24-69;
*COMPND   5 ENGINEERED: YES
*SOURCE    MOL_ID: 1;
*SOURCE   2 EXPRESSION_SYSTEM: ESCHERICHIA COLI;
*SOURCE   3 EXPRESSION_SYSTEM_STRAIN: B;
*SOURCE   4 EXPRESSION_SYSTEM_PLASMID: PET31B/MERF;
*SOURCE   5 EXPRESSION_SYSTEM_CELL_LINE: C43(DE3);
*SOURCE   6 ORGANISM_SCIENTIFIC: MORGANELLA MORGANII
*KEYWDS    NMR, PROTEIN STRUCTURE, RESIDUAL DIPOLAR COUPLING,
*KEYWDS   2 POLYTOPIC MEMBRANE PROTEIN, TRANSPORT PROTEIN,
*KEYWDS   3 ANTIBIOTIC RESISTANCE, MERCURY DETOXIFICATION
*EXPDTA    NMR, 15 STRUCTURES
*AUTHOR    S.C.HOWELL,M.F.MESLEH,S.J.OPELLA




Residual Dipolar Couplings:
6% SAG
500mM SDS at 60C
Residue		MerFt	 MerFm
14 G		  0.58	 -4.51
15 T		 -0.16	   -
16 T		 -1.24	   -
17 L		  1.66	   -
18 V		  2.58	   -
19 A		  1.40	   -
20 L		  0.54	   -
21 S		  1.06	   -
22 S		  1.48	   -
23 F		  0.90	   -
24 T		-10.73	   -
26 V		 -8.74	   -
27 L		-16.54	   -
28 V		-16.75	   -
29 I		-13.05	   -
30 L		-15.00	-11.71
31 L		-18.69	   -
32 G		-16.12	-12.82
33 V		-12.88	 -9.33
34 V		-15.83	 -9.50
35 G		-18.40	-15.47
36 L		-14.18	-10.18
37 S		-12.10	 -8.16
38 A		-16.74	-10.53
39 L		-16.24	   -
40 T		 -6.37	 -5.35
41 G		 -4.09	 -2.42
42 Y		 -4.90	 -4.20
43 L		   -	  0.49
44 D		-12.04	   -
45 Y		  5.78	  5.81
46 V		 -2.24	  0.86
47 L		  1.08	 -5.34
48 L		 -0.32	  -
50 A		-12.46	   -
51 L		-13.36	 -7.99
52 A		 -9.19	 -4.53
53 I		 -9.67	   -
54 F		   -	-10.36
55 I		-11.57	 -7.51
56 G		 -9.59	 -4.17
57 L		-11.90	 -5.27
58 T		-13.51	 -1.21
59 I		 -9.78	 -2.84
60 Y		 -9.63	 -3.78
61 A		-13.90	 -8.57
62 I		-13.92	 -8.16
63 Q		  -	 -2.40
64 R		-10.81	 -5.46
65 K		-14.79	 -8.40
66 R		-12.41	 -7.09
67 Q		 -5.15	 -0.29
68 A		 -7.12	   -
69 D		 -3.35	   -
70 A		 -1.79	   -
71 S		  -	   -
72 S		 -0.97	   -



Chemical Shift Tables:




MerFt 500mM SDS at 60C






Residue         HN      N       Ca
14 G            8.213   109.52  44.50
15 T            7.654   112.14  61.68
16 T            7.892   116.72  62.40
17 L            7.872   121.60  55.24
18 V            7.571   116.27  62.45
19 A            7.765   124.06  51.62
20 L            7.791   118.55  54.40
21 S            7.986   113.72  58.33
22 S            7.807   116.10  55.67
23 F            7.995   118.10  56.61
24 T            7.899   115.57  64.71
26 V            7.267   113.60  64.42
27 L            7.553   118.66  56.26
28 V            7.737   116.42  65.26
29 I            7.666   118.48  63.43
30 L            8.095   119.09  56.79
31 L            8.244   117.81  56.39
32 G            8.433   106.32  45.51
33 V            8.511   121.05  65.20
34 V            8.345   121.43  65.27
35 G            8.893   107.62  45.89
36 L            8.710   121.13  56.26
37 S            8.388   117.07  60.94
38 A            8.244   125.56  52.87
39 L            8.062   117.57  55.53
40 T            7.661   105.02  60.70
41 G            7.628   108.01  44.24
42 Y            8.221   119.66  57.03
43 L            7.728   121.49  54.90
44 D            8.249   116.53  53.94
45 Y            7.596   116.91  57.32
46 V            7.462   114.00  61.28
47 L            7.724   120.30  56.65
48 L            8.240   116.28  57.88
50 A            7.811   116.94  53.75
51 L            8.322   117.48  56.22
52 A            8.218   120.30  53.86
53 I            7.995   116.57  63.39
54 F            8.414   119.78  60.10
55 I            8.823   121.00  63.55
56 G            8.594   107.36  46.21
57 L            8.728   120.51  56.20
58 T            7.864   117.06  66.62
59 I            8.250   120.64  64.03
60 Y            8.314   120.25  60.10
61 A            8.623   121.29  53.68
62 I            8.324   118.23  63.55
63 Q            8.414   119.72  57.22
64 R            8.195   118.97  56.66
65 K            7.948   120.60  56.73
66 R            8.162   118.45  56.65
67 Q            7.811   118.10  55.13
68 A            7.706   123.91  51.63
69 D            8.024   119.08  52.81
70 A            7.839   124.13  50.78
71 S            8.021   115.04  56.74
72 S            7.711   127.84  51.49




  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1    H    THR  24           H        THR  24 -18.729  -4.383   4.793
    2    HA   THR  24           HA       THR  24 -16.889  -5.656   5.837
    3    HB   THR  24           HB       THR  24 -15.915  -6.833   3.618
    4    HG1  THR  24          1HG       THR  24 -18.245  -6.201   2.440
    5   1HG2  THR  24          3HG2      THR  24 -18.751  -6.951   4.669
    6   2HG2  THR  24          2HG2      THR  24 -18.077  -8.131   3.545
    7   3HG2  THR  24          1HG2      THR  24 -17.389  -7.958   5.160
    8    MG   THR  24           QG2      THR  24 -18.072  -7.680   4.458
    9    HA   PRO  25           HA       PRO  25 -13.460  -2.687   5.179
   10   1HB   PRO  25          2HB       PRO  25 -12.478  -2.980   7.731
   11   2HB   PRO  25          1HB       PRO  25 -13.766  -1.836   7.300
   12   1HG   PRO  25          2HG       PRO  25 -13.970  -4.531   8.549
   13   2HG   PRO  25          1HG       PRO  25 -14.880  -3.054   8.899
   14   1HD   PRO  25          2HD       PRO  25 -15.907  -5.090   7.441
   15   2HD   PRO  25          1HD       PRO  25 -16.354  -3.392   7.166
   16    QB   PRO  25           QB       PRO  25 -13.122  -2.408   7.515
   17    QG   PRO  25           QG       PRO  25 -14.425  -3.792   8.724
   18    QD   PRO  25           QD       PRO  25 -16.130  -4.241   7.303
   19    H    VAL  26           H        VAL  26 -13.667  -6.004   6.315
   20    HA   VAL  26           HA       VAL  26 -10.809  -6.597   6.379
   21    HB   VAL  26           HB       VAL  26 -13.294  -8.239   5.805
   22   1HG1  VAL  26          2HG1      VAL  26 -10.453  -8.939   5.761
   23   2HG1  VAL  26          1HG1      VAL  26 -11.367  -9.904   6.920
   24   3HG1  VAL  26          3HG1      VAL  26 -11.846  -9.878   5.223
   25   1HG2  VAL  26          1HG2      VAL  26 -11.988  -7.159   8.206
   26   2HG2  VAL  26          3HG2      VAL  26 -13.630  -7.770   8.001
   27   3HG2  VAL  26          2HG2      VAL  26 -12.302  -8.891   8.303
   28    MG1  VAL  26           QG1      VAL  26 -11.222  -9.573   5.968
   29    MG2  VAL  26           QG2      VAL  26 -12.640  -7.940   8.170
   30    QG   VAL  26           QQG      VAL  26 -11.931  -8.756   7.069
   31    H    LEU  27           H        LEU  27 -13.233  -6.528   3.759
   32    HA   LEU  27           HA       LEU  27 -11.693  -7.906   1.739
   33   1HB   LEU  27          2HB       LEU  27 -14.127  -6.828   1.923
   34   2HB   LEU  27          1HB       LEU  27 -13.337  -5.487   1.092
   35    HG   LEU  27           HG       LEU  27 -14.278  -6.988  -0.573
   36   1HD1  LEU  27          2HD1      LEU  27 -11.931  -5.968  -0.849
   37   2HD1  LEU  27          1HD1      LEU  27 -11.315  -7.580  -0.486
   38   3HD1  LEU  27          3HD1      LEU  27 -12.335  -7.324  -1.902
   39   1HD2  LEU  27          2HD2      LEU  27 -13.438  -8.980   1.311
   40   2HD2  LEU  27          1HD2      LEU  27 -14.421  -9.194  -0.137
   41   3HD2  LEU  27          3HD2      LEU  27 -12.664  -9.318  -0.237
   42    MD1  LEU  27           QD1      LEU  27 -11.860  -6.957  -1.079
   43    MD2  LEU  27           QD2      LEU  27 -13.507  -9.164   0.312
   44    QB   LEU  27           QB       LEU  27 -13.732  -6.157   1.507
   45    QD   LEU  27           QQD      LEU  27 -12.684  -8.060  -0.384
   46    H    VAL  28           H        VAL  28 -11.621  -4.514   2.856
   47    HA   VAL  28           HA       VAL  28  -9.954  -3.443   0.752
   48    HB   VAL  28           HB       VAL  28 -10.261  -2.847   3.707
   49   1HG1  VAL  28          3HG1      VAL  28  -8.406  -1.753   1.759
   50   2HG1  VAL  28          2HG1      VAL  28  -9.514  -0.511   2.342
   51   3HG1  VAL  28          1HG1      VAL  28  -8.528  -1.423   3.486
   52   1HG2  VAL  28          1HG2      VAL  28 -11.663  -2.088   1.183
   53   2HG2  VAL  28          3HG2      VAL  28 -12.324  -2.363   2.794
   54   3HG2  VAL  28          2HG2      VAL  28 -11.504  -0.845   2.425
   55    MG1  VAL  28           QG1      VAL  28  -8.816  -1.229   2.529
   56    MG2  VAL  28           QG2      VAL  28 -11.830  -1.765   2.134
   57    QG   VAL  28           QQG      VAL  28 -10.323  -1.497   2.331
   58    H    ILE  29           H        ILE  29  -9.074  -5.028   3.863
   59    HA   ILE  29           HA       ILE  29  -6.195  -4.671   3.539
   60    HB   ILE  29           HB       ILE  29  -7.871  -6.774   4.947
   61   1HG1  ILE  29          2HG1      ILE  29  -6.608  -4.230   6.010
   62   2HG1  ILE  29          1HG1      ILE  29  -8.305  -4.369   5.549
   63   1HG2  ILE  29          1HG2      ILE  29  -4.944  -6.131   4.948
   64   2HG2  ILE  29          3HG2      ILE  29  -5.696  -6.657   6.454
   65   3HG2  ILE  29          2HG2      ILE  29  -5.744  -7.701   5.032
   66   1HD1  ILE  29          1HD1      ILE  29  -7.977  -6.557   7.184
   67   2HD1  ILE  29          3HD1      ILE  29  -6.929  -5.364   7.952
   68   3HD1  ILE  29          2HD1      ILE  29  -8.638  -5.006   7.701
   69    MG   ILE  29           QG2      ILE  29  -5.461  -6.829   5.478
   70    MD   ILE  29           QD1      ILE  29  -7.848  -5.642   7.612
   71    QG   ILE  29           QG1      ILE  29  -7.456  -4.299   5.779
   72    H    LEU  30           H        LEU  30  -8.472  -7.220   2.479
   73    HA   LEU  30           HA       LEU  30  -6.474  -9.135   1.607
   74   1HB   LEU  30          2HB       LEU  30  -9.254  -8.455   0.596
   75   2HB   LEU  30          1HB       LEU  30  -8.395  -9.952   0.231
   76    HG   LEU  30           HG       LEU  30  -9.180  -8.973   2.991
   77   1HD1  LEU  30          2HD1      LEU  30 -10.705 -10.278   1.070
   78   2HD1  LEU  30          1HD1      LEU  30 -10.110 -11.595   2.081
   79   3HD1  LEU  30          3HD1      LEU  30 -11.023 -10.272   2.805
   80   1HD2  LEU  30          1HD2      LEU  30  -7.411 -11.173   1.991
   81   2HD2  LEU  30          3HD2      LEU  30  -7.243 -10.170   3.432
   82   3HD2  LEU  30          2HD2      LEU  30  -8.412 -11.490   3.408
   83    MD1  LEU  30           QD1      LEU  30 -10.612 -10.715   1.985
   84    MD2  LEU  30           QD2      LEU  30  -7.688 -10.944   2.943
   85    QB   LEU  30           QB       LEU  30  -8.824  -9.203   0.413
   86    QD   LEU  30           QQD      LEU  30  -9.150 -10.829   2.464
   87    H    LEU  31           H        LEU  31  -8.096  -6.439  -0.143
   88    HA   LEU  31           HA       LEU  31  -6.837  -6.960  -2.712
   89   1HB   LEU  31          2HB       LEU  31  -8.793  -5.498  -2.234
   90   2HB   LEU  31          1HB       LEU  31  -7.719  -4.358  -1.420
   91    HG   LEU  31           HG       LEU  31  -6.386  -4.255  -3.587
   92   1HD1  LEU  31          1HD1      LEU  31  -8.827  -5.783  -4.516
   93   2HD1  LEU  31          3HD1      LEU  31  -7.790  -4.881  -5.620
   94   3HD1  LEU  31          2HD1      LEU  31  -7.133  -6.237  -4.703
   95   1HD2  LEU  31          1HD2      LEU  31  -7.985  -2.492  -2.872
   96   2HD2  LEU  31          3HD2      LEU  31  -7.954  -2.673  -4.625
   97   3HD2  LEU  31          2HD2      LEU  31  -9.284  -3.358  -3.691
   98    MD1  LEU  31           QD1      LEU  31  -7.916  -5.633  -4.947
   99    MD2  LEU  31           QD2      LEU  31  -8.407  -2.841  -3.730
  100    QB   LEU  31           QB       LEU  31  -8.256  -4.928  -1.827
  101    QD   LEU  31           QQD      LEU  31  -8.162  -4.237  -4.338
  102    H    GLY  32           H        GLY  32  -5.847  -4.892   0.064
  103   1HA   GLY  32          1HA       GLY  32  -3.725  -3.904   0.472
  104   2HA   GLY  32          2HA       GLY  32  -3.476  -3.840  -1.274
  105    QA   GLY  32           QA       GLY  32  -3.600  -3.872  -0.401
  106    H    VAL  33           H        VAL  33  -4.080  -6.748   0.705
  107    HA   VAL  33           HA       VAL  33  -1.338  -7.576   1.053
  108    HB   VAL  33           HB       VAL  33  -3.950  -9.068   0.664
  109   1HG1  VAL  33          1HG1      VAL  33  -1.214 -10.061   0.889
  110   2HG1  VAL  33          3HG1      VAL  33  -2.239 -10.649   2.198
  111   3HG1  VAL  33          2HG1      VAL  33  -2.697 -10.942   0.521
  112   1HG2  VAL  33          2HG2      VAL  33  -3.032  -7.426   2.719
  113   2HG2  VAL  33          1HG2      VAL  33  -4.325  -8.618   2.850
  114   3HG2  VAL  33          3HG2      VAL  33  -2.675  -9.054   3.297
  115    MG1  VAL  33           QG1      VAL  33  -2.050 -10.550   1.202
  116    MG2  VAL  33           QG2      VAL  33  -3.344  -8.366   2.955
  117    QG   VAL  33           QQG      VAL  33  -2.697  -9.458   2.079
  118    H    VAL  34           H        VAL  34  -3.661  -8.295  -1.600
  119    HA   VAL  34           HA       VAL  34  -1.902  -9.988  -3.145
  120    HB   VAL  34           HB       VAL  34  -4.093  -8.033  -3.899
  121   1HG1  VAL  34          1HG1      VAL  34  -2.758 -10.244  -5.483
  122   2HG1  VAL  34          3HG1      VAL  34  -4.308  -9.530  -5.930
  123   3HG1  VAL  34          2HG1      VAL  34  -2.853  -8.534  -5.905
  124   1HG2  VAL  34          2HG2      VAL  34  -3.973 -10.877  -2.964
  125   2HG2  VAL  34          1HG2      VAL  34  -5.125  -9.610  -2.542
  126   3HG2  VAL  34          3HG2      VAL  34  -5.239 -10.422  -4.104
  127    MG1  VAL  34           QG1      VAL  34  -3.306  -9.436  -5.773
  128    MG2  VAL  34           QG2      VAL  34  -4.779 -10.303  -3.204
  129    QG   VAL  34           QQG      VAL  34  -4.042  -9.869  -4.488
  130    H    GLY  35           H        GLY  35  -2.314  -6.412  -3.151
  131   1HA   GLY  35          1HA       GLY  35  -0.874  -4.778  -4.097
  132   2HA   GLY  35          2HA       GLY  35  -0.579  -5.919  -5.410
  133    QA   GLY  35           QA       GLY  35  -0.726  -5.348  -4.754
  134    H    LEU  36           H        LEU  36   0.158  -6.320  -1.922
  135    HA   LEU  36           HA       LEU  36   2.963  -5.632  -2.074
  136   1HB   LEU  36          2HB       LEU  36   1.575  -6.001  -0.040
  137   2HB   LEU  36          1HB       LEU  36   1.546  -7.728  -0.396
  138    HG   LEU  36           HG       LEU  36   4.091  -7.652  -0.358
  139   1HD1  LEU  36          1HD1      LEU  36   3.432  -4.844   0.133
  140   2HD1  LEU  36          3HD1      LEU  36   4.521  -5.505   1.352
  141   3HD1  LEU  36          2HD1      LEU  36   4.966  -5.566  -0.353
  142   1HD2  LEU  36          1HD2      LEU  36   2.235  -7.982   1.672
  143   2HD2  LEU  36          3HD2      LEU  36   3.953  -8.361   1.794
  144   3HD2  LEU  36          2HD2      LEU  36   3.353  -6.800   2.354
  145    MD1  LEU  36           QD1      LEU  36   4.307  -5.305   0.377
  146    MD2  LEU  36           QD2      LEU  36   3.181  -7.714   1.940
  147    QB   LEU  36           QB       LEU  36   1.561  -6.864  -0.218
  148    QD   LEU  36           QQD      LEU  36   3.744  -6.509   1.158
  149    H    SER  37           H        SER  37   1.256  -8.716  -2.723
  150    HA   SER  37           HA       SER  37   3.574 -10.409  -2.969
  151   1HB   SER  37          2HB       SER  37   1.086 -10.944  -2.960
  152   2HB   SER  37          1HB       SER  37   1.055 -10.462  -4.653
  153    HG   SER  37           HG       SER  37   2.199 -12.193  -5.181
  154    QB   SER  37           QB       SER  37   1.071 -10.703  -3.807
  155    H    ALA  38           H        ALA  38   1.869  -8.503  -5.527
  156    HA   ALA  38           HA       ALA  38   3.580  -9.202  -7.719
  157   1HB   ALA  38          3HB       ALA  38   1.476  -7.859  -7.747
  158   2HB   ALA  38          1HB       ALA  38   2.777  -7.075  -8.644
  159   3HB   ALA  38          2HB       ALA  38   2.357  -6.512  -7.027
  160    MB   ALA  38           QB       ALA  38   2.204  -7.148  -7.806
  161    H    LEU  39           H        LEU  39   4.100  -6.882  -5.060
  162    HA   LEU  39           HA       LEU  39   6.807  -6.214  -6.290
  163   1HB   LEU  39          2HB       LEU  39   5.170  -4.402  -5.800
  164   2HB   LEU  39          1HB       LEU  39   5.181  -4.880  -4.102
  165    HG   LEU  39           HG       LEU  39   7.712  -4.539  -4.167
  166   1HD1  LEU  39          1HD1      LEU  39   6.900  -3.308  -6.809
  167   2HD1  LEU  39          3HD1      LEU  39   8.394  -2.874  -5.979
  168   3HD1  LEU  39          2HD1      LEU  39   8.137  -4.532  -6.520
  169   1HD2  LEU  39          3HD2      LEU  39   5.652  -2.825  -3.586
  170   2HD2  LEU  39          2HD2      LEU  39   7.355  -2.455  -3.315
  171   3HD2  LEU  39          1HD2      LEU  39   6.553  -1.890  -4.780
  172    MD1  LEU  39           QD1      LEU  39   7.811  -3.571  -6.436
  173    MD2  LEU  39           QD2      LEU  39   6.520  -2.390  -3.894
  174    QB   LEU  39           QB       LEU  39   5.176  -4.641  -4.951
  175    QD   LEU  39           QQD      LEU  39   7.166  -2.980  -5.165
  176    H    THR  40           H        THR  40   8.301  -7.708  -5.540
  177    HA   THR  40           HA       THR  40   8.495  -7.921  -2.513
  178    HB   THR  40           HB       THR  40   7.157  -9.810  -3.458
  179    HG1  THR  40          1HG       THR  40   9.021 -11.411  -2.793
  180   1HG2  THR  40          1HG2      THR  40   8.406  -9.741  -5.675
  181   2HG2  THR  40          3HG2      THR  40   9.712 -10.605  -4.864
  182   3HG2  THR  40          2HG2      THR  40   8.120 -11.350  -5.011
  183    MG   THR  40           QG2      THR  40   8.746 -10.565  -5.184
  184    H    GLY  41           H        GLY  41  10.094  -6.383  -4.444
  185   1HA   GLY  41          1HA       GLY  41  12.355  -7.193  -5.582
  186   2HA   GLY  41          2HA       GLY  41  12.710  -7.857  -3.986
  187    QA   GLY  41           QA       GLY  41  12.533  -7.525  -4.784
  188    H    TYR  42           H        TYR  42  14.467  -6.523  -3.470
  189    HA   TYR  42           HA       TYR  42  13.799  -3.881  -2.398
  190   1HB   TYR  42          2HB       TYR  42  16.106  -3.874  -1.814
  191   2HB   TYR  42          1HB       TYR  42  15.656  -5.580  -1.818
  192    HD1  TYR  42          1HD       TYR  42  17.530  -2.940  -3.559
  193    HD2  TYR  42          2HD       TYR  42  16.358  -7.072  -3.638
  194    HE1  TYR  42          1HE       TYR  42  19.247  -3.394  -5.291
  195    HE2  TYR  42          2HE       TYR  42  18.074  -7.526  -5.369
  196    HH   TYR  42           HH       TYR  42  20.354  -5.017  -6.399
  197    QB   TYR  42           QB       TYR  42  15.881  -4.727  -1.816
  198    QD   TYR  42           QD       TYR  42  16.944  -5.006  -3.599
  199    QE   TYR  42           QE       TYR  42  18.661  -5.460  -5.330
  200    QR   TYR  42           QR       TYR  42  17.803  -5.233  -4.465
  201    H    LEU  43           H        LEU  43  15.216  -1.892  -3.069
  202    HA   LEU  43           HA       LEU  43  15.998  -1.665  -5.895
  203   1HB   LEU  43          2HB       LEU  43  13.531  -1.982  -6.103
  204   2HB   LEU  43          1HB       LEU  43  13.287  -0.555  -5.095
  205    HG   LEU  43           HG       LEU  43  14.687   0.732  -6.789
  206   1HD1  LEU  43          1HD1      LEU  43  14.519  -1.960  -8.074
  207   2HD1  LEU  43          3HD1      LEU  43  14.401  -0.547  -9.122
  208   3HD1  LEU  43          2HD1      LEU  43  15.828  -0.778  -8.112
  209   1HD2  LEU  43          1HD2      LEU  43  11.948  -0.085  -6.837
  210   2HD2  LEU  43          3HD2      LEU  43  12.647   1.407  -7.465
  211   3HD2  LEU  43          2HD2      LEU  43  12.519  -0.013  -8.504
  212    MD1  LEU  43           QD1      LEU  43  14.916  -1.095  -8.436
  213    MD2  LEU  43           QD2      LEU  43  12.372   0.437  -7.602
  214    QB   LEU  43           QB       LEU  43  13.409  -1.268  -5.599
  215    QD   LEU  43           QQD      LEU  43  13.644  -0.329  -8.019
  216    H    ASP  44           H        ASP  44  17.405   0.053  -5.954
  217    HA   ASP  44           HA       ASP  44  17.702   1.808  -3.629
  218   1HB   ASP  44          2HB       ASP  44  18.645   1.925  -6.510
  219   2HB   ASP  44          1HB       ASP  44  19.250   2.989  -5.239
  220    QB   ASP  44           QB       ASP  44  18.948   2.457  -5.875
  221    H    TYR  45           H        TYR  45  17.861   4.362  -4.223
  222    HA   TYR  45           HA       TYR  45  15.032   5.047  -5.108
  223   1HB   TYR  45          2HB       TYR  45  17.142   6.571  -3.544
  224   2HB   TYR  45          1HB       TYR  45  15.478   7.097  -3.798
  225    HD1  TYR  45          1HD       TYR  45  17.692   4.954  -1.875
  226    HD2  TYR  45          2HD       TYR  45  13.584   5.724  -2.865
  227    HE1  TYR  45          1HE       TYR  45  16.970   3.620   0.087
  228    HE2  TYR  45          2HE       TYR  45  12.861   4.390  -0.903
  229    HH   TYR  45           HH       TYR  45  13.508   3.195   0.845
  230    QB   TYR  45           QB       TYR  45  16.310   6.834  -3.671
  231    QD   TYR  45           QD       TYR  45  15.638   5.339  -2.370
  232    QE   TYR  45           QE       TYR  45  14.916   4.005  -0.408
  233    QR   TYR  45           QR       TYR  45  15.277   4.672  -1.389
  234    H    VAL  46           H        VAL  46  14.723   6.043  -7.055
  235    HA   VAL  46           HA       VAL  46  17.203   7.078  -8.465
  236    HB   VAL  46           HB       VAL  46  14.479   6.949  -9.691
  237   1HG1  VAL  46          3HG1      VAL  46  17.141   7.207 -10.564
  238   2HG1  VAL  46          2HG1      VAL  46  16.655   5.577 -11.031
  239   3HG1  VAL  46          1HG1      VAL  46  15.717   6.968 -11.575
  240   1HG2  VAL  46          2HG2      VAL  46  16.021   4.616  -8.590
  241   2HG2  VAL  46          1HG2      VAL  46  14.280   4.895  -8.594
  242   3HG2  VAL  46          3HG2      VAL  46  15.100   4.419 -10.081
  243    MG1  VAL  46           QG1      VAL  46  16.505   6.584 -11.057
  244    MG2  VAL  46           QG2      VAL  46  15.134   4.644  -9.089
  245    QG   VAL  46           QQG      VAL  46  15.819   5.614 -10.073
  246    H    LEU  47           H        LEU  47  15.377   8.711 -10.237
  247    HA   LEU  47           HA       LEU  47  15.756  11.277  -8.976
  248   1HB   LEU  47          2HB       LEU  47  14.125  10.112 -11.202
  249   2HB   LEU  47          1HB       LEU  47  13.800  11.777 -10.719
  250    HG   LEU  47           HG       LEU  47  15.502  11.622 -12.537
  251   1HD1  LEU  47          2HD1      LEU  47  15.603  13.101 -10.132
  252   2HD1  LEU  47          1HD1      LEU  47  17.261  12.596 -10.461
  253   3HD1  LEU  47          3HD1      LEU  47  16.363  13.514 -11.669
  254   1HD2  LEU  47          2HD2      LEU  47  16.478   9.452 -11.791
  255   2HD2  LEU  47          1HD2      LEU  47  17.710  10.694 -12.014
  256   3HD2  LEU  47          3HD2      LEU  47  17.169  10.269 -10.390
  257    MD1  LEU  47           QD1      LEU  47  16.409  13.071 -10.754
  258    MD2  LEU  47           QD2      LEU  47  17.119  10.139 -11.399
  259    QB   LEU  47           QB       LEU  47  13.963  10.945 -10.961
  260    QD   LEU  47           QQD      LEU  47  16.764  11.605 -11.076
  261    H    LEU  48           H        LEU  48  12.940   9.059  -8.975
  262    HA   LEU  48           HA       LEU  48  11.887  10.565  -6.577
  263   1HB   LEU  48          2HB       LEU  48  10.951  10.841  -9.310
  264   2HB   LEU  48          1HB       LEU  48   9.669  10.210  -8.276
  265    HG   LEU  48           HG       LEU  48  11.325  12.523  -7.319
  266   1HD1  LEU  48          2HD1      LEU  48   9.223  12.538  -9.461
  267   2HD1  LEU  48          1HD1      LEU  48   9.307  13.890  -8.332
  268   3HD1  LEU  48          3HD1      LEU  48  10.699  13.495  -9.341
  269   1HD2  LEU  48          3HD2      LEU  48   9.501  11.143  -6.022
  270   2HD2  LEU  48          2HD2      LEU  48   9.505  12.902  -5.895
  271   3HD2  LEU  48          1HD2      LEU  48   8.367  12.098  -6.976
  272    MD1  LEU  48           QD1      LEU  48   9.743  13.308  -9.045
  273    MD2  LEU  48           QD2      LEU  48   9.125  12.048  -6.298
  274    QB   LEU  48           QB       LEU  48  10.310  10.526  -8.793
  275    QD   LEU  48           QQD      LEU  48   9.434  12.678  -7.671
  276    HA   PRO  49           HA       PRO  49  11.111   6.228  -5.805
  277   1HB   PRO  49          2HB       PRO  49  10.241   6.561  -3.232
  278   2HB   PRO  49          1HB       PRO  49  11.959   6.590  -3.679
  279   1HG   PRO  49          2HG       PRO  49  10.102   8.863  -3.156
  280   2HG   PRO  49          1HG       PRO  49  11.796   8.658  -2.679
  281   1HD   PRO  49          2HD       PRO  49  11.028  10.195  -4.782
  282   2HD   PRO  49          1HD       PRO  49  12.593   9.353  -4.717
  283    QB   PRO  49           QB       PRO  49  11.100   6.576  -3.456
  284    QG   PRO  49           QG       PRO  49  10.949   8.761  -2.918
  285    QD   PRO  49           QD       PRO  49  11.811   9.774  -4.750
  286    H    ALA  50           H        ALA  50   9.280   6.992  -7.501
  287    HA   ALA  50           HA       ALA  50   6.653   7.708  -6.540
  288   1HB   ALA  50          3HB       ALA  50   7.047   5.752  -8.778
  289   2HB   ALA  50          2HB       ALA  50   6.051   7.207  -8.733
  290   3HB   ALA  50          1HB       ALA  50   7.801   7.341  -8.914
  291    MB   ALA  50           QB       ALA  50   6.967   6.767  -8.809
  292    H    LEU  51           H        LEU  51   8.348   4.577  -6.633
  293    HA   LEU  51           HA       LEU  51   5.987   2.923  -6.113
  294   1HB   LEU  51          2HB       LEU  51   8.225   2.204  -6.973
  295   2HB   LEU  51          1HB       LEU  51   8.904   2.516  -5.375
  296    HG   LEU  51           HG       LEU  51   7.171   0.904  -4.447
  297   1HD1  LEU  51          3HD1      LEU  51   6.457   0.910  -7.285
  298   2HD1  LEU  51          2HD1      LEU  51   6.715  -0.718  -6.658
  299   3HD1  LEU  51          1HD1      LEU  51   5.528   0.342  -5.897
  300   1HD2  LEU  51          3HD2      LEU  51   9.628   0.384  -5.042
  301   2HD2  LEU  51          2HD2      LEU  51   8.537  -0.992  -4.878
  302   3HD2  LEU  51          1HD2      LEU  51   8.983  -0.406  -6.481
  303    MD1  LEU  51           QD1      LEU  51   6.234   0.178  -6.614
  304    MD2  LEU  51           QD2      LEU  51   9.050  -0.338  -5.467
  305    QB   LEU  51           QB       LEU  51   8.565   2.360  -6.174
  306    QD   LEU  51           QQD      LEU  51   7.642  -0.080  -6.040
  307    H    ALA  52           H        ALA  52   8.540   4.240  -3.927
  308    HA   ALA  52           HA       ALA  52   7.468   3.220  -1.464
  309   1HB   ALA  52          3HB       ALA  52   8.731   5.932  -1.955
  310   2HB   ALA  52          1HB       ALA  52   9.642   4.422  -1.952
  311   3HB   ALA  52          2HB       ALA  52   8.829   4.964  -0.484
  312    MB   ALA  52           QB       ALA  52   9.068   5.106  -1.464
  313    H    ILE  53           H        ILE  53   6.710   6.289  -3.191
  314    HA   ILE  53           HA       ILE  53   4.800   7.244  -1.200
  315    HB   ILE  53           HB       ILE  53   4.978   7.672  -4.202
  316   1HG1  ILE  53          2HG1      ILE  53   7.110   8.175  -3.196
  317   2HG1  ILE  53          1HG1      ILE  53   6.291   9.715  -3.462
  318   1HG2  ILE  53          2HG2      ILE  53   3.358   8.872  -2.031
  319   2HG2  ILE  53          1HG2      ILE  53   4.130  10.023  -3.122
  320   3HG2  ILE  53          3HG2      ILE  53   3.039   8.795  -3.764
  321   1HD1  ILE  53          2HD1      ILE  53   5.375   9.162  -0.987
  322   2HD1  ILE  53          1HD1      ILE  53   6.923   8.321  -0.911
  323   3HD1  ILE  53          3HD1      ILE  53   6.874  10.048  -1.268
  324    MG   ILE  53           QG2      ILE  53   3.509   9.230  -2.973
  325    MD   ILE  53           QD1      ILE  53   6.391   9.177  -1.056
  326    QG   ILE  53           QG1      ILE  53   6.701   8.945  -3.329
  327    H    PHE  54           H        PHE  54   4.396   5.332  -4.224
  328    HA   PHE  54           HA       PHE  54   1.534   5.171  -4.223
  329   1HB   PHE  54          2HB       PHE  54   3.177   4.369  -5.937
  330   2HB   PHE  54          1HB       PHE  54   3.557   3.006  -4.884
  331    HD1  PHE  54          1HD       PHE  54   0.882   4.612  -6.893
  332    HD2  PHE  54          2HD       PHE  54   2.069   1.135  -4.668
  333    HE1  PHE  54          1HE       PHE  54  -1.067   3.371  -7.793
  334    HE2  PHE  54          2HE       PHE  54   0.119  -0.106  -5.567
  335    HZ   PHE  54           HZ       PHE  54  -1.449   1.012  -7.130
  336    QB   PHE  54           QB       PHE  54   3.367   3.688  -5.411
  337    QD   PHE  54           QD       PHE  54   1.476   2.874  -5.781
  338    QE   PHE  54           QE       PHE  54  -0.474   1.633  -6.680
  339    QR   PHE  54           QR       PHE  54   0.111   2.005  -6.411
  340    H    ILE  55           H        ILE  55   3.911   3.038  -2.540
  341    HA   ILE  55           HA       ILE  55   1.909   1.295  -1.342
  342    HB   ILE  55           HB       ILE  55   4.664   2.175  -0.417
  343   1HG1  ILE  55          2HG1      ILE  55   4.721   1.265  -2.675
  344   2HG1  ILE  55          1HG1      ILE  55   5.362   0.054  -1.564
  345   1HG2  ILE  55          1HG2      ILE  55   2.712   0.168   0.566
  346   2HG2  ILE  55          3HG2      ILE  55   4.377  -0.391   0.417
  347   3HG2  ILE  55          2HG2      ILE  55   4.003   1.002   1.432
  348   1HD1  ILE  55          3HD1      ILE  55   2.796  -0.680  -1.474
  349   2HD1  ILE  55          2HD1      ILE  55   2.783   0.069  -3.071
  350   3HD1  ILE  55          1HD1      ILE  55   3.879  -1.272  -2.735
  351    MG   ILE  55           QG2      ILE  55   3.698   0.260   0.805
  352    MD   ILE  55           QD1      ILE  55   3.153  -0.627  -2.427
  353    QG   ILE  55           QG1      ILE  55   5.042   0.660  -2.120
  354    H    GLY  56           H        GLY  56   3.512   4.287  -0.140
  355   1HA   GLY  56          1HA       GLY  56   2.759   5.759   1.563
  356   2HA   GLY  56          2HA       GLY  56   2.325   4.309   2.469
  357    QA   GLY  56           QA       GLY  56   2.542   5.034   2.016
  358    H    LEU  57           H        LEU  57   1.055   5.824  -0.557
  359    HA   LEU  57           HA       LEU  57  -1.476   6.637   0.619
  360   1HB   LEU  57          2HB       LEU  57  -0.207   7.025  -1.696
  361   2HB   LEU  57          1HB       LEU  57  -1.255   5.706  -2.217
  362    HG   LEU  57           HG       LEU  57  -2.393   7.809  -2.645
  363   1HD1  LEU  57          2HD1      LEU  57  -3.589   5.760  -1.565
  364   2HD1  LEU  57          1HD1      LEU  57  -3.663   6.767  -0.119
  365   3HD1  LEU  57          3HD1      LEU  57  -4.443   7.303  -1.608
  366   1HD2  LEU  57          1HD2      LEU  57  -1.189   8.501  -0.097
  367   2HD2  LEU  57          3HD2      LEU  57  -1.895   9.564  -1.314
  368   3HD2  LEU  57          2HD2      LEU  57  -2.920   8.838  -0.076
  369    MD1  LEU  57           QD1      LEU  57  -3.898   6.610  -1.098
  370    MD2  LEU  57           QD2      LEU  57  -2.001   8.968  -0.496
  371    QB   LEU  57           QB       LEU  57  -0.731   6.366  -1.957
  372    QD   LEU  57           QQD      LEU  57  -2.949   7.789  -0.797
  373    H    THR  58           H        THR  58  -0.405   3.579  -0.904
  374    HA   THR  58           HA       THR  58  -3.039   2.334  -0.994
  375    HB   THR  58           HB       THR  58  -0.267   1.151  -0.635
  376    HG1  THR  58          1HG       THR  58  -1.741   2.031  -2.877
  377   1HG2  THR  58          1HG2      THR  58  -2.891   0.014  -1.616
  378   2HG2  THR  58          3HG2      THR  58  -1.336  -0.755  -1.935
  379   3HG2  THR  58          2HG2      THR  58  -1.900  -0.560  -0.275
  380    MG   THR  58           QG2      THR  58  -2.042  -0.433  -1.276
  381    H    ILE  59           H        ILE  59  -0.373   2.054   1.424
  382    HA   ILE  59           HA       ILE  59  -1.927   0.422   3.280
  383    HB   ILE  59           HB       ILE  59   0.412   2.321   3.638
  384   1HG1  ILE  59          2HG1      ILE  59   0.339  -0.693   3.288
  385   2HG1  ILE  59          1HG1      ILE  59   0.669   0.442   1.978
  386   1HG2  ILE  59          1HG2      ILE  59  -1.134   0.838   5.562
  387   2HG2  ILE  59          3HG2      ILE  59   0.485   0.143   5.459
  388   3HG2  ILE  59          2HG2      ILE  59   0.282   1.853   5.837
  389   1HD1  ILE  59          2HD1      ILE  59   2.601   1.331   3.235
  390   2HD1  ILE  59          1HD1      ILE  59   2.278   0.186   4.538
  391   3HD1  ILE  59          3HD1      ILE  59   2.772  -0.401   2.950
  392    MG   ILE  59           QG2      ILE  59  -0.122   0.945   5.619
  393    MD   ILE  59           QD1      ILE  59   2.551   0.372   3.574
  394    QG   ILE  59           QG1      ILE  59   0.504  -0.125   2.633
  395    H    TYR  60           H        TYR  60  -1.382   3.987   3.078
  396    HA   TYR  60           HA       TYR  60  -2.797   4.650   5.523
  397   1HB   TYR  60          2HB       TYR  60  -2.157   5.972   2.901
  398   2HB   TYR  60          1HB       TYR  60  -3.241   6.798   4.018
  399    HD1  TYR  60          1HD       TYR  60  -0.152   4.710   4.459
  400    HD2  TYR  60          2HD       TYR  60  -2.113   8.460   5.203
  401    HE1  TYR  60          1HE       TYR  60   1.807   5.475   5.772
  402    HE2  TYR  60          2HE       TYR  60  -0.153   9.223   6.519
  403    HH   TYR  60           HH       TYR  60   2.829   7.693   6.423
  404    QB   TYR  60           QB       TYR  60  -2.699   6.385   3.459
  405    QD   TYR  60           QD       TYR  60  -1.132   6.585   4.831
  406    QE   TYR  60           QE       TYR  60   0.827   7.349   6.145
  407    QR   TYR  60           QR       TYR  60  -0.152   6.967   5.488
  408    H    ALA  61           H        ALA  61  -3.977   4.484   2.118
  409    HA   ALA  61           HA       ALA  61  -6.745   5.060   2.703
  410   1HB   ALA  61          1HB       ALA  61  -5.946   3.074   0.611
  411   2HB   ALA  61          2HB       ALA  61  -5.271   4.700   0.521
  412   3HB   ALA  61          3HB       ALA  61  -7.018   4.469   0.475
  413    MB   ALA  61           QB       ALA  61  -6.078   4.081   0.535
  414    H    ILE  62           H        ILE  62  -4.992   1.918   2.627
  415    HA   ILE  62           HA       ILE  62  -7.352   0.280   3.084
  416    HB   ILE  62           HB       ILE  62  -4.407  -0.016   3.722
  417   1HG1  ILE  62          2HG1      ILE  62  -6.045  -1.328   1.544
  418   2HG1  ILE  62          1HG1      ILE  62  -5.278   0.244   1.314
  419   1HG2  ILE  62          1HG2      ILE  62  -6.731  -1.828   4.185
  420   2HG2  ILE  62          3HG2      ILE  62  -5.265  -2.555   3.528
  421   3HG2  ILE  62          2HG2      ILE  62  -5.211  -1.702   5.071
  422   1HD1  ILE  62          1HD1      ILE  62  -3.838  -2.298   2.127
  423   2HD1  ILE  62          3HD1      ILE  62  -3.832  -1.599   0.508
  424   3HD1  ILE  62          2HD1      ILE  62  -3.086  -0.727   1.847
  425    MG   ILE  62           QG2      ILE  62  -5.735  -2.028   4.261
  426    MD   ILE  62           QD1      ILE  62  -3.585  -1.541   1.494
  427    QG   ILE  62           QG1      ILE  62  -5.661  -0.542   1.429
  428    H    GLN  63           H        GLN  63  -4.961   1.689   5.395
  429    HA   GLN  63           HA       GLN  63  -6.192   0.552   7.773
  430   1HB   GLN  63          2HB       GLN  63  -3.938   1.621   7.526
  431   2HB   GLN  63          1HB       GLN  63  -4.738   3.189   7.413
  432   1HG   GLN  63          2HG       GLN  63  -5.789   2.762   9.641
  433   2HG   GLN  63          1HG       GLN  63  -4.846   1.276   9.761
  434   1HE2  GLN  63          1HE2      GLN  63  -2.892   1.469  10.847
  435   2HE2  GLN  63          2HE2      GLN  63  -1.968   3.010  10.973
  436    QB   GLN  63           QB       GLN  63  -4.338   2.405   7.469
  437    QG   GLN  63           QG       GLN  63  -5.317   2.019   9.701
  438    QE   GLN  63           QE2      GLN  63  -2.430   2.240  10.910
  439    H    ARG  64           H        ARG  64  -6.743   3.650   6.036
  440    HA   ARG  64           HA       ARG  64  -8.652   4.700   7.984
  441   1HB   ARG  64          2HB       ARG  64  -7.436   5.952   6.205
  442   2HB   ARG  64          1HB       ARG  64  -8.411   5.127   4.988
  443   1HG   ARG  64          2HG       ARG  64 -10.461   6.069   5.986
  444   2HG   ARG  64          1HG       ARG  64  -9.487   6.901   7.199
  445   1HD   ARG  64          2HD       ARG  64  -9.982   8.491   5.425
  446   2HD   ARG  64          1HD       ARG  64  -8.268   8.048   5.280
  447    HE   ARG  64           HE       ARG  64 -10.180   6.304   3.760
  448   1HH1  ARG  64          1HH1      ARG  64 -10.665   8.225   1.969
  449   2HH1  ARG  64          2HH1      ARG  64  -9.223   8.580   1.079
  450   1HH2  ARG  64          1HH2      ARG  64  -7.107   7.154   3.427
  451   2HH2  ARG  64          2HH2      ARG  64  -7.208   7.973   1.904
  452    QB   ARG  64           QB       ARG  64  -7.923   5.540   5.596
  453    QG   ARG  64           QG       ARG  64  -9.974   6.485   6.592
  454    QD   ARG  64           QD       ARG  64  -9.125   8.270   5.352
  455    QH1  ARG  64           QH1      ARG  64  -9.944   8.403   1.524
  456    QH2  ARG  64           QH2      ARG  64  -7.157   7.564   2.665
  457    H    LYS  65           H        LYS  65  -9.158   3.046   4.811
  458    HA   LYS  65           HA       LYS  65 -12.026   2.871   4.991
  459   1HB   LYS  65          2HB       LYS  65  -9.925   1.028   3.809
  460   2HB   LYS  65          1HB       LYS  65 -11.644   0.937   3.425
  461   1HG   LYS  65          2HG       LYS  65  -9.943   3.418   3.048
  462   2HG   LYS  65          1HG       LYS  65 -10.337   2.279   1.760
  463   1HD   LYS  65          2HD       LYS  65 -12.780   2.680   2.277
  464   2HD   LYS  65          1HD       LYS  65 -12.270   3.981   3.355
  465   1HE   LYS  65          2HE       LYS  65 -12.628   5.152   1.351
  466   2HE   LYS  65          1HE       LYS  65 -10.898   4.778   1.222
  467   1HZ   LYS  65          1HZ       LYS  65 -11.807   2.550   0.258
  468   2HZ   LYS  65          3HZ       LYS  65 -13.181   3.479  -0.099
  469   3HZ   LYS  65          2HZ       LYS  65 -11.671   3.916  -0.744
  470    QB   LYS  65           QB       LYS  65 -10.784   0.983   3.617
  471    QD   LYS  65           QD       LYS  65 -12.525   3.331   2.816
  472    QG   LYS  65           QG       LYS  65 -10.140   2.849   2.404
  473    QE   LYS  65           QE       LYS  65 -11.763   4.965   1.286
  474    QZ   LYS  65           QZ       LYS  65 -12.219   3.315  -0.195
  475    H    ARG  66           H        ARG  66  -9.519   0.508   6.078
  476    HA   ARG  66           HA       ARG  66 -11.327  -1.442   7.182
  477   1HB   ARG  66          2HB       ARG  66  -8.861  -1.625   6.876
  478   2HB   ARG  66          1HB       ARG  66  -8.630  -0.488   8.205
  479   1HG   ARG  66          2HG       ARG  66  -9.780  -2.030   9.742
  480   2HG   ARG  66          1HG       ARG  66 -10.039  -3.165   8.418
  481   1HD   ARG  66          2HD       ARG  66  -8.083  -3.936   9.604
  482   2HD   ARG  66          1HD       ARG  66  -7.488  -3.175   8.115
  483    HE   ARG  66           HE       ARG  66  -7.380  -0.980   9.646
  484   1HH1  ARG  66          1HH1      ARG  66  -7.610  -1.563  12.268
  485   2HH1  ARG  66          2HH1      ARG  66  -6.172  -2.365  12.807
  486   1HH2  ARG  66          1HH2      ARG  66  -5.155  -3.260   9.616
  487   2HH2  ARG  66          2HH2      ARG  66  -4.783  -3.326  11.306
  488    QB   ARG  66           QB       ARG  66  -8.745  -1.056   7.540
  489    QG   ARG  66           QG       ARG  66  -9.909  -2.597   9.080
  490    QD   ARG  66           QD       ARG  66  -7.785  -3.555   8.859
  491    QH1  ARG  66           QH1      ARG  66  -6.891  -1.964  12.537
  492    QH2  ARG  66           QH2      ARG  66  -4.969  -3.293  10.461
  493    H    GLN  67           H        GLN  67 -10.012   1.582   8.593
  494    HA   GLN  67           HA       GLN  67 -12.320   1.647  10.504
  495   1HB   GLN  67          2HB       GLN  67 -10.512   0.091  11.438
  496   2HB   GLN  67          1HB       GLN  67  -9.487   1.521  11.566
  497   1HG   GLN  67          2HG       GLN  67 -11.208   2.613  12.979
  498   2HG   GLN  67          1HG       GLN  67 -12.195   1.155  12.883
  499   1HE2  GLN  67          1HE2      GLN  67 -11.486   1.941  15.441
  500   2HE2  GLN  67          2HE2      GLN  67 -10.191   0.857  16.067
  501    QB   GLN  67           QB       GLN  67  -9.999   0.806  11.502
  502    QG   GLN  67           QG       GLN  67 -11.701   1.884  12.931
  503    QE   GLN  67           QE2      GLN  67 -10.838   1.399  15.754
  504    H    ALA  68           H        ALA  68 -12.680   3.760  11.299
  505    HA   ALA  68           HA       ALA  68 -10.696   5.816  10.211
  506   1HB   ALA  68          3HB       ALA  68 -13.689   5.638  10.435
  507   2HB   ALA  68          1HB       ALA  68 -12.707   6.091   9.042
  508   3HB   ALA  68          2HB       ALA  68 -12.915   7.222  10.379
  509    MB   ALA  68           QB       ALA  68 -13.103   6.317   9.952
  510    H    ASP  69           H        ASP  69 -10.561   4.446  12.863
  511    HA   ASP  69           HA       ASP  69 -10.196   5.171  15.113
  512   1HB   ASP  69          2HB       ASP  69  -9.099   7.008  13.622
  513   2HB   ASP  69          1HB       ASP  69 -10.482   7.996  14.092
  514    QB   ASP  69           QB       ASP  69  -9.790   7.502  13.857

  No H/Q in entry =         514
  Start of MODEL    2
    1    H    THR  24           H        THR  24 -17.121  -3.452   4.981
    2    HA   THR  24           HA       THR  24 -15.522  -5.214   4.681
    3    HB   THR  24           HB       THR  24 -15.635  -6.096   2.479
    4    HG1  THR  24          1HG       THR  24 -15.923  -4.751   0.689
    5   1HG2  THR  24          3HG2      THR  24 -17.870  -5.483   3.656
    6   2HG2  THR  24          2HG2      THR  24 -17.994  -4.229   2.423
    7   3HG2  THR  24          1HG2      THR  24 -17.917  -5.925   1.949
    8    MG   THR  24           QG2      THR  24 -17.927  -5.212   2.676
    9    HA   PRO  25           HA       PRO  25 -12.122  -2.083   3.832
   10   1HB   PRO  25          2HB       PRO  25 -11.048  -2.134   6.358
   11   2HB   PRO  25          1HB       PRO  25 -12.318  -0.998   5.861
   12   1HG   PRO  25          2HG       PRO  25 -12.544  -3.531   7.407
   13   2HG   PRO  25          1HG       PRO  25 -13.399  -1.996   7.624
   14   1HD   PRO  25          2HD       PRO  25 -14.520  -4.164   6.429
   15   2HD   PRO  25          1HD       PRO  25 -14.967  -2.492   6.025
   16    QB   PRO  25           QB       PRO  25 -11.683  -1.566   6.109
   17    QG   PRO  25           QG       PRO  25 -12.971  -2.764   7.516
   18    QD   PRO  25           QD       PRO  25 -14.744  -3.328   6.227
   19    H    VAL  26           H        VAL  26 -12.440  -5.252   5.303
   20    HA   VAL  26           HA       VAL  26  -9.617  -5.974   5.381
   21    HB   VAL  26           HB       VAL  26 -11.656  -7.097   6.409
   22   1HG1  VAL  26          3HG1      VAL  26 -12.978  -7.061   4.271
   23   2HG1  VAL  26          2HG1      VAL  26 -11.897  -8.300   3.636
   24   3HG1  VAL  26          1HG1      VAL  26 -12.915  -8.650   5.032
   25   1HG2  VAL  26          2HG2      VAL  26  -9.560  -8.602   4.841
   26   2HG2  VAL  26          1HG2      VAL  26  -9.636  -8.313   6.579
   27   3HG2  VAL  26          3HG2      VAL  26 -10.745  -9.459   5.827
   28    MG1  VAL  26           QG1      VAL  26 -12.597  -8.004   4.313
   29    MG2  VAL  26           QG2      VAL  26  -9.980  -8.791   5.749
   30    QG   VAL  26           QQG      VAL  26 -11.289  -8.398   5.031
   31    H    LEU  27           H        LEU  27 -12.075  -6.045   2.792
   32    HA   LEU  27           HA       LEU  27 -10.622  -7.664   0.890
   33   1HB   LEU  27          2HB       LEU  27 -12.982  -6.868   0.768
   34   2HB   LEU  27          1HB       LEU  27 -12.393  -5.238   0.445
   35    HG   LEU  27           HG       LEU  27 -11.132  -6.224  -1.539
   36   1HD1  LEU  27          1HD1      LEU  27 -11.264  -8.582  -0.769
   37   2HD1  LEU  27          3HD1      LEU  27 -13.014  -8.540  -0.989
   38   3HD1  LEU  27          2HD1      LEU  27 -11.946  -8.381  -2.384
   39   1HD2  LEU  27          1HD2      LEU  27 -13.757  -5.317  -1.268
   40   2HD2  LEU  27          3HD2      LEU  27 -12.872  -5.487  -2.783
   41   3HD2  LEU  27          2HD2      LEU  27 -13.915  -6.793  -2.220
   42    MD1  LEU  27           QD1      LEU  27 -12.075  -8.501  -1.381
   43    MD2  LEU  27           QD2      LEU  27 -13.515  -5.866  -2.090
   44    QB   LEU  27           QB       LEU  27 -12.687  -6.053   0.606
   45    QD   LEU  27           QQD      LEU  27 -12.795  -7.183  -1.736
   46    H    VAL  28           H        VAL  28 -10.402  -4.188   1.684
   47    HA   VAL  28           HA       VAL  28  -8.715  -3.401  -0.533
   48    HB   VAL  28           HB       VAL  28  -8.900  -2.461   2.346
   49   1HG1  VAL  28          2HG1      VAL  28  -6.863  -1.659   1.099
   50   2HG1  VAL  28          1HG1      VAL  28  -7.944  -0.939  -0.095
   51   3HG1  VAL  28          3HG1      VAL  28  -7.966  -0.365   1.573
   52   1HG2  VAL  28          1HG2      VAL  28 -10.894  -2.552   0.505
   53   2HG2  VAL  28          3HG2      VAL  28 -10.771  -1.294   1.735
   54   3HG2  VAL  28          2HG2      VAL  28 -10.175  -0.993   0.103
   55    MG1  VAL  28           QG1      VAL  28  -7.591  -0.988   0.859
   56    MG2  VAL  28           QG2      VAL  28 -10.613  -1.613   0.781
   57    QG   VAL  28           QQG      VAL  28  -9.102  -1.300   0.820
   58    H    ILE  29           H        ILE  29  -7.878  -4.653   2.739
   59    HA   ILE  29           HA       ILE  29  -4.989  -4.434   2.364
   60    HB   ILE  29           HB       ILE  29  -6.721  -6.286   4.033
   61   1HG1  ILE  29          2HG1      ILE  29  -5.381  -3.659   4.749
   62   2HG1  ILE  29          1HG1      ILE  29  -7.088  -3.819   4.333
   63   1HG2  ILE  29          2HG2      ILE  29  -3.846  -6.084   3.692
   64   2HG2  ILE  29          1HG2      ILE  29  -4.310  -5.705   5.351
   65   3HG2  ILE  29          3HG2      ILE  29  -4.775  -7.248   4.637
   66   1HD1  ILE  29          1HD1      ILE  29  -6.421  -5.795   6.309
   67   2HD1  ILE  29          3HD1      ILE  29  -5.879  -4.214   6.873
   68   3HD1  ILE  29          2HD1      ILE  29  -7.569  -4.462   6.433
   69    MG   ILE  29           QG2      ILE  29  -4.311  -6.346   4.560
   70    MD   ILE  29           QD1      ILE  29  -6.623  -4.824   6.538
   71    QG   ILE  29           QG1      ILE  29  -6.235  -3.739   4.541
   72    H    LEU  30           H        LEU  30  -7.358  -7.026   1.664
   73    HA   LEU  30           HA       LEU  30  -5.408  -9.083   1.008
   74   1HB   LEU  30          2HB       LEU  30  -8.277  -8.441   0.502
   75   2HB   LEU  30          1HB       LEU  30  -7.552  -9.704  -0.493
   76    HG   LEU  30           HG       LEU  30  -8.633 -10.450   1.718
   77   1HD1  LEU  30          3HD1      LEU  30  -5.976 -11.134   0.601
   78   2HD1  LEU  30          2HD1      LEU  30  -6.290 -11.733   2.229
   79   3HD1  LEU  30          1HD1      LEU  30  -7.369 -12.171   0.906
   80   1HD2  LEU  30          1HD2      LEU  30  -7.545  -8.499   2.968
   81   2HD2  LEU  30          3HD2      LEU  30  -7.407 -10.079   3.739
   82   3HD2  LEU  30          2HD2      LEU  30  -6.034  -9.403   2.862
   83    MD1  LEU  30           QD1      LEU  30  -6.545 -11.680   1.245
   84    MD2  LEU  30           QD2      LEU  30  -6.995  -9.327   3.190
   85    QB   LEU  30           QB       LEU  30  -7.914  -9.072   0.005
   86    QD   LEU  30           QQD      LEU  30  -6.770 -10.503   2.217
   87    H    LEU  31           H        LEU  31  -7.073  -6.628  -1.034
   88    HA   LEU  31           HA       LEU  31  -5.907  -7.510  -3.550
   89   1HB   LEU  31          2HB       LEU  31  -7.844  -5.948  -3.115
   90   2HB   LEU  31          1HB       LEU  31  -6.668  -4.711  -2.666
   91    HG   LEU  31           HG       LEU  31  -6.353  -6.135  -5.286
   92   1HD1  LEU  31          2HD1      LEU  31  -8.429  -4.085  -4.570
   93   2HD1  LEU  31          1HD1      LEU  31  -7.706  -4.064  -6.178
   94   3HD1  LEU  31          3HD1      LEU  31  -8.574  -5.495  -5.619
   95   1HD2  LEU  31          1HD2      LEU  31  -5.337  -3.749  -3.905
   96   2HD2  LEU  31          3HD2      LEU  31  -4.619  -4.673  -5.224
   97   3HD2  LEU  31          2HD2      LEU  31  -5.825  -3.434  -5.570
   98    MD1  LEU  31           QD1      LEU  31  -8.236  -4.548  -5.456
   99    MD2  LEU  31           QD2      LEU  31  -5.260  -3.952  -4.900
  100    QB   LEU  31           QB       LEU  31  -7.256  -5.330  -2.890
  101    QD   LEU  31           QQD      LEU  31  -6.748  -4.250  -5.178
  102    H    GLY  32           H        GLY  32  -4.818  -5.078  -1.128
  103   1HA   GLY  32          1HA       GLY  32  -2.681  -4.055  -0.938
  104   2HA   GLY  32          2HA       GLY  32  -2.485  -4.256  -2.681
  105    QA   GLY  32           QA       GLY  32  -2.583  -4.156  -1.810
  106    H    VAL  33           H        VAL  33  -3.036  -6.819  -0.256
  107    HA   VAL  33           HA       VAL  33  -0.288  -7.612   0.121
  108    HB   VAL  33           HB       VAL  33  -2.925  -9.111   0.066
  109   1HG1  VAL  33          2HG1      VAL  33  -0.137 -10.027   0.644
  110   2HG1  VAL  33          1HG1      VAL  33  -1.438 -10.642   1.663
  111   3HG1  VAL  33          3HG1      VAL  33  -1.481 -10.911  -0.079
  112   1HG2  VAL  33          3HG2      VAL  33  -2.061  -7.169   1.773
  113   2HG2  VAL  33          2HG2      VAL  33  -3.153  -8.469   2.248
  114   3HG2  VAL  33          1HG2      VAL  33  -1.426  -8.608   2.571
  115    MG1  VAL  33           QG1      VAL  33  -1.019 -10.527   0.743
  116    MG2  VAL  33           QG2      VAL  33  -2.213  -8.082   2.197
  117    QG   VAL  33           QQG      VAL  33  -1.616  -9.304   1.470
  118    H    VAL  34           H        VAL  34  -2.712  -8.725  -2.297
  119    HA   VAL  34           HA       VAL  34  -1.003 -10.645  -3.622
  120    HB   VAL  34           HB       VAL  34  -3.260  -8.850  -4.553
  121   1HG1  VAL  34          3HG1      VAL  34  -1.869 -11.169  -5.907
  122   2HG1  VAL  34          2HG1      VAL  34  -3.510 -10.680  -6.332
  123   3HG1  VAL  34          1HG1      VAL  34  -2.169  -9.555  -6.553
  124   1HG2  VAL  34          2HG2      VAL  34  -3.049 -11.289  -2.976
  125   2HG2  VAL  34          1HG2      VAL  34  -4.451 -10.253  -3.243
  126   3HG2  VAL  34          3HG2      VAL  34  -4.062 -11.528  -4.399
  127    MG1  VAL  34           QG1      VAL  34  -2.516 -10.468  -6.264
  128    MG2  VAL  34           QG2      VAL  34  -3.854 -11.024  -3.539
  129    QG   VAL  34           QQG      VAL  34  -3.185 -10.746  -4.902
  130    H    GLY  35           H        GLY  35  -1.448  -7.117  -4.178
  131   1HA   GLY  35          1HA       GLY  35  -0.072  -5.652  -5.442
  132   2HA   GLY  35          2HA       GLY  35   0.185  -6.990  -6.562
  133    QA   GLY  35           QA       GLY  35   0.057  -6.321  -6.002
  134    H    LEU  36           H        LEU  36   1.067  -6.788  -3.088
  135    HA   LEU  36           HA       LEU  36   3.858  -6.130  -3.482
  136   1HB   LEU  36          2HB       LEU  36   2.549  -6.137  -1.358
  137   2HB   LEU  36          1HB       LEU  36   2.540  -7.900  -1.396
  138    HG   LEU  36           HG       LEU  36   5.085  -7.783  -1.484
  139   1HD1  LEU  36          3HD1      LEU  36   4.425  -4.977  -1.606
  140   2HD1  LEU  36          2HD1      LEU  36   5.401  -5.296  -0.171
  141   3HD1  LEU  36          1HD1      LEU  36   6.004  -5.747  -1.766
  142   1HD2  LEU  36          1HD2      LEU  36   3.533  -8.121   0.595
  143   2HD2  LEU  36          3HD2      LEU  36   5.237  -7.759   0.862
  144   3HD2  LEU  36          2HD2      LEU  36   4.030  -6.483   1.021
  145    MD1  LEU  36           QD1      LEU  36   5.277  -5.340  -1.181
  146    MD2  LEU  36           QD2      LEU  36   4.266  -7.454   0.826
  147    QB   LEU  36           QB       LEU  36   2.545  -7.019  -1.377
  148    QD   LEU  36           QQD      LEU  36   4.772  -6.397  -0.178
  149    H    SER  37           H        SER  37   2.151  -9.282  -3.496
  150    HA   SER  37           HA       SER  37   4.475 -10.987  -3.534
  151   1HB   SER  37          2HB       SER  37   1.825 -11.287  -4.980
  152   2HB   SER  37          1HB       SER  37   2.889 -12.598  -4.480
  153    HG   SER  37           HG       SER  37   2.598 -11.455  -2.299
  154    QB   SER  37           QB       SER  37   2.357 -11.942  -4.730
  155    H    ALA  38           H        ALA  38   2.638  -9.579  -6.312
  156    HA   ALA  38           HA       ALA  38   4.272 -10.667  -8.411
  157   1HB   ALA  38          3HB       ALA  38   2.246  -9.522  -8.906
  158   2HB   ALA  38          1HB       ALA  38   3.512  -8.477  -9.554
  159   3HB   ALA  38          2HB       ALA  38   2.749  -8.087  -8.012
  160    MB   ALA  38           QB       ALA  38   2.836  -8.696  -8.824
  161    H    LEU  39           H        LEU  39   4.830  -7.871  -6.267
  162    HA   LEU  39           HA       LEU  39   7.445  -7.356  -7.741
  163   1HB   LEU  39          2HB       LEU  39   5.884  -5.746  -5.696
  164   2HB   LEU  39          1HB       LEU  39   7.294  -5.182  -6.594
  165    HG   LEU  39           HG       LEU  39   4.706  -6.105  -7.873
  166   1HD1  LEU  39          3HD1      LEU  39   5.463  -3.583  -6.656
  167   2HD1  LEU  39          2HD1      LEU  39   5.157  -3.378  -8.381
  168   3HD1  LEU  39          1HD1      LEU  39   3.910  -4.065  -7.340
  169   1HD2  LEU  39          3HD2      LEU  39   7.335  -5.759  -8.884
  170   2HD2  LEU  39          2HD2      LEU  39   5.859  -6.045  -9.807
  171   3HD2  LEU  39          1HD2      LEU  39   6.384  -4.395  -9.472
  172    MD1  LEU  39           QD1      LEU  39   4.843  -3.676  -7.459
  173    MD2  LEU  39           QD2      LEU  39   6.526  -5.399  -9.388
  174    QB   LEU  39           QB       LEU  39   6.589  -5.464  -6.145
  175    QD   LEU  39           QQD      LEU  39   5.685  -4.538  -8.423
  176    H    THR  40           H        THR  40   9.050  -8.649  -6.867
  177    HA   THR  40           HA       THR  40   9.496  -8.324  -3.888
  178    HB   THR  40           HB       THR  40   9.800 -10.876  -3.839
  179    HG1  THR  40          1HG       THR  40   8.024 -11.229  -5.840
  180   1HG2  THR  40          1HG2      THR  40   7.761  -9.441  -3.075
  181   2HG2  THR  40          3HG2      THR  40   6.972 -10.100  -4.508
  182   3HG2  THR  40          2HG2      THR  40   7.556 -11.185  -3.245
  183    MG   THR  40           QG2      THR  40   7.430 -10.242  -3.609
  184    H    GLY  41           H        GLY  41  10.926  -7.243  -6.200
  185   1HA   GLY  41          1HA       GLY  41  13.032  -7.757  -7.404
  186   2HA   GLY  41          2HA       GLY  41  13.387  -9.024  -6.229
  187    QA   GLY  41           QA       GLY  41  13.210  -8.391  -6.817
  188    H    TYR  42           H        TYR  42  15.004  -6.632  -7.118
  189    HA   TYR  42           HA       TYR  42  15.168  -5.228  -4.411
  190   1HB   TYR  42          2HB       TYR  42  16.791  -7.108  -4.652
  191   2HB   TYR  42          1HB       TYR  42  17.435  -6.333  -6.101
  192    HD1  TYR  42          1HD       TYR  42  17.035  -6.015  -2.429
  193    HD2  TYR  42          2HD       TYR  42  18.864  -4.399  -5.963
  194    HE1  TYR  42          1HE       TYR  42  18.503  -4.596  -1.020
  195    HE2  TYR  42          2HE       TYR  42  20.332  -2.981  -4.555
  196    HH   TYR  42           HH       TYR  42  20.271  -3.225  -1.009
  197    QB   TYR  42           QB       TYR  42  17.113  -6.721  -5.377
  198    QD   TYR  42           QD       TYR  42  17.949  -5.207  -4.196
  199    QE   TYR  42           QE       TYR  42  19.418  -3.788  -2.788
  200    QR   TYR  42           QR       TYR  42  18.684  -4.498  -3.492
  201    H    LEU  43           H        LEU  43  15.644  -3.031  -4.501
  202    HA   LEU  43           HA       LEU  43  16.753  -1.846  -7.007
  203   1HB   LEU  43          2HB       LEU  43  14.211  -2.423  -7.285
  204   2HB   LEU  43          1HB       LEU  43  13.957  -1.026  -6.237
  205    HG   LEU  43           HG       LEU  43  15.791  -0.756  -8.595
  206   1HD1  LEU  43          2HD1      LEU  43  12.839  -1.151  -8.657
  207   2HD1  LEU  43          1HD1      LEU  43  13.487   0.155  -9.651
  208   3HD1  LEU  43          3HD1      LEU  43  14.047  -1.501  -9.895
  209   1HD2  LEU  43          1HD2      LEU  43  14.162   0.973  -6.784
  210   2HD2  LEU  43          3HD2      LEU  43  15.794   1.222  -7.404
  211   3HD2  LEU  43          2HD2      LEU  43  14.400   1.528  -8.441
  212    MD1  LEU  43           QD1      LEU  43  13.458  -0.832  -9.401
  213    MD2  LEU  43           QD2      LEU  43  14.785   1.241  -7.543
  214    QB   LEU  43           QB       LEU  43  14.084  -1.724  -6.761
  215    QD   LEU  43           QQD      LEU  43  14.121   0.204  -8.472
  216    H    ASP  44           H        ASP  44  17.827   0.032  -6.457
  217    HA   ASP  44           HA       ASP  44  17.649   0.965  -3.640
  218   1HB   ASP  44          2HB       ASP  44  19.051   1.948  -6.145
  219   2HB   ASP  44          1HB       ASP  44  19.334   2.611  -4.535
  220    QB   ASP  44           QB       ASP  44  19.193   2.279  -5.340
  221    H    TYR  45           H        TYR  45  17.857   3.711  -3.787
  222    HA   TYR  45           HA       TYR  45  15.008   4.436  -4.369
  223   1HB   TYR  45          2HB       TYR  45  15.541   6.342  -3.066
  224   2HB   TYR  45          1HB       TYR  45  16.547   5.069  -2.374
  225    HD1  TYR  45          1HD       TYR  45  16.508   8.174  -4.312
  226    HD2  TYR  45          2HD       TYR  45  18.966   4.950  -2.894
  227    HE1  TYR  45          1HE       TYR  45  18.540   9.495  -4.832
  228    HE2  TYR  45          2HE       TYR  45  21.000   6.272  -3.412
  229    HH   TYR  45           HH       TYR  45  21.125   8.746  -5.399
  230    QB   TYR  45           QB       TYR  45  16.044   5.706  -2.720
  231    QD   TYR  45           QD       TYR  45  17.737   6.562  -3.603
  232    QE   TYR  45           QE       TYR  45  19.770   7.883  -4.122
  233    QR   TYR  45           QR       TYR  45  18.754   7.223  -3.862
  234    H    VAL  46           H        VAL  46  14.327   5.279  -6.291
  235    HA   VAL  46           HA       VAL  46  16.485   6.366  -8.142
  236    HB   VAL  46           HB       VAL  46  14.912   5.812  -9.879
  237   1HG1  VAL  46          1HG1      VAL  46  15.947   3.941  -8.156
  238   2HG1  VAL  46          3HG1      VAL  46  14.232   3.529  -8.141
  239   3HG1  VAL  46          2HG1      VAL  46  15.118   3.557  -9.665
  240   1HG2  VAL  46          2HG2      VAL  46  12.993   6.030  -7.628
  241   2HG2  VAL  46          1HG2      VAL  46  12.779   6.433  -9.331
  242   3HG2  VAL  46          3HG2      VAL  46  12.646   4.757  -8.798
  243    MG1  VAL  46           QG1      VAL  46  15.099   3.676  -8.654
  244    MG2  VAL  46           QG2      VAL  46  12.806   5.740  -8.586
  245    QG   VAL  46           QQG      VAL  46  13.953   4.708  -8.620
  246    H    LEU  47           H        LEU  47  14.325   7.691  -9.753
  247    HA   LEU  47           HA       LEU  47  14.589  10.366  -8.762
  248   1HB   LEU  47          2HB       LEU  47  13.851   9.611 -11.021
  249   2HB   LEU  47          1HB       LEU  47  12.308   9.112 -10.325
  250    HG   LEU  47           HG       LEU  47  12.049  11.506  -9.494
  251   1HD1  LEU  47          2HD1      LEU  47  14.700  11.639 -10.566
  252   2HD1  LEU  47          1HD1      LEU  47  13.670  12.719 -11.505
  253   3HD1  LEU  47          3HD1      LEU  47  13.786  12.912  -9.756
  254   1HD2  LEU  47          1HD2      LEU  47  11.248  10.347 -11.795
  255   2HD2  LEU  47          3HD2      LEU  47  10.894  12.033 -11.414
  256   3HD2  LEU  47          2HD2      LEU  47  12.252  11.632 -12.464
  257    MD1  LEU  47           QD1      LEU  47  14.052  12.423 -10.609
  258    MD2  LEU  47           QD2      LEU  47  11.465  11.337 -11.891
  259    QB   LEU  47           QB       LEU  47  13.079   9.362 -10.673
  260    QD   LEU  47           QQD      LEU  47  12.759  11.880 -11.250
  261    H    LEU  48           H        LEU  48  12.019   7.939  -8.133
  262    HA   LEU  48           HA       LEU  48  11.327   9.390  -5.606
  263   1HB   LEU  48          2HB       LEU  48  10.176  10.301  -7.899
  264   2HB   LEU  48          1HB       LEU  48   9.017   9.055  -7.438
  265    HG   LEU  48           HG       LEU  48   9.857  10.649  -5.147
  266   1HD1  LEU  48          2HD1      LEU  48   8.501  12.051  -7.471
  267   2HD1  LEU  48          1HD1      LEU  48   8.647  12.710  -5.842
  268   3HD1  LEU  48          3HD1      LEU  48  10.093  12.430  -6.813
  269   1HD2  LEU  48          2HD2      LEU  48   7.863   9.103  -5.367
  270   2HD2  LEU  48          1HD2      LEU  48   7.475  10.708  -4.750
  271   3HD2  LEU  48          3HD2      LEU  48   7.132  10.303  -6.432
  272    MD1  LEU  48           QD1      LEU  48   9.081  12.397  -6.709
  273    MD2  LEU  48           QD2      LEU  48   7.490  10.038  -5.517
  274    QB   LEU  48           QB       LEU  48   9.596   9.678  -7.668
  275    QD   LEU  48           QQD      LEU  48   8.285  11.217  -6.113
  276    HA   PRO  49           HA       PRO  49  10.346   5.155  -4.750
  277   1HB   PRO  49          2HB       PRO  49   9.289   5.526  -2.257
  278   2HB   PRO  49          1HB       PRO  49  11.033   5.604  -2.581
  279   1HG   PRO  49          2HG       PRO  49   9.072   7.820  -2.242
  280   2HG   PRO  49          1HG       PRO  49  10.739   7.691  -1.657
  281   1HD   PRO  49          2HD       PRO  49  10.032   9.135  -3.857
  282   2HD   PRO  49          1HD       PRO  49  11.631   8.386  -3.650
  283    QB   PRO  49           QB       PRO  49  10.161   5.565  -2.419
  284    QG   PRO  49           QG       PRO  49   9.905   7.756  -1.950
  285    QD   PRO  49           QD       PRO  49  10.832   8.761  -3.753
  286    H    ALA  50           H        ALA  50   8.633   5.737  -6.590
  287    HA   ALA  50           HA       ALA  50   5.943   6.495  -5.943
  288   1HB   ALA  50          3HB       ALA  50   7.289   4.709  -7.953
  289   2HB   ALA  50          1HB       ALA  50   6.492   6.262  -8.207
  290   3HB   ALA  50          2HB       ALA  50   5.528   4.811  -7.935
  291    MB   ALA  50           QB       ALA  50   6.436   5.261  -8.032
  292    H    LEU  51           H        LEU  51   7.562   3.308  -5.668
  293    HA   LEU  51           HA       LEU  51   5.129   1.826  -4.980
  294   1HB   LEU  51          2HB       LEU  51   7.650   1.221  -5.660
  295   2HB   LEU  51          1HB       LEU  51   7.822   1.086  -3.910
  296    HG   LEU  51           HG       LEU  51   7.185  -1.089  -4.590
  297   1HD1  LEU  51          2HD1      LEU  51   5.765  -0.011  -2.757
  298   2HD1  LEU  51          1HD1      LEU  51   4.519   0.207  -3.985
  299   3HD1  LEU  51          3HD1      LEU  51   5.057  -1.416  -3.554
  300   1HD2  LEU  51          1HD2      LEU  51   6.109   0.253  -6.812
  301   2HD2  LEU  51          3HD2      LEU  51   6.116  -1.490  -6.540
  302   3HD2  LEU  51          2HD2      LEU  51   4.728  -0.525  -6.040
  303    MD1  LEU  51           QD1      LEU  51   5.114  -0.407  -3.432
  304    MD2  LEU  51           QD2      LEU  51   5.651  -0.587  -6.464
  305    QB   LEU  51           QB       LEU  51   7.736   1.154  -4.785
  306    QD   LEU  51           QQD      LEU  51   5.382  -0.497  -4.948
  307    H    ALA  52           H        ALA  52   7.779   3.191  -2.941
  308    HA   ALA  52           HA       ALA  52   6.674   2.469  -0.389
  309   1HB   ALA  52          1HB       ALA  52   8.842   3.779  -1.352
  310   2HB   ALA  52          3HB       ALA  52   7.927   5.145  -0.713
  311   3HB   ALA  52          2HB       ALA  52   8.383   3.814   0.351
  312    MB   ALA  52           QB       ALA  52   8.384   4.246  -0.571
  313    H    ILE  53           H        ILE  53   6.090   5.414  -2.380
  314    HA   ILE  53           HA       ILE  53   4.258   6.658  -0.480
  315    HB   ILE  53           HB       ILE  53   4.500   6.791  -3.503
  316   1HG1  ILE  53          2HG1      ILE  53   5.674   8.569  -1.342
  317   2HG1  ILE  53          1HG1      ILE  53   6.573   7.310  -2.190
  318   1HG2  ILE  53          2HG2      ILE  53   2.563   7.932  -1.766
  319   2HG2  ILE  53          1HG2      ILE  53   3.648   9.235  -2.251
  320   3HG2  ILE  53          3HG2      ILE  53   2.814   8.281  -3.477
  321   1HD1  ILE  53          2HD1      ILE  53   5.178   9.623  -3.566
  322   2HD1  ILE  53          1HD1      ILE  53   6.897   9.594  -3.175
  323   3HD1  ILE  53          3HD1      ILE  53   6.234   8.428  -4.319
  324    MG   ILE  53           QG2      ILE  53   3.009   8.482  -2.498
  325    MD   ILE  53           QD1      ILE  53   6.103   9.215  -3.687
  326    QG   ILE  53           QG1      ILE  53   6.123   7.940  -1.766
  327    H    PHE  54           H        PHE  54   3.708   4.514  -3.321
  328    HA   PHE  54           HA       PHE  54   0.843   4.518  -3.289
  329   1HB   PHE  54          2HB       PHE  54   2.398   3.468  -4.936
  330   2HB   PHE  54          1HB       PHE  54   2.747   2.201  -3.760
  331    HD1  PHE  54          1HD       PHE  54   0.114   3.696  -5.898
  332    HD2  PHE  54          2HD       PHE  54   1.171   0.440  -3.302
  333    HE1  PHE  54          1HE       PHE  54  -1.903   2.455  -6.633
  334    HE2  PHE  54          2HE       PHE  54  -0.845  -0.801  -4.038
  335    HZ   PHE  54           HZ       PHE  54  -2.382   0.206  -5.704
  336    QB   PHE  54           QB       PHE  54   2.573   2.835  -4.348
  337    QD   PHE  54           QD       PHE  54   0.642   2.068  -4.600
  338    QE   PHE  54           QE       PHE  54  -1.374   0.827  -5.336
  339    QR   PHE  54           QR       PHE  54  -0.769   1.199  -5.115
  340    H    ILE  55           H        ILE  55   3.114   2.432  -1.412
  341    HA   ILE  55           HA       ILE  55   1.026   0.920  -0.052
  342    HB   ILE  55           HB       ILE  55   3.841   1.725   0.752
  343   1HG1  ILE  55          2HG1      ILE  55   2.808  -0.796  -0.587
  344   2HG1  ILE  55          1HG1      ILE  55   3.602   0.529  -1.439
  345   1HG2  ILE  55          3HG2      ILE  55   2.468   0.885   2.650
  346   2HG2  ILE  55          2HG2      ILE  55   2.114  -0.574   1.723
  347   3HG2  ILE  55          1HG2      ILE  55   3.768  -0.230   2.228
  348   1HD1  ILE  55          2HD1      ILE  55   5.591   0.232   0.052
  349   2HD1  ILE  55          1HD1      ILE  55   4.802  -1.178   0.760
  350   3HD1  ILE  55          3HD1      ILE  55   5.257  -1.185  -0.944
  351    MG   ILE  55           QG2      ILE  55   2.783   0.027   2.200
  352    MD   ILE  55           QD1      ILE  55   5.217  -0.711  -0.044
  353    QG   ILE  55           QG1      ILE  55   3.205  -0.133  -1.013
  354    H    GLY  56           H        GLY  56   2.812   3.912   0.864
  355   1HA   GLY  56          1HA       GLY  56   2.150   5.584   2.413
  356   2HA   GLY  56          2HA       GLY  56   1.653   4.253   3.459
  357    QA   GLY  56           QA       GLY  56   1.901   4.918   2.936
  358    H    LEU  57           H        LEU  57   0.427   5.533   0.309
  359    HA   LEU  57           HA       LEU  57  -2.042   6.594   1.412
  360   1HB   LEU  57          2HB       LEU  57  -0.970   6.971  -0.848
  361   2HB   LEU  57          1HB       LEU  57  -1.546   5.372  -1.318
  362    HG   LEU  57           HG       LEU  57  -3.491   7.338  -0.157
  363   1HD1  LEU  57          1HD1      LEU  57  -1.921   8.024  -2.340
  364   2HD1  LEU  57          3HD1      LEU  57  -3.366   7.339  -3.084
  365   3HD1  LEU  57          2HD1      LEU  57  -3.509   8.696  -1.968
  366   1HD2  LEU  57          2HD2      LEU  57  -3.508   4.768  -1.530
  367   2HD2  LEU  57          1HD2      LEU  57  -4.803   5.560  -0.633
  368   3HD2  LEU  57          3HD2      LEU  57  -4.553   5.936  -2.339
  369    MD1  LEU  57           QD1      LEU  57  -2.932   8.020  -2.464
  370    MD2  LEU  57           QD2      LEU  57  -4.288   5.421  -1.501
  371    QB   LEU  57           QB       LEU  57  -1.258   6.172  -1.083
  372    QD   LEU  57           QQD      LEU  57  -3.610   6.721  -1.982
  373    H    THR  58           H        THR  58  -1.144   3.338   0.230
  374    HA   THR  58           HA       THR  58  -3.839   2.229   0.270
  375    HB   THR  58           HB       THR  58  -1.137   0.943   0.780
  376    HG1  THR  58          1HG       THR  58  -0.838   1.067  -1.307
  377   1HG2  THR  58          3HG2      THR  58  -3.780  -0.123   0.733
  378   2HG2  THR  58          2HG2      THR  58  -2.957  -0.664  -0.730
  379   3HG2  THR  58          1HG2      THR  58  -2.255  -1.002   0.852
  380    MG   THR  58           QG2      THR  58  -2.997  -0.597   0.285
  381    H    ILE  59           H        ILE  59  -1.190   2.089   2.717
  382    HA   ILE  59           HA       ILE  59  -2.815   0.752   4.737
  383    HB   ILE  59           HB       ILE  59  -0.403   2.584   4.907
  384   1HG1  ILE  59          2HG1      ILE  59  -0.601  -0.445   4.836
  385   2HG1  ILE  59          1HG1      ILE  59  -0.194   0.555   3.440
  386   1HG2  ILE  59          2HG2      ILE  59  -1.880   0.941   6.911
  387   2HG2  ILE  59          1HG2      ILE  59  -0.119   0.907   6.985
  388   3HG2  ILE  59          3HG2      ILE  59  -0.980   2.440   7.134
  389   1HD1  ILE  59          3HD1      ILE  59   1.702   1.523   4.823
  390   2HD1  ILE  59          2HD1      ILE  59   1.368   0.271   6.019
  391   3HD1  ILE  59          1HD1      ILE  59   1.889  -0.178   4.395
  392    MG   ILE  59           QG2      ILE  59  -0.993   1.429   7.010
  393    MD   ILE  59           QD1      ILE  59   1.653   0.539   5.079
  394    QG   ILE  59           QG1      ILE  59  -0.397   0.055   4.138
  395    H    TYR  60           H        TYR  60  -2.124   4.243   4.131
  396    HA   TYR  60           HA       TYR  60  -3.493   5.244   6.482
  397   1HB   TYR  60          2HB       TYR  60  -2.855   6.230   3.710
  398   2HB   TYR  60          1HB       TYR  60  -3.856   7.226   4.765
  399    HD1  TYR  60          1HD       TYR  60  -2.750   6.780   7.413
  400    HD2  TYR  60          2HD       TYR  60  -0.715   7.195   3.652
  401    HE1  TYR  60          1HE       TYR  60  -0.716   7.557   8.599
  402    HE2  TYR  60          2HE       TYR  60   1.319   7.974   4.840
  403    HH   TYR  60           HH       TYR  60   1.562   9.206   7.455
  404    QB   TYR  60           QB       TYR  60  -3.356   6.728   4.238
  405    QD   TYR  60           QD       TYR  60  -1.733   6.987   5.532
  406    QE   TYR  60           QE       TYR  60   0.301   7.766   6.719
  407    QR   TYR  60           QR       TYR  60  -0.716   7.377   6.126
  408    H    ALA  61           H        ALA  61  -4.710   4.743   3.123
  409    HA   ALA  61           HA       ALA  61  -7.449   5.486   3.647
  410   1HB   ALA  61          3HB       ALA  61  -6.848   3.231   1.801
  411   2HB   ALA  61          1HB       ALA  61  -5.954   4.729   1.533
  412   3HB   ALA  61          2HB       ALA  61  -7.716   4.734   1.492
  413    MB   ALA  61           QB       ALA  61  -6.839   4.231   1.609
  414    H    ILE  62           H        ILE  62  -5.818   2.291   3.940
  415    HA   ILE  62           HA       ILE  62  -8.230   0.806   4.587
  416    HB   ILE  62           HB       ILE  62  -5.300   0.489   5.274
  417   1HG1  ILE  62          2HG1      ILE  62  -6.981  -1.017   3.261
  418   2HG1  ILE  62          1HG1      ILE  62  -6.149   0.483   2.848
  419   1HG2  ILE  62          3HG2      ILE  62  -7.601  -1.465   5.579
  420   2HG2  ILE  62          2HG2      ILE  62  -5.897  -1.910   5.685
  421   3HG2  ILE  62          1HG2      ILE  62  -6.598  -0.813   6.875
  422   1HD1  ILE  62          3HD1      ILE  62  -4.753  -1.909   4.066
  423   2HD1  ILE  62          2HD1      ILE  62  -4.843  -1.621   2.329
  424   3HD1  ILE  62          1HD1      ILE  62  -4.004  -0.473   3.371
  425    MG   ILE  62           QG2      ILE  62  -6.698  -1.396   6.046
  426    MD   ILE  62           QD1      ILE  62  -4.534  -1.334   3.255
  427    QG   ILE  62           QG1      ILE  62  -6.565  -0.267   3.055
  428    H    GLN  63           H        GLN  63  -5.786   2.380   6.731
  429    HA   GLN  63           HA       GLN  63  -7.039   1.592   9.223
  430   1HB   GLN  63          2HB       GLN  63  -5.442   4.031   8.389
  431   2HB   GLN  63          1HB       GLN  63  -5.768   3.594  10.067
  432   1HG   GLN  63          2HG       GLN  63  -4.634   1.448   9.762
  433   2HG   GLN  63          1HG       GLN  63  -4.361   1.813   8.057
  434   1HE2  GLN  63          1HE2      GLN  63  -2.153   1.264   9.785
  435   2HE2  GLN  63          2HE2      GLN  63  -1.237   2.799  10.005
  436    QB   GLN  63           QB       GLN  63  -5.605   3.813   9.228
  437    QG   GLN  63           QG       GLN  63  -4.497   1.630   8.909
  438    QE   GLN  63           QE2      GLN  63  -1.695   2.032   9.895
  439    H    ARG  64           H        ARG  64  -7.601   4.411   7.075
  440    HA   ARG  64           HA       ARG  64  -9.476   5.744   8.882
  441   1HB   ARG  64          2HB       ARG  64  -8.267   6.710   6.918
  442   2HB   ARG  64          1HB       ARG  64  -9.289   5.745   5.852
  443   1HG   ARG  64          2HG       ARG  64 -11.297   6.850   6.839
  444   2HG   ARG  64          1HG       ARG  64 -10.226   7.881   7.789
  445   1HD   ARG  64          2HD       ARG  64 -10.259   7.721   4.751
  446   2HD   ARG  64          1HD       ARG  64 -10.922   9.049   5.725
  447    HE   ARG  64           HE       ARG  64  -8.447   9.084   6.769
  448   1HH1  ARG  64          1HH1      ARG  64  -7.566  10.928   5.333
  449   2HH1  ARG  64          2HH1      ARG  64  -6.919  10.399   3.817
  450   1HH2  ARG  64          1HH2      ARG  64  -8.438   7.285   3.954
  451   2HH2  ARG  64          2HH2      ARG  64  -7.412   8.336   3.036
  452    QB   ARG  64           QB       ARG  64  -8.778   6.227   6.385
  453    QG   ARG  64           QG       ARG  64 -10.761   7.365   7.314
  454    QD   ARG  64           QD       ARG  64 -10.591   8.385   5.238
  455    QH1  ARG  64           QH1      ARG  64  -7.243  10.663   4.575
  456    QH2  ARG  64           QH2      ARG  64  -7.925   7.810   3.495
  457    H    LYS  65           H        LYS  65 -10.021   3.653   5.987
  458    HA   LYS  65           HA       LYS  65 -12.891   3.533   6.215
  459   1HB   LYS  65          2HB       LYS  65 -10.801   1.546   5.273
  460   2HB   LYS  65          1HB       LYS  65 -12.527   1.373   4.950
  461   1HG   LYS  65          2HG       LYS  65 -12.509   3.615   3.854
  462   2HG   LYS  65          1HG       LYS  65 -10.764   3.688   4.095
  463   1HD   LYS  65          2HD       LYS  65 -10.536   1.577   2.779
  464   2HD   LYS  65          1HD       LYS  65 -12.269   1.627   2.458
  465   1HE   LYS  65          2HE       LYS  65 -11.729   2.878   0.630
  466   2HE   LYS  65          1HE       LYS  65 -11.402   4.194   1.776
  467   1HZ   LYS  65          3HZ       LYS  65  -9.152   3.344   2.052
  468   2HZ   LYS  65          2HZ       LYS  65  -9.461   2.104   0.933
  469   3HZ   LYS  65          1HZ       LYS  65  -9.447   3.724   0.426
  470    QB   LYS  65           QB       LYS  65 -11.664   1.459   5.112
  471    QD   LYS  65           QD       LYS  65 -11.403   1.602   2.618
  472    QG   LYS  65           QG       LYS  65 -11.637   3.652   3.975
  473    QE   LYS  65           QE       LYS  65 -11.565   3.536   1.203
  474    QZ   LYS  65           QZ       LYS  65  -9.353   3.057   1.137
  475    H    ARG  66           H        ARG  66 -10.402   1.288   7.568
  476    HA   ARG  66           HA       ARG  66 -12.254  -0.422   8.981
  477   1HB   ARG  66          2HB       ARG  66  -9.416   0.499   9.531
  478   2HB   ARG  66          1HB       ARG  66 -10.189  -0.823  10.406
  479   1HG   ARG  66          2HG       ARG  66 -10.552  -2.028   8.289
  480   2HG   ARG  66          1HG       ARG  66  -9.803  -0.702   7.400
  481   1HD   ARG  66          2HD       ARG  66  -8.108  -2.413   7.715
  482   2HD   ARG  66          1HD       ARG  66  -7.715  -1.079   8.819
  483    HE   ARG  66           HE       ARG  66  -9.517  -2.780  10.258
  484   1HH1  ARG  66          1HH1      ARG  66  -8.686  -5.218   9.994
  485   2HH1  ARG  66          2HH1      ARG  66  -7.048  -5.404  10.524
  486   1HH2  ARG  66          1HH2      ARG  66  -6.338  -2.013  10.382
  487   2HH2  ARG  66          2HH2      ARG  66  -5.718  -3.590  10.743
  488    QB   ARG  66           QB       ARG  66  -9.803  -0.162   9.968
  489    QG   ARG  66           QG       ARG  66 -10.177  -1.365   7.845
  490    QD   ARG  66           QD       ARG  66  -7.912  -1.746   8.267
  491    QH1  ARG  66           QH1      ARG  66  -7.867  -5.311  10.259
  492    QH2  ARG  66           QH2      ARG  66  -6.028  -2.801  10.562
  493    H    GLN  67           H        GLN  67 -10.728   2.686   9.905
  494    HA   GLN  67           HA       GLN  67 -12.898   3.082  11.944
  495   1HB   GLN  67          2HB       GLN  67 -11.148   1.664  13.039
  496   2HB   GLN  67          1HB       GLN  67  -9.964   2.929  12.710
  497   1HG   GLN  67          2HG       GLN  67 -11.272   4.524  14.051
  498   2HG   GLN  67          1HG       GLN  67 -12.482   3.279  14.364
  499   1HE2  GLN  67          1HE2      GLN  67 -11.357   4.370  16.627
  500   2HE2  GLN  67          2HE2      GLN  67 -10.165   3.220  17.332
  501    QB   GLN  67           QB       GLN  67 -10.556   2.296  12.875
  502    QG   GLN  67           QG       GLN  67 -11.877   3.902  14.208
  503    QE   GLN  67           QE2      GLN  67 -10.761   3.795  16.980
  504    H    ALA  68           H        ALA  68 -13.102   5.302  12.559
  505    HA   ALA  68           HA       ALA  68 -11.000   7.221  11.614
  506   1HB   ALA  68          3HB       ALA  68 -13.363   6.465  10.062
  507   2HB   ALA  68          1HB       ALA  68 -11.941   7.376   9.556
  508   3HB   ALA  68          2HB       ALA  68 -13.279   8.203  10.354
  509    MB   ALA  68           QB       ALA  68 -12.861   7.348   9.991
  510    H    ASP  69           H        ASP  69 -11.851   9.576  11.972
  511    HA   ASP  69           HA       ASP  69 -13.901   9.596  14.224
  512   1HB   ASP  69          2HB       ASP  69 -12.339  10.913  15.577
  513   2HB   ASP  69          1HB       ASP  69 -11.571   9.393  15.115
  514    QB   ASP  69           QB       ASP  69 -11.955  10.153  15.346

  No H/Q in entry =         514
  Start of MODEL    3
    1    H    THR  24           H        THR  24 -18.005  -3.528   3.716
    2    HA   THR  24           HA       THR  24 -16.405  -5.295   3.483
    3    HB   THR  24           HB       THR  24 -15.233  -4.151   1.039
    4    HG1  THR  24          1HG       THR  24 -17.721  -4.641   0.369
    5   1HG2  THR  24          1HG2      THR  24 -15.519  -6.615   1.884
    6   2HG2  THR  24          3HG2      THR  24 -17.141  -6.465   1.207
    7   3HG2  THR  24          2HG2      THR  24 -15.729  -6.261   0.169
    8    MG   THR  24           QG2      THR  24 -16.129  -6.447   1.087
    9    HA   PRO  25           HA       PRO  25 -12.896  -2.732   4.987
   10   1HB   PRO  25          2HB       PRO  25 -12.594  -4.032   7.367
   11   2HB   PRO  25          1HB       PRO  25 -13.752  -2.705   7.139
   12   1HG   PRO  25          2HG       PRO  25 -14.226  -5.636   7.230
   13   2HG   PRO  25          1HG       PRO  25 -15.232  -4.307   7.828
   14   1HD   PRO  25          2HD       PRO  25 -15.668  -5.672   5.469
   15   2HD   PRO  25          1HD       PRO  25 -16.275  -4.039   5.823
   16    QB   PRO  25           QB       PRO  25 -13.173  -3.369   7.253
   17    QG   PRO  25           QG       PRO  25 -14.729  -4.971   7.529
   18    QD   PRO  25           QD       PRO  25 -15.971  -4.856   5.646
   19    H    VAL  26           H        VAL  26 -13.331  -6.267   5.569
   20    HA   VAL  26           HA       VAL  26 -10.544  -6.976   5.509
   21    HB   VAL  26           HB       VAL  26 -12.634  -8.322   6.089
   22   1HG1  VAL  26          3HG1      VAL  26 -13.795  -7.784   3.926
   23   2HG1  VAL  26          2HG1      VAL  26 -12.633  -8.821   3.097
   24   3HG1  VAL  26          1HG1      VAL  26 -13.742  -9.510   4.284
   25   1HG2  VAL  26          3HG2      VAL  26 -10.173  -9.182   4.745
   26   2HG2  VAL  26          2HG2      VAL  26 -10.945  -9.833   6.190
   27   3HG2  VAL  26          1HG2      VAL  26 -11.482 -10.355   4.593
   28    MG1  VAL  26           QG1      VAL  26 -13.390  -8.705   3.769
   29    MG2  VAL  26           QG2      VAL  26 -10.867  -9.790   5.176
   30    QG   VAL  26           QQG      VAL  26 -12.128  -9.248   4.472
   31    H    LEU  27           H        LEU  27 -12.832  -6.327   2.857
   32    HA   LEU  27           HA       LEU  27 -11.319  -7.460   0.680
   33   1HB   LEU  27          2HB       LEU  27 -13.656  -6.219   0.962
   34   2HB   LEU  27          1HB       LEU  27 -12.721  -4.822   0.429
   35    HG   LEU  27           HG       LEU  27 -13.691  -5.905  -1.521
   36   1HD1  LEU  27          2HD1      LEU  27 -11.210  -5.086  -1.438
   37   2HD1  LEU  27          1HD1      LEU  27 -10.817  -6.802  -1.525
   38   3HD1  LEU  27          3HD1      LEU  27 -11.741  -6.043  -2.821
   39   1HD2  LEU  27          3HD2      LEU  27 -13.034  -8.282  -0.023
   40   2HD2  LEU  27          2HD2      LEU  27 -14.044  -8.131  -1.461
   41   3HD2  LEU  27          1HD2      LEU  27 -12.305  -8.375  -1.627
   42    MD1  LEU  27           QD1      LEU  27 -11.256  -5.977  -1.928
   43    MD2  LEU  27           QD2      LEU  27 -13.128  -8.263  -1.037
   44    QB   LEU  27           QB       LEU  27 -13.188  -5.521   0.695
   45    QD   LEU  27           QQD      LEU  27 -12.192  -7.120  -1.482
   46    H    VAL  28           H        VAL  28 -11.030  -4.300   2.333
   47    HA   VAL  28           HA       VAL  28  -9.125  -3.108   0.504
   48    HB   VAL  28           HB       VAL  28  -9.594  -2.870   3.491
   49   1HG1  VAL  28          3HG1      VAL  28  -7.544  -1.708   1.826
   50   2HG1  VAL  28          2HG1      VAL  28  -8.633  -0.443   2.400
   51   3HG1  VAL  28          1HG1      VAL  28  -7.814  -1.495   3.556
   52   1HG2  VAL  28          1HG2      VAL  28 -11.205  -2.226   1.304
   53   2HG2  VAL  28          3HG2      VAL  28 -11.379  -1.598   2.942
   54   3HG2  VAL  28          2HG2      VAL  28 -10.451  -0.693   1.745
   55    MG1  VAL  28           QG1      VAL  28  -7.997  -1.215   2.594
   56    MG2  VAL  28           QG2      VAL  28 -11.012  -1.506   1.997
   57    QG   VAL  28           QQG      VAL  28  -9.504  -1.360   2.296
   58    H    ILE  29           H        ILE  29  -8.627  -5.114   3.457
   59    HA   ILE  29           HA       ILE  29  -5.709  -5.003   3.341
   60    HB   ILE  29           HB       ILE  29  -7.655  -7.062   4.433
   61   1HG1  ILE  29          2HG1      ILE  29  -6.258  -4.757   5.826
   62   2HG1  ILE  29          1HG1      ILE  29  -7.919  -4.683   5.233
   63   1HG2  ILE  29          3HG2      ILE  29  -4.693  -6.710   4.635
   64   2HG2  ILE  29          2HG2      ILE  29  -5.561  -7.234   6.078
   65   3HG2  ILE  29          1HG2      ILE  29  -5.645  -8.193   4.601
   66   1HD1  ILE  29          1HD1      ILE  29  -8.335  -6.804   6.626
   67   2HD1  ILE  29          3HD1      ILE  29  -6.792  -6.454   7.407
   68   3HD1  ILE  29          2HD1      ILE  29  -8.120  -5.299   7.519
   69    MG   ILE  29           QG2      ILE  29  -5.300  -7.379   5.105
   70    MD   ILE  29           QD1      ILE  29  -7.749  -6.185   7.184
   71    QG   ILE  29           QG1      ILE  29  -7.088  -4.720   5.530
   72    H    LEU  30           H        LEU  30  -8.136  -7.214   1.915
   73    HA   LEU  30           HA       LEU  30  -6.247  -9.208   0.961
   74   1HB   LEU  30          2HB       LEU  30  -8.758  -9.317   1.149
   75   2HB   LEU  30          1HB       LEU  30  -8.858  -8.275  -0.271
   76    HG   LEU  30           HG       LEU  30  -7.190 -10.765  -0.402
   77   1HD1  LEU  30          1HD1      LEU  30  -9.454 -11.370   0.539
   78   2HD1  LEU  30          3HD1      LEU  30 -10.175 -10.693  -0.921
   79   3HD1  LEU  30          2HD1      LEU  30  -9.108 -12.093  -1.031
   80   1HD2  LEU  30          2HD2      LEU  30  -8.177  -8.708  -2.177
   81   2HD2  LEU  30          1HD2      LEU  30  -7.017  -9.994  -2.514
   82   3HD2  LEU  30          3HD2      LEU  30  -8.745 -10.289  -2.716
   83    MD1  LEU  30           QD1      LEU  30  -9.579 -11.385  -0.471
   84    MD2  LEU  30           QD2      LEU  30  -7.980  -9.664  -2.469
   85    QB   LEU  30           QB       LEU  30  -8.808  -8.796   0.439
   86    QD   LEU  30           QQD      LEU  30  -8.779 -10.525  -1.470
   87    H    LEU  31           H        LEU  31  -7.583  -6.246  -0.589
   88    HA   LEU  31           HA       LEU  31  -6.266  -6.636  -3.152
   89   1HB   LEU  31          2HB       LEU  31  -8.126  -5.057  -2.514
   90   2HB   LEU  31          1HB       LEU  31  -6.923  -4.056  -1.700
   91    HG   LEU  31           HG       LEU  31  -6.455  -4.864  -4.550
   92   1HD1  LEU  31          3HD1      LEU  31  -8.800  -3.961  -4.377
   93   2HD1  LEU  31          2HD1      LEU  31  -8.122  -2.473  -3.716
   94   3HD1  LEU  31          1HD1      LEU  31  -7.725  -2.969  -5.361
   95   1HD2  LEU  31          3HD2      LEU  31  -5.574  -2.757  -2.622
   96   2HD2  LEU  31          2HD2      LEU  31  -4.624  -3.678  -3.789
   97   3HD2  LEU  31          1HD2      LEU  31  -5.623  -2.329  -4.332
   98    MD1  LEU  31           QD1      LEU  31  -8.216  -3.134  -4.485
   99    MD2  LEU  31           QD2      LEU  31  -5.274  -2.921  -3.581
  100    QB   LEU  31           QB       LEU  31  -7.524  -4.557  -2.107
  101    QD   LEU  31           QQD      LEU  31  -6.745  -3.028  -4.033
  102    H    GLY  32           H        GLY  32  -5.231  -4.894  -0.175
  103   1HA   GLY  32          1HA       GLY  32  -3.056  -4.128   0.393
  104   2HA   GLY  32          2HA       GLY  32  -2.730  -3.937  -1.331
  105    QA   GLY  32           QA       GLY  32  -2.893  -4.032  -0.469
  106    H    VAL  33           H        VAL  33  -3.647  -6.943   0.358
  107    HA   VAL  33           HA       VAL  33  -0.999  -8.022   0.736
  108    HB   VAL  33           HB       VAL  33  -3.692  -9.266   0.098
  109   1HG1  VAL  33          1HG1      VAL  33  -1.032 -10.482   0.754
  110   2HG1  VAL  33          3HG1      VAL  33  -2.488 -11.228   1.413
  111   3HG1  VAL  33          2HG1      VAL  33  -2.292 -11.066  -0.333
  112   1HG2  VAL  33          2HG2      VAL  33  -2.909  -7.826   2.289
  113   2HG2  VAL  33          1HG2      VAL  33  -4.135  -9.094   2.330
  114   3HG2  VAL  33          3HG2      VAL  33  -2.471  -9.460   2.785
  115    MG1  VAL  33           QG1      VAL  33  -1.937 -10.925   0.611
  116    MG2  VAL  33           QG2      VAL  33  -3.172  -8.793   2.468
  117    QG   VAL  33           QQG      VAL  33  -2.554  -9.859   1.540
  118    H    VAL  34           H        VAL  34  -3.247  -8.332  -2.058
  119    HA   VAL  34           HA       VAL  34  -1.547 -10.007  -3.683
  120    HB   VAL  34           HB       VAL  34  -3.559  -7.835  -4.331
  121   1HG1  VAL  34          1HG1      VAL  34  -2.080  -9.795  -6.057
  122   2HG1  VAL  34          3HG1      VAL  34  -3.745  -9.378  -6.463
  123   3HG1  VAL  34          2HG1      VAL  34  -2.513  -8.119  -6.393
  124   1HG2  VAL  34          3HG2      VAL  34  -3.681 -10.650  -3.463
  125   2HG2  VAL  34          2HG2      VAL  34  -4.910  -9.389  -3.366
  126   3HG2  VAL  34          1HG2      VAL  34  -4.685 -10.287  -4.867
  127    MG1  VAL  34           QG1      VAL  34  -2.779  -9.097  -6.304
  128    MG2  VAL  34           QG2      VAL  34  -4.426 -10.109  -3.899
  129    QG   VAL  34           QQG      VAL  34  -3.602  -9.603  -5.102
  130    H    GLY  35           H        GLY  35  -1.684  -6.428  -3.361
  131   1HA   GLY  35          1HA       GLY  35  -0.093  -4.831  -4.104
  132   2HA   GLY  35          2HA       GLY  35   0.185  -5.873  -5.501
  133    QA   GLY  35           QA       GLY  35   0.046  -5.352  -4.802
  134    H    LEU  36           H        LEU  36   0.720  -6.615  -2.029
  135    HA   LEU  36           HA       LEU  36   3.571  -6.132  -2.005
  136   1HB   LEU  36          2HB       LEU  36   1.834  -8.167  -0.571
  137   2HB   LEU  36          1HB       LEU  36   3.465  -7.716  -0.072
  138    HG   LEU  36           HG       LEU  36   1.074  -5.862  -0.262
  139   1HD1  LEU  36          1HD1      LEU  36   2.661  -6.983   2.065
  140   2HD1  LEU  36          3HD1      LEU  36   1.495  -5.668   2.214
  141   3HD1  LEU  36          2HD1      LEU  36   0.958  -7.270   1.705
  142   1HD2  LEU  36          3HD2      LEU  36   4.014  -5.411   0.100
  143   2HD2  LEU  36          2HD2      LEU  36   2.830  -4.427  -0.760
  144   3HD2  LEU  36          1HD2      LEU  36   2.895  -4.389   1.002
  145    MD1  LEU  36           QD1      LEU  36   1.705  -6.640   1.995
  146    MD2  LEU  36           QD2      LEU  36   3.246  -4.742   0.114
  147    QB   LEU  36           QB       LEU  36   2.650  -7.942  -0.321
  148    QD   LEU  36           QQD      LEU  36   2.475  -5.691   1.054
  149    H    SER  37           H        SER  37   1.683  -9.025  -2.966
  150    HA   SER  37           HA       SER  37   3.902 -10.843  -3.277
  151   1HB   SER  37          2HB       SER  37   1.423 -11.280  -3.345
  152   2HB   SER  37          1HB       SER  37   1.391 -10.580  -4.960
  153    HG   SER  37           HG       SER  37   2.436 -12.999  -4.057
  154    QB   SER  37           QB       SER  37   1.407 -10.930  -4.153
  155    H    ALA  38           H        ALA  38   2.368  -8.674  -5.734
  156    HA   ALA  38           HA       ALA  38   4.125  -9.306  -7.916
  157   1HB   ALA  38          1HB       ALA  38   2.095  -7.914  -8.011
  158   2HB   ALA  38          2HB       ALA  38   3.468  -7.036  -8.685
  159   3HB   ALA  38          3HB       ALA  38   2.897  -6.664  -7.058
  160    MB   ALA  38           QB       ALA  38   2.820  -7.205  -7.918
  161    H    LEU  39           H        LEU  39   4.620  -7.154  -5.112
  162    HA   LEU  39           HA       LEU  39   7.396  -6.522  -6.202
  163   1HB   LEU  39          2HB       LEU  39   5.741  -5.252  -3.999
  164   2HB   LEU  39          1HB       LEU  39   7.244  -4.616  -4.669
  165    HG   LEU  39           HG       LEU  39   4.636  -5.008  -6.164
  166   1HD1  LEU  39          1HD1      LEU  39   4.952  -3.030  -4.534
  167   2HD1  LEU  39          3HD1      LEU  39   6.145  -2.436  -5.690
  168   3HD1  LEU  39          2HD1      LEU  39   4.464  -2.646  -6.185
  169   1HD2  LEU  39          3HD2      LEU  39   7.436  -4.611  -7.034
  170   2HD2  LEU  39          2HD2      LEU  39   6.064  -5.267  -7.926
  171   3HD2  LEU  39          1HD2      LEU  39   6.267  -3.521  -7.780
  172    MD1  LEU  39           QD1      LEU  39   5.187  -2.704  -5.470
  173    MD2  LEU  39           QD2      LEU  39   6.589  -4.466  -7.580
  174    QB   LEU  39           QB       LEU  39   6.492  -4.934  -4.334
  175    QD   LEU  39           QQD      LEU  39   5.888  -3.585  -6.525
  176    H    THR  40           H        THR  40   8.711  -8.229  -5.507
  177    HA   THR  40           HA       THR  40   8.818  -8.560  -2.479
  178    HB   THR  40           HB       THR  40   9.072 -11.027  -2.952
  179    HG1  THR  40          1HG       THR  40   9.573 -11.244  -5.014
  180   1HG2  THR  40          2HG2      THR  40   6.528  -9.680  -3.900
  181   2HG2  THR  40          1HG2      THR  40   6.660 -11.379  -3.447
  182   3HG2  THR  40          3HG2      THR  40   6.917 -10.121  -2.237
  183    MG   THR  40           QG2      THR  40   6.702 -10.393  -3.195
  184    H    GLY  41           H        GLY  41  10.538  -6.979  -4.284
  185   1HA   GLY  41          1HA       GLY  41  12.827  -7.909  -5.350
  186   2HA   GLY  41          2HA       GLY  41  13.099  -8.488  -3.705
  187    QA   GLY  41           QA       GLY  41  12.963  -8.198  -4.527
  188    H    TYR  42           H        TYR  42  14.908  -7.130  -3.317
  189    HA   TYR  42           HA       TYR  42  14.284  -4.487  -2.273
  190   1HB   TYR  42          2HB       TYR  42  16.863  -5.785  -3.209
  191   2HB   TYR  42          1HB       TYR  42  16.781  -4.333  -2.210
  192    HD1  TYR  42          1HD       TYR  42  16.606  -7.950  -2.254
  193    HD2  TYR  42          2HD       TYR  42  15.645  -4.457   0.055
  194    HE1  TYR  42          1HE       TYR  42  16.373  -9.356  -0.224
  195    HE2  TYR  42          2HE       TYR  42  15.413  -5.863   2.084
  196    HH   TYR  42           HH       TYR  42  15.538  -9.376   1.911
  197    QB   TYR  42           QB       TYR  42  16.822  -5.059  -2.709
  198    QD   TYR  42           QD       TYR  42  16.126  -6.204  -1.099
  199    QE   TYR  42           QE       TYR  42  15.893  -7.609   0.930
  200    QR   TYR  42           QR       TYR  42  16.009  -6.907  -0.085
  201    H    LEU  43           H        LEU  43  15.461  -2.436  -3.064
  202    HA   LEU  43           HA       LEU  43  16.086  -2.203  -5.928
  203   1HB   LEU  43          2HB       LEU  43  13.635  -2.701  -5.993
  204   2HB   LEU  43          1HB       LEU  43  13.348  -1.266  -5.010
  205    HG   LEU  43           HG       LEU  43  14.583   0.053  -6.815
  206   1HD1  LEU  43          1HD1      LEU  43  14.414  -2.671  -8.063
  207   2HD1  LEU  43          3HD1      LEU  43  14.286  -1.248  -9.097
  208   3HD1  LEU  43          2HD1      LEU  43  15.731  -1.498  -8.118
  209   1HD2  LEU  43          1HD2      LEU  43  11.889  -1.063  -6.800
  210   2HD2  LEU  43          3HD2      LEU  43  12.416   0.575  -7.186
  211   3HD2  LEU  43          2HD2      LEU  43  12.422  -0.671  -8.434
  212    MD1  LEU  43           QD1      LEU  43  14.810  -1.806  -8.426
  213    MD2  LEU  43           QD2      LEU  43  12.242  -0.387  -7.473
  214    QB   LEU  43           QB       LEU  43  13.492  -1.983  -5.502
  215    QD   LEU  43           QQD      LEU  43  13.526  -1.096  -7.950
  216    H    ASP  44           H        ASP  44  17.350  -0.382  -6.092
  217    HA   ASP  44           HA       ASP  44  17.643   1.430  -3.811
  218   1HB   ASP  44          2HB       ASP  44  19.148   0.756  -5.877
  219   2HB   ASP  44          1HB       ASP  44  18.362   2.138  -6.641
  220    QB   ASP  44           QB       ASP  44  18.755   1.447  -6.259
  221    H    TYR  45           H        TYR  45  17.569   3.980  -4.452
  222    HA   TYR  45           HA       TYR  45  14.642   4.433  -5.126
  223   1HB   TYR  45          2HB       TYR  45  14.891   6.380  -3.788
  224   2HB   TYR  45          1HB       TYR  45  15.883   5.171  -2.975
  225    HD1  TYR  45          1HD       TYR  45  15.892   8.254  -4.959
  226    HD2  TYR  45          2HD       TYR  45  18.344   5.219  -3.161
  227    HE1  TYR  45          1HE       TYR  45  17.887   9.700  -5.238
  228    HE2  TYR  45          2HE       TYR  45  20.339   6.665  -3.441
  229    HH   TYR  45           HH       TYR  45  20.362   9.402  -5.417
  230    QB   TYR  45           QB       TYR  45  15.387   5.776  -3.382
  231    QD   TYR  45           QD       TYR  45  17.118   6.736  -4.060
  232    QE   TYR  45           QE       TYR  45  19.113   8.182  -4.340
  233    QR   TYR  45           QR       TYR  45  18.115   7.459  -4.200
  234    H    VAL  46           H        VAL  46  14.080   5.315  -7.071
  235    HA   VAL  46           HA       VAL  46  16.316   6.339  -8.821
  236    HB   VAL  46           HB       VAL  46  14.289   4.723  -9.334
  237   1HG1  VAL  46          2HG1      VAL  46  12.809   6.824  -8.538
  238   2HG1  VAL  46          1HG1      VAL  46  12.947   7.221 -10.251
  239   3HG1  VAL  46          3HG1      VAL  46  12.241   5.682  -9.757
  240   1HG2  VAL  46          1HG2      VAL  46  15.914   6.489 -10.882
  241   2HG2  VAL  46          3HG2      VAL  46  15.162   4.979 -11.395
  242   3HG2  VAL  46          2HG2      VAL  46  14.295   6.503 -11.582
  243    MG1  VAL  46           QG1      VAL  46  12.665   6.576  -9.515
  244    MG2  VAL  46           QG2      VAL  46  15.124   5.990 -11.286
  245    QG   VAL  46           QQG      VAL  46  13.895   6.283 -10.401
  246    H    LEU  47           H        LEU  47  14.672   8.118 -10.390
  247    HA   LEU  47           HA       LEU  47  15.149  10.601  -8.967
  248   1HB   LEU  47          2HB       LEU  47  13.307   9.871 -11.268
  249   2HB   LEU  47          1HB       LEU  47  13.780  11.518 -10.853
  250    HG   LEU  47           HG       LEU  47  15.657   9.275 -11.655
  251   1HD1  LEU  47          1HD1      LEU  47  14.125  10.596 -13.363
  252   2HD1  LEU  47          3HD1      LEU  47  15.322  11.868 -13.121
  253   3HD1  LEU  47          2HD1      LEU  47  15.822  10.293 -13.738
  254   1HD2  LEU  47          1HD2      LEU  47  16.084  12.086 -10.650
  255   2HD2  LEU  47          3HD2      LEU  47  16.897  10.601 -10.153
  256   3HD2  LEU  47          2HD2      LEU  47  17.266  11.327 -11.717
  257    MD1  LEU  47           QD1      LEU  47  15.090  10.919 -13.407
  258    MD2  LEU  47           QD2      LEU  47  16.749  11.338 -10.840
  259    QB   LEU  47           QB       LEU  47  13.544  10.694 -11.060
  260    QD   LEU  47           QQD      LEU  47  15.919  11.129 -12.124
  261    H    LEU  48           H        LEU  48  12.122   8.724  -9.506
  262    HA   LEU  48           HA       LEU  48  10.910  10.366  -7.230
  263   1HB   LEU  48          2HB       LEU  48  10.224  10.224  -9.978
  264   2HB   LEU  48          1HB       LEU  48   8.972   9.339  -9.105
  265    HG   LEU  48           HG       LEU  48   8.339  11.688  -9.230
  266   1HD1  LEU  48          1HD1      LEU  48   8.608  10.195  -6.860
  267   2HD1  LEU  48          3HD1      LEU  48   9.143  11.824  -6.449
  268   3HD1  LEU  48          2HD1      LEU  48   7.536  11.569  -7.128
  269   1HD2  LEU  48          1HD2      LEU  48  11.082  12.140  -9.070
  270   2HD2  LEU  48          3HD2      LEU  48   9.830  13.381  -9.022
  271   3HD2  LEU  48          2HD2      LEU  48  10.476  12.722  -7.519
  272    MD1  LEU  48           QD1      LEU  48   8.429  11.196  -6.813
  273    MD2  LEU  48           QD2      LEU  48  10.463  12.747  -8.537
  274    QB   LEU  48           QB       LEU  48   9.598   9.781  -9.541
  275    QD   LEU  48           QQD      LEU  48   9.446  11.972  -7.675
  276    HA   PRO  49           HA       PRO  49  10.597   6.112  -5.775
  277   1HB   PRO  49          2HB       PRO  49   9.885   6.791  -3.219
  278   2HB   PRO  49          1HB       PRO  49  11.565   6.821  -3.793
  279   1HG   PRO  49          2HG       PRO  49   9.635   9.072  -3.479
  280   2HG   PRO  49          1HG       PRO  49  11.363   9.008  -3.095
  281   1HD   PRO  49          2HD       PRO  49  10.404  10.187  -5.338
  282   2HD   PRO  49          1HD       PRO  49  11.998   9.401  -5.270
  283    QB   PRO  49           QB       PRO  49  10.725   6.806  -3.506
  284    QG   PRO  49           QG       PRO  49  10.499   9.040  -3.287
  285    QD   PRO  49           QD       PRO  49  11.201   9.794  -5.304
  286    H    ALA  50           H        ALA  50   8.615   6.522  -7.418
  287    HA   ALA  50           HA       ALA  50   6.023   7.238  -6.328
  288   1HB   ALA  50          2HB       ALA  50   6.656   5.175  -8.458
  289   2HB   ALA  50          1HB       ALA  50   5.223   6.197  -8.352
  290   3HB   ALA  50          3HB       ALA  50   6.790   6.912  -8.732
  291    MB   ALA  50           QB       ALA  50   6.223   6.095  -8.514
  292    H    LEU  51           H        LEU  51   7.900   4.216  -6.244
  293    HA   LEU  51           HA       LEU  51   5.699   2.479  -5.412
  294   1HB   LEU  51          2HB       LEU  51   8.692   2.394  -4.894
  295   2HB   LEU  51          1HB       LEU  51   7.596   1.022  -4.729
  296    HG   LEU  51           HG       LEU  51   8.182   2.561  -7.276
  297   1HD1  LEU  51          2HD1      LEU  51   9.445   0.337  -6.029
  298   2HD1  LEU  51          1HD1      LEU  51   8.564  -0.279  -7.426
  299   3HD1  LEU  51          3HD1      LEU  51   9.760   0.999  -7.633
  300   1HD2  LEU  51          3HD2      LEU  51   6.017   0.679  -6.490
  301   2HD2  LEU  51          2HD2      LEU  51   6.016   1.945  -7.719
  302   3HD2  LEU  51          1HD2      LEU  51   6.769   0.386  -8.058
  303    MD1  LEU  51           QD1      LEU  51   9.256   0.352  -7.030
  304    MD2  LEU  51           QD2      LEU  51   6.267   1.003  -7.422
  305    QB   LEU  51           QB       LEU  51   8.144   1.708  -4.812
  306    QD   LEU  51           QQD      LEU  51   7.762   0.678  -7.226
  307    H    ALA  52           H        ALA  52   8.268   4.164  -3.512
  308    HA   ALA  52           HA       ALA  52   7.366   3.350  -0.906
  309   1HB   ALA  52          2HB       ALA  52   8.542   5.466  -0.229
  310   2HB   ALA  52          3HB       ALA  52   8.601   5.925  -1.931
  311   3HB   ALA  52          1HB       ALA  52   9.466   4.492  -1.373
  312    MB   ALA  52           QB       ALA  52   8.870   5.294  -1.177
  313    H    ILE  53           H        ILE  53   6.393   6.202  -2.881
  314    HA   ILE  53           HA       ILE  53   4.512   7.245  -0.902
  315    HB   ILE  53           HB       ILE  53   4.638   7.429  -3.931
  316   1HG1  ILE  53          2HG1      ILE  53   5.715   9.282  -1.782
  317   2HG1  ILE  53          1HG1      ILE  53   6.696   8.140  -2.700
  318   1HG2  ILE  53          3HG2      ILE  53   2.796   8.538  -1.952
  319   2HG2  ILE  53          2HG2      ILE  53   3.599   9.796  -2.892
  320   3HG2  ILE  53          1HG2      ILE  53   2.679   8.535  -3.712
  321   1HD1  ILE  53          1HD1      ILE  53   5.168   9.599  -4.590
  322   2HD1  ILE  53          3HD1      ILE  53   5.837  10.777  -3.461
  323   3HD1  ILE  53          2HD1      ILE  53   6.910   9.678  -4.326
  324    MG   ILE  53           QG2      ILE  53   3.024   8.956  -2.852
  325    MD   ILE  53           QD1      ILE  53   5.971  10.018  -4.126
  326    QG   ILE  53           QG1      ILE  53   6.206   8.711  -2.241
  327    H    PHE  54           H        PHE  54   4.099   5.074  -3.743
  328    HA   PHE  54           HA       PHE  54   1.248   4.795  -3.626
  329   1HB   PHE  54          2HB       PHE  54   2.826   3.930  -5.348
  330   2HB   PHE  54          1HB       PHE  54   3.370   2.702  -4.204
  331    HD1  PHE  54          1HD       PHE  54   0.549   3.859  -6.288
  332    HD2  PHE  54          2HD       PHE  54   1.970   0.808  -3.618
  333    HE1  PHE  54          1HE       PHE  54  -1.342   2.399  -6.950
  334    HE2  PHE  54          2HE       PHE  54   0.078  -0.653  -4.282
  335    HZ   PHE  54           HZ       PHE  54  -1.577   0.143  -5.948
  336    QB   PHE  54           QB       PHE  54   3.098   3.316  -4.776
  337    QD   PHE  54           QD       PHE  54   1.260   2.333  -4.953
  338    QE   PHE  54           QE       PHE  54  -0.632   0.873  -5.616
  339    QR   PHE  54           QR       PHE  54  -0.064   1.311  -5.417
  340    H    ILE  55           H        ILE  55   3.771   2.891  -1.882
  341    HA   ILE  55           HA       ILE  55   1.890   1.169  -0.479
  342    HB   ILE  55           HB       ILE  55   4.642   2.227   0.244
  343   1HG1  ILE  55          2HG1      ILE  55   4.599   1.088  -1.920
  344   2HG1  ILE  55          1HG1      ILE  55   5.381   0.047  -0.731
  345   1HG2  ILE  55          1HG2      ILE  55   2.850   0.158   1.453
  346   2HG2  ILE  55          3HG2      ILE  55   4.583  -0.171   1.401
  347   3HG2  ILE  55          2HG2      ILE  55   3.982   1.260   2.240
  348   1HD1  ILE  55          3HD1      ILE  55   2.733  -0.657  -0.458
  349   2HD1  ILE  55          2HD1      ILE  55   2.858  -0.349  -2.190
  350   3HD1  ILE  55          1HD1      ILE  55   3.915  -1.537  -1.427
  351    MG   ILE  55           QG2      ILE  55   3.805   0.416   1.698
  352    MD   ILE  55           QD1      ILE  55   3.169  -0.848  -1.358
  353    QG   ILE  55           QG1      ILE  55   4.990   0.567  -1.325
  354    H    GLY  56           H        GLY  56   3.417   4.296   0.449
  355   1HA   GLY  56          1HA       GLY  56   2.665   5.861   2.068
  356   2HA   GLY  56          2HA       GLY  56   2.304   4.467   3.086
  357    QA   GLY  56           QA       GLY  56   2.485   5.164   2.577
  358    H    LEU  57           H        LEU  57   0.904   5.731   0.003
  359    HA   LEU  57           HA       LEU  57  -1.621   6.541   1.192
  360   1HB   LEU  57          2HB       LEU  57  -0.703   7.138  -1.052
  361   2HB   LEU  57          1HB       LEU  57  -0.999   5.483  -1.585
  362    HG   LEU  57           HG       LEU  57  -3.432   5.834  -0.918
  363   1HD1  LEU  57          3HD1      LEU  57  -2.275   8.347  -0.063
  364   2HD1  LEU  57          2HD1      LEU  57  -3.556   8.631  -1.241
  365   3HD1  LEU  57          1HD1      LEU  57  -3.896   7.717   0.229
  366   1HD2  LEU  57          3HD2      LEU  57  -2.019   7.248  -3.159
  367   2HD2  LEU  57          2HD2      LEU  57  -3.119   5.871  -3.228
  368   3HD2  LEU  57          1HD2      LEU  57  -3.754   7.494  -2.955
  369    MD1  LEU  57           QD1      LEU  57  -3.242   8.232  -0.359
  370    MD2  LEU  57           QD2      LEU  57  -2.964   6.871  -3.114
  371    QB   LEU  57           QB       LEU  57  -0.851   6.311  -1.319
  372    QD   LEU  57           QQD      LEU  57  -3.103   7.551  -1.736
  373    H    THR  58           H        THR  58  -0.494   3.420  -0.155
  374    HA   THR  58           HA       THR  58  -3.090   2.094  -0.076
  375    HB   THR  58           HB       THR  58  -0.265   1.031   0.255
  376    HG1  THR  58          1HG       THR  58  -0.067   1.474  -1.771
  377   1HG2  THR  58          2HG2      THR  58  -2.797  -0.275   0.319
  378   2HG2  THR  58          1HG2      THR  58  -2.016  -0.694  -1.206
  379   3HG2  THR  58          3HG2      THR  58  -1.194  -1.011   0.321
  380    MG   THR  58           QG2      THR  58  -2.002  -0.660  -0.189
  381    H    ILE  59           H        ILE  59  -0.340   2.047   2.262
  382    HA   ILE  59           HA       ILE  59  -1.784   0.496   4.270
  383    HB   ILE  59           HB       ILE  59   0.496   2.488   4.464
  384   1HG1  ILE  59          2HG1      ILE  59   0.960   0.707   2.862
  385   2HG1  ILE  59          1HG1      ILE  59   1.879   0.397   4.336
  386   1HG2  ILE  59          1HG2      ILE  59  -0.851   0.750   6.426
  387   2HG2  ILE  59          3HG2      ILE  59   0.900   0.546   6.368
  388   3HG2  ILE  59          2HG2      ILE  59   0.208   2.135   6.691
  389   1HD1  ILE  59          1HD1      ILE  59  -0.082  -1.064   5.084
  390   2HD1  ILE  59          3HD1      ILE  59  -0.679  -0.938   3.430
  391   3HD1  ILE  59          2HD1      ILE  59   0.882  -1.692   3.748
  392    MG   ILE  59           QG2      ILE  59   0.086   1.144   6.495
  393    MD   ILE  59           QD1      ILE  59   0.040  -1.231   4.088
  394    QG   ILE  59           QG1      ILE  59   1.420   0.552   3.599
  395    H    TYR  60           H        TYR  60  -1.348   4.053   3.827
  396    HA   TYR  60           HA       TYR  60  -2.692   4.844   6.268
  397   1HB   TYR  60          2HB       TYR  60  -1.387   6.249   4.618
  398   2HB   TYR  60          1HB       TYR  60  -2.777   6.172   3.536
  399    HD1  TYR  60          1HD       TYR  60  -1.703   7.242   6.943
  400    HD2  TYR  60          2HD       TYR  60  -4.628   7.628   3.820
  401    HE1  TYR  60          1HE       TYR  60  -2.733   9.150   8.143
  402    HE2  TYR  60          2HE       TYR  60  -5.659   9.538   5.024
  403    HH   TYR  60           HH       TYR  60  -5.027  10.248   8.226
  404    QB   TYR  60           QB       TYR  60  -2.082   6.210   4.077
  405    QD   TYR  60           QD       TYR  60  -3.166   7.435   5.381
  406    QE   TYR  60           QE       TYR  60  -4.196   9.344   6.583
  407    QR   TYR  60           QR       TYR  60  -3.681   8.390   5.982
  408    H    ALA  61           H        ALA  61  -4.006   4.375   2.943
  409    HA   ALA  61           HA       ALA  61  -6.763   4.913   3.567
  410   1HB   ALA  61          1HB       ALA  61  -5.578   2.874   1.660
  411   2HB   ALA  61          2HB       ALA  61  -5.693   4.603   1.336
  412   3HB   ALA  61          3HB       ALA  61  -7.161   3.640   1.513
  413    MB   ALA  61           QB       ALA  61  -6.144   3.706   1.503
  414    H    ILE  62           H        ILE  62  -4.893   1.860   3.857
  415    HA   ILE  62           HA       ILE  62  -7.161   0.178   4.533
  416    HB   ILE  62           HB       ILE  62  -4.215   0.141   5.228
  417   1HG1  ILE  62          2HG1      ILE  62  -5.746  -1.563   3.255
  418   2HG1  ILE  62          1HG1      ILE  62  -5.071   0.002   2.803
  419   1HG2  ILE  62          3HG2      ILE  62  -6.403  -1.541   6.171
  420   2HG2  ILE  62          2HG2      ILE  62  -5.199  -2.475   5.282
  421   3HG2  ILE  62          1HG2      ILE  62  -4.716  -1.516   6.681
  422   1HD1  ILE  62          1HD1      ILE  62  -2.957  -1.193   4.106
  423   2HD1  ILE  62          3HD1      ILE  62  -3.707  -2.555   3.273
  424   3HD1  ILE  62          2HD1      ILE  62  -3.171  -1.147   2.356
  425    MG   ILE  62           QG2      ILE  62  -5.439  -1.844   6.045
  426    MD   ILE  62           QD1      ILE  62  -3.279  -1.632   3.245
  427    QG   ILE  62           QG1      ILE  62  -5.409  -0.781   3.029
  428    H    GLN  63           H        GLN  63  -4.905   2.049   6.638
  429    HA   GLN  63           HA       GLN  63  -6.017   1.189   9.160
  430   1HB   GLN  63          2HB       GLN  63  -3.939   2.533   8.691
  431   2HB   GLN  63          1HB       GLN  63  -4.974   3.931   8.393
  432   1HG   GLN  63          2HG       GLN  63  -5.924   3.674  10.684
  433   2HG   GLN  63          1HG       GLN  63  -4.789   2.356  10.976
  434   1HE2  GLN  63          1HE2      GLN  63  -2.882   2.954  11.995
  435   2HE2  GLN  63          2HE2      GLN  63  -2.168   4.604  11.888
  436    QB   GLN  63           QB       GLN  63  -4.457   3.232   8.542
  437    QG   GLN  63           QG       GLN  63  -5.356   3.015  10.830
  438    QE   GLN  63           QE2      GLN  63  -2.525   3.779  11.941
  439    H    ARG  64           H        ARG  64  -7.022   3.824   6.937
  440    HA   ARG  64           HA       ARG  64  -9.081   4.895   8.716
  441   1HB   ARG  64          2HB       ARG  64  -8.704   4.837   5.707
  442   2HB   ARG  64          1HB       ARG  64  -9.895   5.849   6.525
  443   1HG   ARG  64          2HG       ARG  64  -8.043   6.872   7.858
  444   2HG   ARG  64          1HG       ARG  64  -6.888   5.940   6.904
  445   1HD   ARG  64          2HD       ARG  64  -7.070   8.168   5.923
  446   2HD   ARG  64          1HD       ARG  64  -7.869   7.021   4.828
  447    HE   ARG  64           HE       ARG  64  -9.646   8.186   6.937
  448   1HH1  ARG  64          1HH1      ARG  64  -8.271  10.103   4.751
  449   2HH1  ARG  64          2HH1      ARG  64  -9.601  10.268   3.656
  450   1HH2  ARG  64          1HH2      ARG  64 -11.387   7.623   5.010
  451   2HH2  ARG  64          2HH2      ARG  64 -11.366   8.864   3.802
  452    QB   ARG  64           QB       ARG  64  -9.299   5.343   6.116
  453    QG   ARG  64           QG       ARG  64  -7.465   6.406   7.381
  454    QD   ARG  64           QD       ARG  64  -7.470   7.594   5.376
  455    QH1  ARG  64           QH1      ARG  64  -8.936  10.186   4.204
  456    QH2  ARG  64           QH2      ARG  64 -11.377   8.243   4.406
  457    H    LYS  65           H        LYS  65  -9.258   2.598   5.937
  458    HA   LYS  65           HA       LYS  65 -12.073   2.033   6.143
  459   1HB   LYS  65          2HB       LYS  65  -9.696   0.299   5.397
  460   2HB   LYS  65          1HB       LYS  65 -11.371  -0.093   5.010
  461   1HG   LYS  65          2HG       LYS  65  -9.958   2.448   4.148
  462   2HG   LYS  65          1HG       LYS  65 -10.194   1.034   3.120
  463   1HD   LYS  65          2HD       LYS  65 -12.675   1.257   3.518
  464   2HD   LYS  65          1HD       LYS  65 -12.346   2.785   4.337
  465   1HE   LYS  65          2HE       LYS  65 -11.213   2.350   1.586
  466   2HE   LYS  65          1HE       LYS  65 -12.919   2.806   1.760
  467   1HZ   LYS  65          1HZ       LYS  65 -11.200   4.260   3.528
  468   2HZ   LYS  65          3HZ       LYS  65 -10.797   4.519   1.901
  469   3HZ   LYS  65          2HZ       LYS  65 -12.373   4.842   2.444
  470    QB   LYS  65           QB       LYS  65 -10.533   0.103   5.203
  471    QD   LYS  65           QD       LYS  65 -12.510   2.021   3.928
  472    QG   LYS  65           QG       LYS  65 -10.076   1.741   3.634
  473    QE   LYS  65           QE       LYS  65 -12.066   2.578   1.673
  474    QZ   LYS  65           QZ       LYS  65 -11.457   4.540   2.624
  475    H    ARG  66           H        ARG  66  -9.304   0.259   7.649
  476    HA   ARG  66           HA       ARG  66 -10.877  -1.587   9.195
  477   1HB   ARG  66          2HB       ARG  66  -8.254  -0.154   9.716
  478   2HB   ARG  66          1HB       ARG  66  -8.819  -1.520  10.678
  479   1HG   ARG  66          2HG       ARG  66  -8.977  -2.869   8.568
  480   2HG   ARG  66          1HG       ARG  66  -8.248  -1.518   7.700
  481   1HD   ARG  66          2HD       ARG  66  -6.249  -1.662   9.178
  482   2HD   ARG  66          1HD       ARG  66  -6.973  -3.066   9.987
  483    HE   ARG  66           HE       ARG  66  -6.877  -3.277   7.005
  484   1HH1  ARG  66          1HH1      ARG  66  -6.569  -5.182   9.652
  485   2HH1  ARG  66          2HH1      ARG  66  -5.035  -5.888   9.267
  486   1HH2  ARG  66          1HH2      ARG  66  -4.327  -3.620   6.742
  487   2HH2  ARG  66          2HH2      ARG  66  -3.766  -5.004   7.620
  488    QB   ARG  66           QB       ARG  66  -8.537  -0.837  10.197
  489    QG   ARG  66           QG       ARG  66  -8.612  -2.193   8.134
  490    QD   ARG  66           QD       ARG  66  -6.611  -2.364   9.582
  491    QH1  ARG  66           QH1      ARG  66  -5.802  -5.535   9.460
  492    QH2  ARG  66           QH2      ARG  66  -4.046  -4.312   7.181
  493    H    GLN  67           H        GLN  67 -10.032   1.829   9.794
  494    HA   GLN  67           HA       GLN  67 -12.296   2.143  11.654
  495   1HB   GLN  67          2HB       GLN  67 -10.736   0.775  13.029
  496   2HB   GLN  67          1HB       GLN  67  -9.493   2.009  12.816
  497   1HG   GLN  67          2HG       GLN  67 -11.057   3.676  13.858
  498   2HG   GLN  67          1HG       GLN  67 -12.169   2.351  14.199
  499   1HE2  GLN  67          1HE2      GLN  67 -11.946   1.384  16.215
  500   2HE2  GLN  67          2HE2      GLN  67 -10.421   1.422  17.174
  501    QB   GLN  67           QB       GLN  67 -10.115   1.392  12.922
  502    QG   GLN  67           QG       GLN  67 -11.613   3.014  14.029
  503    QE   GLN  67           QE2      GLN  67 -11.183   1.403  16.694
  504    H    ALA  68           H        ALA  68 -12.777   4.330  11.831
  505    HA   ALA  68           HA       ALA  68 -11.060   6.193  10.282
  506   1HB   ALA  68          2HB       ALA  68 -13.485   6.572  12.068
  507   2HB   ALA  68          3HB       ALA  68 -13.521   6.264  10.331
  508   3HB   ALA  68          1HB       ALA  68 -12.856   7.777  10.944
  509    MB   ALA  68           QB       ALA  68 -13.287   6.871  11.114
  510    H    ASP  69           H        ASP  69  -9.454   7.518  11.044
  511    HA   ASP  69           HA       ASP  69  -8.661   7.312  13.886
  512   1HB   ASP  69          2HB       ASP  69  -6.952   8.948  13.129
  513   2HB   ASP  69          1HB       ASP  69  -7.110   7.612  11.989
  514    QB   ASP  69           QB       ASP  69  -7.031   8.280  12.559

  No H/Q in entry =         514
  Start of MODEL    4
    1    H    THR  24           H        THR  24 -16.207  -6.349   2.594
    2    HA   THR  24           HA       THR  24 -16.730  -4.441   4.915
    3    HB   THR  24           HB       THR  24 -15.015  -6.145   5.942
    4    HG1  THR  24          1HG       THR  24 -15.750  -8.192   4.587
    5   1HG2  THR  24          3HG2      THR  24 -17.843  -6.902   5.163
    6   2HG2  THR  24          2HG2      THR  24 -16.890  -7.737   6.390
    7   3HG2  THR  24          1HG2      THR  24 -17.346  -6.050   6.625
    8    MG   THR  24           QG2      THR  24 -17.360  -6.896   6.059
    9    HA   PRO  25           HA       PRO  25 -13.070  -2.196   4.027
   10   1HB   PRO  25          2HB       PRO  25 -12.012  -1.803   6.527
   11   2HB   PRO  25          1HB       PRO  25 -13.446  -0.943   5.930
   12   1HG   PRO  25          2HG       PRO  25 -13.269  -3.296   7.744
   13   2HG   PRO  25          1HG       PRO  25 -14.360  -1.903   7.804
   14   1HD   PRO  25          2HD       PRO  25 -15.112  -4.342   6.865
   15   2HD   PRO  25          1HD       PRO  25 -15.825  -2.815   6.295
   16    QB   PRO  25           QB       PRO  25 -12.729  -1.373   6.228
   17    QG   PRO  25           QG       PRO  25 -13.815  -2.599   7.774
   18    QD   PRO  25           QD       PRO  25 -15.468  -3.578   6.580
   19    H    VAL  26           H        VAL  26 -12.831  -5.120   6.005
   20    HA   VAL  26           HA       VAL  26  -9.924  -5.376   5.950
   21    HB   VAL  26           HB       VAL  26 -12.221  -7.352   6.094
   22   1HG1  VAL  26          2HG1      VAL  26  -9.356  -7.783   5.874
   23   2HG1  VAL  26          1HG1      VAL  26  -9.968  -8.387   7.414
   24   3HG1  VAL  26          3HG1      VAL  26 -10.660  -8.969   5.900
   25   1HG2  VAL  26          2HG2      VAL  26 -10.548  -5.858   8.124
   26   2HG2  VAL  26          1HG2      VAL  26 -12.304  -5.871   7.956
   27   3HG2  VAL  26          3HG2      VAL  26 -11.464  -7.302   8.555
   28    MG1  VAL  26           QG1      VAL  26  -9.995  -8.380   6.396
   29    MG2  VAL  26           QG2      VAL  26 -11.439  -6.343   8.211
   30    QG   VAL  26           QQG      VAL  26 -10.717  -7.362   7.304
   31    H    LEU  27           H        LEU  27 -12.475  -6.121   3.600
   32    HA   LEU  27           HA       LEU  27 -11.073  -8.009   1.945
   33   1HB   LEU  27          2HB       LEU  27 -13.447  -7.270   1.787
   34   2HB   LEU  27          1HB       LEU  27 -12.901  -5.718   1.153
   35    HG   LEU  27           HG       LEU  27 -11.714  -7.028  -0.682
   36   1HD1  LEU  27          3HD1      LEU  27 -13.011  -9.199   0.854
   37   2HD1  LEU  27          2HD1      LEU  27 -13.199  -9.306  -0.896
   38   3HD1  LEU  27          1HD1      LEU  27 -11.586  -9.251  -0.183
   39   1HD2  LEU  27          3HD2      LEU  27 -14.599  -6.560  -0.306
   40   2HD2  LEU  27          2HD2      LEU  27 -13.556  -6.115  -1.656
   41   3HD2  LEU  27          1HD2      LEU  27 -14.223  -7.744  -1.557
   42    MD1  LEU  27           QD1      LEU  27 -12.599  -9.252  -0.075
   43    MD2  LEU  27           QD2      LEU  27 -14.126  -6.806  -1.173
   44    QB   LEU  27           QB       LEU  27 -13.174  -6.494   1.470
   45    QD   LEU  27           QQD      LEU  27 -13.362  -8.029  -0.624
   46    H    VAL  28           H        VAL  28 -10.834  -4.456   2.125
   47    HA   VAL  28           HA       VAL  28  -9.345  -4.021  -0.309
   48    HB   VAL  28           HB       VAL  28  -8.857  -1.914   0.724
   49   1HG1  VAL  28          3HG1      VAL  28 -11.396  -2.977   0.713
   50   2HG1  VAL  28          2HG1      VAL  28 -11.233  -2.429   2.382
   51   3HG1  VAL  28          1HG1      VAL  28 -11.015  -1.289   1.054
   52   1HG2  VAL  28          1HG2      VAL  28  -9.036  -3.523   3.266
   53   2HG2  VAL  28          3HG2      VAL  28  -7.732  -2.473   2.715
   54   3HG2  VAL  28          2HG2      VAL  28  -9.241  -1.772   3.299
   55    MG1  VAL  28           QG1      VAL  28 -11.215  -2.232   1.383
   56    MG2  VAL  28           QG2      VAL  28  -8.669  -2.589   3.093
   57    QG   VAL  28           QQG      VAL  28  -9.942  -2.410   2.238
   58    H    ILE  29           H        ILE  29  -8.281  -5.073   2.939
   59    HA   ILE  29           HA       ILE  29  -5.420  -4.756   2.446
   60    HB   ILE  29           HB       ILE  29  -7.019  -6.653   4.196
   61   1HG1  ILE  29          2HG1      ILE  29  -5.742  -3.973   4.826
   62   2HG1  ILE  29          1HG1      ILE  29  -7.462  -4.206   4.505
   63   1HG2  ILE  29          3HG2      ILE  29  -4.104  -5.826   4.234
   64   2HG2  ILE  29          2HG2      ILE  29  -4.911  -6.614   5.590
   65   3HG2  ILE  29          1HG2      ILE  29  -4.748  -7.457   4.049
   66   1HD1  ILE  29          2HD1      ILE  29  -6.561  -6.120   6.471
   67   2HD1  ILE  29          1HD1      ILE  29  -6.137  -4.488   6.983
   68   3HD1  ILE  29          3HD1      ILE  29  -7.815  -4.890   6.620
   69    MG   ILE  29           QG2      ILE  29  -4.588  -6.632   4.624
   70    MD   ILE  29           QD1      ILE  29  -6.837  -5.166   6.691
   71    QG   ILE  29           QG1      ILE  29  -6.602  -4.089   4.665
   72    H    LEU  30           H        LEU  30  -7.722  -7.428   1.837
   73    HA   LEU  30           HA       LEU  30  -5.736  -9.433   1.138
   74   1HB   LEU  30          2HB       LEU  30  -8.576  -8.932   0.189
   75   2HB   LEU  30          1HB       LEU  30  -7.712 -10.459   0.010
   76    HG   LEU  30           HG       LEU  30  -8.383  -9.085   2.628
   77   1HD1  LEU  30          2HD1      LEU  30 -10.278 -10.223   1.455
   78   2HD1  LEU  30          1HD1      LEU  30  -9.340 -11.716   1.460
   79   3HD1  LEU  30          3HD1      LEU  30  -9.857 -10.994   2.984
   80   1HD2  LEU  30          2HD2      LEU  30  -6.522 -11.269   1.876
   81   2HD2  LEU  30          1HD2      LEU  30  -6.489 -10.194   3.274
   82   3HD2  LEU  30          3HD2      LEU  30  -7.558 -11.597   3.265
   83    MD1  LEU  30           QD1      LEU  30  -9.825 -10.978   1.966
   84    MD2  LEU  30           QD2      LEU  30  -6.856 -11.020   2.805
   85    QB   LEU  30           QB       LEU  30  -8.144  -9.695   0.100
   86    QD   LEU  30           QQD      LEU  30  -8.341 -10.999   2.386
   87    H    LEU  31           H        LEU  31  -7.504  -7.025  -0.874
   88    HA   LEU  31           HA       LEU  31  -6.358  -7.888  -3.409
   89   1HB   LEU  31          2HB       LEU  31  -7.334  -5.196  -2.401
   90   2HB   LEU  31          1HB       LEU  31  -7.116  -5.615  -4.101
   91    HG   LEU  31           HG       LEU  31  -8.991  -6.986  -2.150
   92   1HD1  LEU  31          2HD1      LEU  31  -9.283  -4.659  -3.755
   93   2HD1  LEU  31          1HD1      LEU  31 -10.217  -5.939  -4.528
   94   3HD1  LEU  31          3HD1      LEU  31 -10.535  -5.507  -2.848
   95   1HD2  LEU  31          1HD2      LEU  31  -7.992  -7.664  -4.877
   96   2HD2  LEU  31          3HD2      LEU  31  -8.502  -8.733  -3.571
   97   3HD2  LEU  31          2HD2      LEU  31  -9.709  -7.920  -4.568
   98    MD1  LEU  31           QD1      LEU  31 -10.012  -5.368  -3.710
   99    MD2  LEU  31           QD2      LEU  31  -8.734  -8.106  -4.339
  100    QB   LEU  31           QB       LEU  31  -7.225  -5.405  -3.251
  101    QD   LEU  31           QQD      LEU  31  -9.373  -6.737  -4.024
  102    H    GLY  32           H        GLY  32  -5.314  -5.406  -1.019
  103   1HA   GLY  32          1HA       GLY  32  -3.211  -4.312  -0.866
  104   2HA   GLY  32          2HA       GLY  32  -3.044  -4.501  -2.614
  105    QA   GLY  32           QA       GLY  32  -3.128  -4.406  -1.740
  106    H    VAL  33           H        VAL  33  -3.443  -7.077  -0.170
  107    HA   VAL  33           HA       VAL  33  -0.659  -7.777   0.125
  108    HB   VAL  33           HB       VAL  33  -3.240  -9.370   0.151
  109   1HG1  VAL  33          3HG1      VAL  33  -0.444 -10.145   1.027
  110   2HG1  VAL  33          2HG1      VAL  33  -1.898 -11.008   1.529
  111   3HG1  VAL  33          1HG1      VAL  33  -1.448 -10.956  -0.175
  112   1HG2  VAL  33          1HG2      VAL  33  -2.412  -7.380   1.820
  113   2HG2  VAL  33          3HG2      VAL  33  -3.442  -8.717   2.332
  114   3HG2  VAL  33          2HG2      VAL  33  -1.702  -8.785   2.616
  115    MG1  VAL  33           QG1      VAL  33  -1.263 -10.703   0.794
  116    MG2  VAL  33           QG2      VAL  33  -2.519  -8.294   2.256
  117    QG   VAL  33           QQG      VAL  33  -1.891  -9.499   1.525
  118    H    VAL  34           H        VAL  34  -3.117  -8.967  -2.220
  119    HA   VAL  34           HA       VAL  34  -1.393 -10.842  -3.589
  120    HB   VAL  34           HB       VAL  34  -3.723  -9.111  -4.460
  121   1HG1  VAL  34          3HG1      VAL  34  -2.281 -11.373  -5.852
  122   2HG1  VAL  34          2HG1      VAL  34  -3.964 -10.989  -6.211
  123   3HG1  VAL  34          1HG1      VAL  34  -2.705  -9.787  -6.496
  124   1HG2  VAL  34          3HG2      VAL  34  -3.376 -11.758  -3.123
  125   2HG2  VAL  34          2HG2      VAL  34  -4.616 -10.530  -2.875
  126   3HG2  VAL  34          1HG2      VAL  34  -4.701 -11.599  -4.275
  127    MG1  VAL  34           QG1      VAL  34  -2.983 -10.716  -6.186
  128    MG2  VAL  34           QG2      VAL  34  -4.231 -11.296  -3.424
  129    QG   VAL  34           QQG      VAL  34  -3.607 -11.006  -4.805
  130    H    GLY  35           H        GLY  35  -1.950  -7.329  -4.136
  131   1HA   GLY  35          1HA       GLY  35  -0.646  -5.829  -5.436
  132   2HA   GLY  35          2HA       GLY  35  -0.392  -7.160  -6.566
  133    QA   GLY  35           QA       GLY  35  -0.519  -6.495  -6.001
  134    H    LEU  36           H        LEU  36   0.593  -6.947  -3.122
  135    HA   LEU  36           HA       LEU  36   3.353  -6.218  -3.600
  136   1HB   LEU  36          2HB       LEU  36   2.034  -7.954  -1.487
  137   2HB   LEU  36          1HB       LEU  36   3.645  -7.249  -1.338
  138    HG   LEU  36           HG       LEU  36   1.050  -5.715  -1.672
  139   1HD1  LEU  36          2HD1      LEU  36   2.601  -6.644   0.628
  140   2HD1  LEU  36          1HD1      LEU  36   2.357  -4.898   0.640
  141   3HD1  LEU  36          3HD1      LEU  36   0.967  -5.982   0.572
  142   1HD2  LEU  36          1HD2      LEU  36   3.950  -4.926  -1.723
  143   2HD2  LEU  36          3HD2      LEU  36   2.626  -4.355  -2.737
  144   3HD2  LEU  36          2HD2      LEU  36   2.760  -3.802  -1.068
  145    MD1  LEU  36           QD1      LEU  36   1.975  -5.842   0.614
  146    MD2  LEU  36           QD2      LEU  36   3.112  -4.361  -1.843
  147    QB   LEU  36           QB       LEU  36   2.840  -7.602  -1.413
  148    QD   LEU  36           QQD      LEU  36   2.544  -5.102  -0.614
  149    H    SER  37           H        SER  37   1.716  -9.404  -3.601
  150    HA   SER  37           HA       SER  37   4.066 -11.066  -3.688
  151   1HB   SER  37          2HB       SER  37   1.639 -11.689  -3.423
  152   2HB   SER  37          1HB       SER  37   1.431 -11.418  -5.150
  153    HG   SER  37           HG       SER  37   3.581 -12.980  -4.643
  154    QB   SER  37           QB       SER  37   1.535 -11.553  -4.287
  155    H    ALA  38           H        ALA  38   2.183  -9.641  -6.427
  156    HA   ALA  38           HA       ALA  38   3.781 -10.689  -8.565
  157   1HB   ALA  38          2HB       ALA  38   1.786  -9.531  -9.062
  158   2HB   ALA  38          3HB       ALA  38   3.039  -8.423  -9.624
  159   3HB   ALA  38          1HB       ALA  38   2.243  -8.142  -8.075
  160    MB   ALA  38           QB       ALA  38   2.356  -8.699  -8.920
  161    H    LEU  39           H        LEU  39   4.403  -7.951  -6.368
  162    HA   LEU  39           HA       LEU  39   7.006  -7.444  -7.870
  163   1HB   LEU  39          2HB       LEU  39   5.269  -5.641  -7.488
  164   2HB   LEU  39          1HB       LEU  39   5.592  -5.789  -5.760
  165    HG   LEU  39           HG       LEU  39   7.891  -5.391  -7.644
  166   1HD1  LEU  39          3HD1      LEU  39   6.051  -3.678  -8.121
  167   2HD1  LEU  39          2HD1      LEU  39   6.305  -3.096  -6.475
  168   3HD1  LEU  39          1HD1      LEU  39   7.618  -3.019  -7.651
  169   1HD2  LEU  39          3HD2      LEU  39   7.265  -5.105  -4.750
  170   2HD2  LEU  39          2HD2      LEU  39   8.757  -5.627  -5.531
  171   3HD2  LEU  39          1HD2      LEU  39   8.368  -3.910  -5.430
  172    MD1  LEU  39           QD1      LEU  39   6.658  -3.264  -7.416
  173    MD2  LEU  39           QD2      LEU  39   8.130  -4.881  -5.237
  174    QB   LEU  39           QB       LEU  39   5.431  -5.715  -6.624
  175    QD   LEU  39           QQD      LEU  39   7.394  -4.073  -6.326
  176    H    THR  40           H        THR  40   8.668  -8.647  -7.006
  177    HA   THR  40           HA       THR  40   9.068  -8.406  -4.015
  178    HB   THR  40           HB       THR  40   9.503 -11.001  -4.180
  179    HG1  THR  40          1HG       THR  40   8.257 -11.968  -5.756
  180   1HG2  THR  40          3HG2      THR  40   7.387  -9.411  -3.329
  181   2HG2  THR  40          2HG2      THR  40   6.614 -10.624  -4.349
  182   3HG2  THR  40          1HG2      THR  40   7.600 -11.125  -2.976
  183    MG   THR  40           QG2      THR  40   7.200 -10.387  -3.551
  184    H    GLY  41           H        GLY  41  10.500  -7.225  -6.273
  185   1HA   GLY  41          1HA       GLY  41  12.629  -7.641  -7.464
  186   2HA   GLY  41          2HA       GLY  41  12.993  -8.956  -6.346
  187    QA   GLY  41           QA       GLY  41  12.811  -8.299  -6.905
  188    H    TYR  42           H        TYR  42  14.595  -6.520  -7.097
  189    HA   TYR  42           HA       TYR  42  14.683  -5.206  -4.341
  190   1HB   TYR  42          2HB       TYR  42  16.310  -7.082  -4.582
  191   2HB   TYR  42          1HB       TYR  42  17.004  -6.268  -5.985
  192    HD1  TYR  42          1HD       TYR  42  16.479  -6.051  -2.321
  193    HD2  TYR  42          2HD       TYR  42  18.431  -4.343  -5.746
  194    HE1  TYR  42          1HE       TYR  42  17.901  -4.676  -0.825
  195    HE2  TYR  42          2HE       TYR  42  19.853  -2.969  -4.250
  196    HH   TYR  42           HH       TYR  42  19.918  -2.125  -2.041
  197    QB   TYR  42           QB       TYR  42  16.657  -6.675  -5.284
  198    QD   TYR  42           QD       TYR  42  17.455  -5.197  -4.034
  199    QE   TYR  42           QE       TYR  42  18.877  -3.823  -2.538
  200    QR   TYR  42           QR       TYR  42  18.166  -4.510  -3.286
  201    H    LEU  43           H        LEU  43  15.230  -3.013  -4.345
  202    HA   LEU  43           HA       LEU  43  16.355  -1.775  -6.823
  203   1HB   LEU  43          2HB       LEU  43  13.817  -2.256  -7.122
  204   2HB   LEU  43          1HB       LEU  43  13.582  -0.948  -5.961
  205    HG   LEU  43           HG       LEU  43  15.441  -0.433  -8.234
  206   1HD1  LEU  43          2HD1      LEU  43  12.461  -0.807  -8.475
  207   2HD1  LEU  43          1HD1      LEU  43  13.304   0.349  -9.507
  208   3HD1  LEU  43          3HD1      LEU  43  13.735  -1.360  -9.562
  209   1HD2  LEU  43          3HD2      LEU  43  13.929   1.017  -6.230
  210   2HD2  LEU  43          2HD2      LEU  43  15.233   1.594  -7.267
  211   3HD2  LEU  43          1HD2      LEU  43  13.567   1.631  -7.843
  212    MD1  LEU  43           QD1      LEU  43  13.167  -0.606  -9.182
  213    MD2  LEU  43           QD2      LEU  43  14.243   1.414  -7.113
  214    QB   LEU  43           QB       LEU  43  13.699  -1.602  -6.542
  215    QD   LEU  43           QQD      LEU  43  13.705   0.404  -8.147
  216    H    ASP  44           H        ASP  44  17.528   0.017  -6.204
  217    HA   ASP  44           HA       ASP  44  17.346   0.887  -3.356
  218   1HB   ASP  44          2HB       ASP  44  19.300   0.709  -5.212
  219   2HB   ASP  44          1HB       ASP  44  18.862   2.405  -5.424
  220    QB   ASP  44           QB       ASP  44  19.081   1.557  -5.318
  221    H    TYR  45           H        TYR  45  17.815   3.636  -3.534
  222    HA   TYR  45           HA       TYR  45  15.032   4.570  -4.234
  223   1HB   TYR  45          2HB       TYR  45  15.562   6.349  -2.769
  224   2HB   TYR  45          1HB       TYR  45  16.433   4.980  -2.077
  225    HD1  TYR  45          1HD       TYR  45  18.879   4.738  -2.425
  226    HD2  TYR  45          2HD       TYR  45  16.728   8.194  -3.798
  227    HE1  TYR  45          1HE       TYR  45  21.019   5.961  -2.700
  228    HE2  TYR  45          2HE       TYR  45  18.868   9.417  -4.073
  229    HH   TYR  45           HH       TYR  45  21.495   8.849  -2.716
  230    QB   TYR  45           QB       TYR  45  15.998   5.665  -2.423
  231    QD   TYR  45           QD       TYR  45  17.804   6.466  -3.111
  232    QE   TYR  45           QE       TYR  45  19.944   7.689  -3.387
  233    QR   TYR  45           QR       TYR  45  18.874   7.077  -3.249
  234    H    VAL  46           H        VAL  46  14.603   5.517  -6.179
  235    HA   VAL  46           HA       VAL  46  16.988   6.567  -7.747
  236    HB   VAL  46           HB       VAL  46  15.541   6.231  -9.652
  237   1HG1  VAL  46          1HG1      VAL  46  16.366   4.201  -8.036
  238   2HG1  VAL  46          3HG1      VAL  46  14.631   3.890  -8.078
  239   3HG1  VAL  46          2HG1      VAL  46  15.553   3.948  -9.580
  240   1HG2  VAL  46          2HG2      VAL  46  13.464   6.494  -7.580
  241   2HG2  VAL  46          1HG2      VAL  46  13.387   6.869  -9.301
  242   3HG2  VAL  46          3HG2      VAL  46  13.145   5.211  -8.747
  243    MG1  VAL  46           QG1      VAL  46  15.517   4.013  -8.565
  244    MG2  VAL  46           QG2      VAL  46  13.332   6.191  -8.543
  245    QG   VAL  46           QQG      VAL  46  14.424   5.102  -8.554
  246    H    LEU  47           H        LEU  47  15.016   8.100  -9.455
  247    HA   LEU  47           HA       LEU  47  15.380  10.706  -8.315
  248   1HB   LEU  47          2HB       LEU  47  14.761  10.105 -10.654
  249   2HB   LEU  47          1HB       LEU  47  13.144   9.678 -10.094
  250    HG   LEU  47           HG       LEU  47  12.981  12.044  -9.160
  251   1HD1  LEU  47          2HD1      LEU  47  15.416  12.388 -10.941
  252   2HD1  LEU  47          1HD1      LEU  47  14.516  13.698 -10.177
  253   3HD1  LEU  47          3HD1      LEU  47  15.396  12.536  -9.184
  254   1HD2  LEU  47          2HD2      LEU  47  12.086  11.129 -11.431
  255   2HD2  LEU  47          1HD2      LEU  47  12.156  12.876 -11.205
  256   3HD2  LEU  47          3HD2      LEU  47  13.403  12.058 -12.146
  257    MD1  LEU  47           QD1      LEU  47  15.109  12.874 -10.101
  258    MD2  LEU  47           QD2      LEU  47  12.548  12.021 -11.594
  259    QB   LEU  47           QB       LEU  47  13.952   9.891 -10.374
  260    QD   LEU  47           QQD      LEU  47  13.829  12.448 -10.847
  261    H    LEU  48           H        LEU  48  12.638   8.414  -7.975
  262    HA   LEU  48           HA       LEU  48  11.836   9.854  -5.462
  263   1HB   LEU  48          2HB       LEU  48  10.607  10.255  -8.090
  264   2HB   LEU  48          1HB       LEU  48   9.439   9.742  -6.872
  265    HG   LEU  48           HG       LEU  48  11.354  11.795  -5.954
  266   1HD1  LEU  48          1HD1      LEU  48  10.956  12.533  -8.287
  267   2HD1  LEU  48          3HD1      LEU  48   9.217  12.461  -8.003
  268   3HD1  LEU  48          2HD1      LEU  48  10.206  13.628  -7.124
  269   1HD2  LEU  48          3HD2      LEU  48   8.466  11.065  -5.680
  270   2HD2  LEU  48          2HD2      LEU  48   9.651  11.436  -4.427
  271   3HD2  LEU  48          1HD2      LEU  48   8.923  12.739  -5.367
  272    MD1  LEU  48           QD1      LEU  48  10.126  12.874  -7.805
  273    MD2  LEU  48           QD2      LEU  48   9.013  11.747  -5.158
  274    QB   LEU  48           QB       LEU  48  10.023   9.999  -7.481
  275    QD   LEU  48           QQD      LEU  48   9.570  12.310  -6.481
  276    HA   PRO  49           HA       PRO  49  10.756   5.628  -4.680
  277   1HB   PRO  49          2HB       PRO  49   9.575   6.004  -2.244
  278   2HB   PRO  49          1HB       PRO  49  11.335   6.061  -2.477
  279   1HG   PRO  49          2HG       PRO  49   9.387   8.301  -2.230
  280   2HG   PRO  49          1HG       PRO  49  11.019   8.147  -1.560
  281   1HD   PRO  49          2HD       PRO  49  10.444   9.609  -3.788
  282   2HD   PRO  49          1HD       PRO  49  12.022   8.841  -3.499
  283    QB   PRO  49           QB       PRO  49  10.455   6.032  -2.360
  284    QG   PRO  49           QG       PRO  49  10.203   8.224  -1.895
  285    QD   PRO  49           QD       PRO  49  11.233   9.225  -3.644
  286    H    ALA  50           H        ALA  50   9.139   6.378  -6.608
  287    HA   ALA  50           HA       ALA  50   6.422   7.093  -6.043
  288   1HB   ALA  50          2HB       ALA  50   7.179   4.992  -8.065
  289   2HB   ALA  50          3HB       ALA  50   7.801   6.635  -8.228
  290   3HB   ALA  50          1HB       ALA  50   6.061   6.345  -8.243
  291    MB   ALA  50           QB       ALA  50   7.014   5.991  -8.179
  292    H    LEU  51           H        LEU  51   8.002   3.868  -5.961
  293    HA   LEU  51           HA       LEU  51   5.534   2.382  -5.427
  294   1HB   LEU  51          2HB       LEU  51   8.053   1.784  -6.113
  295   2HB   LEU  51          1HB       LEU  51   8.197   1.519  -4.375
  296    HG   LEU  51           HG       LEU  51   7.538  -0.589  -5.242
  297   1HD1  LEU  51          2HD1      LEU  51   6.140   0.368  -3.321
  298   2HD1  LEU  51          1HD1      LEU  51   4.889   0.682  -4.524
  299   3HD1  LEU  51          3HD1      LEU  51   5.421  -0.971  -4.215
  300   1HD2  LEU  51          3HD2      LEU  51   6.135   1.090  -7.188
  301   2HD2  LEU  51          2HD2      LEU  51   6.730  -0.562  -7.358
  302   3HD2  LEU  51          1HD2      LEU  51   5.151  -0.264  -6.631
  303    MD1  LEU  51           QD1      LEU  51   5.483   0.026  -4.020
  304    MD2  LEU  51           QD2      LEU  51   6.005   0.088  -7.059
  305    QB   LEU  51           QB       LEU  51   8.125   1.651  -5.244
  306    QD   LEU  51           QQD      LEU  51   5.744   0.057  -5.540
  307    H    ALA  52           H        ALA  52   8.167   3.547  -3.248
  308    HA   ALA  52           HA       ALA  52   7.009   2.651  -0.775
  309   1HB   ALA  52          2HB       ALA  52   8.298   5.323  -0.855
  310   2HB   ALA  52          1HB       ALA  52   8.735   3.893   0.082
  311   3HB   ALA  52          3HB       ALA  52   9.206   4.015  -1.613
  312    MB   ALA  52           QB       ALA  52   8.746   4.410  -0.795
  313    H    ILE  53           H        ILE  53   6.492   5.738  -2.557
  314    HA   ILE  53           HA       ILE  53   4.654   6.875  -0.597
  315    HB   ILE  53           HB       ILE  53   4.935   7.206  -3.603
  316   1HG1  ILE  53          2HG1      ILE  53   6.086   8.837  -1.317
  317   2HG1  ILE  53          1HG1      ILE  53   6.990   7.619  -2.217
  318   1HG2  ILE  53          2HG2      ILE  53   3.593   8.939  -1.507
  319   2HG2  ILE  53          1HG2      ILE  53   3.924   9.456  -3.160
  320   3HG2  ILE  53          3HG2      ILE  53   2.808   8.125  -2.860
  321   1HD1  ILE  53          3HD1      ILE  53   5.814   9.233  -4.184
  322   2HD1  ILE  53          2HD1      ILE  53   6.383  10.361  -2.954
  323   3HD1  ILE  53          1HD1      ILE  53   7.510   9.230  -3.703
  324    MG   ILE  53           QG2      ILE  53   3.442   8.840  -2.509
  325    MD   ILE  53           QD1      ILE  53   6.569   9.608  -3.614
  326    QG   ILE  53           QG1      ILE  53   6.538   8.228  -1.767
  327    H    PHE  54           H        PHE  54   4.108   4.926  -3.576
  328    HA   PHE  54           HA       PHE  54   1.243   4.970  -3.570
  329   1HB   PHE  54          2HB       PHE  54   2.803   4.010  -5.270
  330   2HB   PHE  54          1HB       PHE  54   3.118   2.662  -4.179
  331    HD1  PHE  54          1HD       PHE  54   1.514   0.894  -3.868
  332    HD2  PHE  54          2HD       PHE  54   0.531   4.344  -6.230
  333    HE1  PHE  54          1HE       PHE  54  -0.517  -0.257  -4.704
  334    HE2  PHE  54          2HE       PHE  54  -1.500   3.194  -7.067
  335    HZ   PHE  54           HZ       PHE  54  -2.024   0.892  -6.304
  336    QB   PHE  54           QB       PHE  54   2.961   3.336  -4.724
  337    QD   PHE  54           QD       PHE  54   1.022   2.619  -5.049
  338    QE   PHE  54           QE       PHE  54  -1.009   1.468  -5.886
  339    QR   PHE  54           QR       PHE  54  -0.399   1.813  -5.635
  340    H    ILE  55           H        ILE  55   3.468   2.735  -1.816
  341    HA   ILE  55           HA       ILE  55   1.348   1.160  -0.582
  342    HB   ILE  55           HB       ILE  55   4.156   1.874   0.330
  343   1HG1  ILE  55          2HG1      ILE  55   4.160   0.908  -1.903
  344   2HG1  ILE  55          1HG1      ILE  55   4.708  -0.320  -0.762
  345   1HG2  ILE  55          1HG2      ILE  55   2.216  -0.300   1.148
  346   2HG2  ILE  55          3HG2      ILE  55   3.950  -0.411   1.451
  347   3HG2  ILE  55          2HG2      ILE  55   3.008   0.888   2.184
  348   1HD1  ILE  55          1HD1      ILE  55   2.069  -0.831  -0.682
  349   2HD1  ILE  55          3HD1      ILE  55   2.172  -0.176  -2.316
  350   3HD1  ILE  55          2HD1      ILE  55   3.136  -1.582  -1.868
  351    MG   ILE  55           QG2      ILE  55   3.058   0.059   1.594
  352    MD   ILE  55           QD1      ILE  55   2.459  -0.863  -1.622
  353    QG   ILE  55           QG1      ILE  55   4.434   0.294  -1.333
  354    H    GLY  56           H        GLY  56   3.151   4.066   0.543
  355   1HA   GLY  56          1HA       GLY  56   2.496   5.635   2.200
  356   2HA   GLY  56          2HA       GLY  56   1.970   4.243   3.148
  357    QA   GLY  56           QA       GLY  56   2.233   4.939   2.674
  358    H    LEU  57           H        LEU  57   0.796   5.740   0.076
  359    HA   LEU  57           HA       LEU  57  -1.678   6.747   1.234
  360   1HB   LEU  57          2HB       LEU  57  -0.571   7.305  -0.970
  361   2HB   LEU  57          1HB       LEU  57  -1.146   5.754  -1.582
  362    HG   LEU  57           HG       LEU  57  -3.104   7.625  -0.292
  363   1HD1  LEU  57          1HD1      LEU  57  -1.675   8.855  -2.043
  364   2HD1  LEU  57          3HD1      LEU  57  -2.406   7.773  -3.229
  365   3HD1  LEU  57          2HD1      LEU  57  -3.421   8.870  -2.292
  366   1HD2  LEU  57          1HD2      LEU  57  -3.088   5.286  -2.135
  367   2HD2  LEU  57          3HD2      LEU  57  -4.235   5.707  -0.862
  368   3HD2  LEU  57          2HD2      LEU  57  -4.323   6.510  -2.431
  369    MD1  LEU  57           QD1      LEU  57  -2.500   8.499  -2.521
  370    MD2  LEU  57           QD2      LEU  57  -3.882   5.834  -1.809
  371    QB   LEU  57           QB       LEU  57  -0.858   6.529  -1.276
  372    QD   LEU  57           QQD      LEU  57  -3.191   7.167  -2.165
  373    H    THR  58           H        THR  58  -0.810   3.606  -0.256
  374    HA   THR  58           HA       THR  58  -3.517   2.526  -0.305
  375    HB   THR  58           HB       THR  58  -0.820   1.180   0.050
  376    HG1  THR  58          1HG       THR  58  -2.149   1.429  -2.390
  377   1HG2  THR  58          2HG2      THR  58  -3.536   0.197  -0.827
  378   2HG2  THR  58          1HG2      THR  58  -2.053  -0.656  -1.252
  379   3HG2  THR  58          3HG2      THR  58  -2.497  -0.454   0.442
  380    MG   THR  58           QG2      THR  58  -2.695  -0.304  -0.546
  381    H    ILE  59           H        ILE  59  -0.855   2.107   2.097
  382    HA   ILE  59           HA       ILE  59  -2.513   0.619   3.990
  383    HB   ILE  59           HB       ILE  59  -0.028   2.328   4.317
  384   1HG1  ILE  59          2HG1      ILE  59  -0.348  -0.665   3.912
  385   2HG1  ILE  59          1HG1      ILE  59   0.098   0.469   2.637
  386   1HG2  ILE  59          2HG2      ILE  59  -1.657   1.048   6.267
  387   2HG2  ILE  59          1HG2      ILE  59  -0.192   0.080   6.100
  388   3HG2  ILE  59          3HG2      ILE  59  -0.077   1.795   6.503
  389   1HD1  ILE  59          2HD1      ILE  59   2.051   1.184   4.057
  390   2HD1  ILE  59          1HD1      ILE  59   1.649  -0.121   5.174
  391   3HD1  ILE  59          3HD1      ILE  59   2.136  -0.494   3.520
  392    MG   ILE  59           QG2      ILE  59  -0.642   0.974   6.290
  393    MD   ILE  59           QD1      ILE  59   1.946   0.190   4.250
  394    QG   ILE  59           QG1      ILE  59  -0.125  -0.098   3.274
  395    H    TYR  60           H        TYR  60  -1.665   4.122   3.745
  396    HA   TYR  60           HA       TYR  60  -2.999   4.925   6.193
  397   1HB   TYR  60          2HB       TYR  60  -2.266   6.169   3.556
  398   2HB   TYR  60          1HB       TYR  60  -3.260   7.094   4.679
  399    HD1  TYR  60          1HD       TYR  60  -1.987   8.648   5.843
  400    HD2  TYR  60          2HD       TYR  60  -0.356   4.743   5.105
  401    HE1  TYR  60          1HE       TYR  60   0.025   9.240   7.163
  402    HE2  TYR  60          2HE       TYR  60   1.660   5.337   6.423
  403    HH   TYR  60           HH       TYR  60   2.526   8.394   7.180
  404    QB   TYR  60           QB       TYR  60  -2.763   6.631   4.117
  405    QD   TYR  60           QD       TYR  60  -1.172   6.695   5.474
  406    QE   TYR  60           QE       TYR  60   0.843   7.288   6.793
  407    QR   TYR  60           QR       TYR  60  -0.164   6.992   6.133
  408    H    ALA  61           H        ALA  61  -4.211   4.839   2.796
  409    HA   ALA  61           HA       ALA  61  -6.912   5.667   3.395
  410   1HB   ALA  61          3HB       ALA  61  -5.914   3.705   1.309
  411   2HB   ALA  61          1HB       ALA  61  -5.773   5.460   1.176
  412   3HB   ALA  61          2HB       ALA  61  -7.364   4.702   1.201
  413    MB   ALA  61           QB       ALA  61  -6.350   4.622   1.229
  414    H    ILE  62           H        ILE  62  -5.424   2.397   3.387
  415    HA   ILE  62           HA       ILE  62  -7.912   0.952   3.815
  416    HB   ILE  62           HB       ILE  62  -5.009   0.452   4.506
  417   1HG1  ILE  62          2HG1      ILE  62  -6.711  -0.832   2.366
  418   2HG1  ILE  62          1HG1      ILE  62  -5.872   0.693   2.083
  419   1HG2  ILE  62          2HG2      ILE  62  -7.455  -1.127   5.078
  420   2HG2  ILE  62          1HG2      ILE  62  -6.120  -2.024   4.353
  421   3HG2  ILE  62          3HG2      ILE  62  -5.882  -1.162   5.874
  422   1HD1  ILE  62          2HD1      ILE  62  -3.742  -0.444   2.832
  423   2HD1  ILE  62          1HD1      ILE  62  -4.633  -1.966   2.831
  424   3HD1  ILE  62          3HD1      ILE  62  -4.416  -1.071   1.327
  425    MG   ILE  62           QG2      ILE  62  -6.486  -1.438   5.101
  426    MD   ILE  62           QD1      ILE  62  -4.264  -1.160   2.330
  427    QG   ILE  62           QG1      ILE  62  -6.291  -0.070   2.225
  428    H    GLN  63           H        GLN  63  -5.472   2.216   6.158
  429    HA   GLN  63           HA       GLN  63  -6.812   1.222   8.531
  430   1HB   GLN  63          2HB       GLN  63  -4.500   2.186   8.284
  431   2HB   GLN  63          1HB       GLN  63  -5.235   3.785   8.159
  432   1HG   GLN  63          2HG       GLN  63  -6.319   3.416  10.378
  433   2HG   GLN  63          1HG       GLN  63  -5.450   1.886  10.511
  434   1HE2  GLN  63          1HE2      GLN  63  -3.500   1.985  11.615
  435   2HE2  GLN  63          2HE2      GLN  63  -2.503   3.480  11.746
  436    QB   GLN  63           QB       GLN  63  -4.868   2.985   8.221
  437    QG   GLN  63           QG       GLN  63  -5.885   2.651  10.445
  438    QE   GLN  63           QE2      GLN  63  -3.001   2.732  11.681
  439    H    ARG  64           H        ARG  64  -7.223   4.253   6.657
  440    HA   ARG  64           HA       ARG  64  -9.076   5.489   8.552
  441   1HB   ARG  64          2HB       ARG  64  -8.628   5.719   5.561
  442   2HB   ARG  64          1HB       ARG  64  -9.636   6.835   6.485
  443   1HG   ARG  64          2HG       ARG  64  -7.711   7.405   7.912
  444   2HG   ARG  64          1HG       ARG  64  -6.698   6.285   6.998
  445   1HD   ARG  64          2HD       ARG  64  -6.325   8.533   6.128
  446   2HD   ARG  64          1HD       ARG  64  -7.254   7.628   4.916
  447    HE   ARG  64           HE       ARG  64  -8.545   9.503   6.949
  448   1HH1  ARG  64          1HH1      ARG  64 -10.834   8.602   6.031
  449   2HH1  ARG  64          2HH1      ARG  64 -11.093   9.115   4.397
  450   1HH2  ARG  64          1HH2      ARG  64  -7.757   9.869   3.827
  451   2HH2  ARG  64          2HH2      ARG  64  -9.351   9.833   3.150
  452    QB   ARG  64           QB       ARG  64  -9.132   6.277   6.023
  453    QG   ARG  64           QG       ARG  64  -7.204   6.845   7.455
  454    QD   ARG  64           QD       ARG  64  -6.789   8.080   5.522
  455    QH1  ARG  64           QH1      ARG  64 -10.963   8.858   5.214
  456    QH2  ARG  64           QH2      ARG  64  -8.554   9.851   3.488
  457    H    LYS  65           H        LYS  65  -9.658   3.686   5.476
  458    HA   LYS  65           HA       LYS  65 -12.533   3.645   5.664
  459   1HB   LYS  65          2HB       LYS  65 -10.507   1.661   4.582
  460   2HB   LYS  65          1HB       LYS  65 -12.233   1.604   4.213
  461   1HG   LYS  65          2HG       LYS  65 -12.086   3.925   3.318
  462   2HG   LYS  65          1HG       LYS  65 -10.347   3.900   3.605
  463   1HD   LYS  65          2HD       LYS  65 -10.174   1.899   2.114
  464   2HD   LYS  65          1HD       LYS  65 -11.894   2.064   1.753
  465   1HE   LYS  65          2HE       LYS  65 -11.478   3.699   0.238
  466   2HE   LYS  65          1HE       LYS  65 -10.506   4.607   1.415
  467   1HZ   LYS  65          2HZ       LYS  65  -8.746   2.861   1.044
  468   2HZ   LYS  65          1HZ       LYS  65  -9.643   2.351  -0.306
  469   3HZ   LYS  65          3HZ       LYS  65  -9.008   3.923  -0.255
  470    QB   LYS  65           QB       LYS  65 -11.370   1.632   4.397
  471    QD   LYS  65           QD       LYS  65 -11.034   1.982   1.933
  472    QG   LYS  65           QG       LYS  65 -11.217   3.912   3.462
  473    QE   LYS  65           QE       LYS  65 -10.992   4.153   0.826
  474    QZ   LYS  65           QZ       LYS  65  -9.133   3.045   0.161
  475    H    ARG  66           H        ARG  66 -10.131   1.227   6.866
  476    HA   ARG  66           HA       ARG  66 -12.025  -0.573   8.076
  477   1HB   ARG  66          2HB       ARG  66  -9.217   0.313   8.801
  478   2HB   ARG  66          1HB       ARG  66 -10.018  -1.058   9.571
  479   1HG   ARG  66          2HG       ARG  66 -10.274  -2.169   7.410
  480   2HG   ARG  66          1HG       ARG  66  -9.576  -0.777   6.585
  481   1HD   ARG  66          2HD       ARG  66  -7.814  -2.429   6.830
  482   2HD   ARG  66          1HD       ARG  66  -7.479  -1.134   7.997
  483    HE   ARG  66           HE       ARG  66  -9.253  -3.105   9.226
  484   1HH1  ARG  66          1HH1      ARG  66  -7.974  -5.320   9.148
  485   2HH1  ARG  66          2HH1      ARG  66  -6.394  -5.204   9.849
  486   1HH2  ARG  66          1HH2      ARG  66  -6.286  -1.742   9.687
  487   2HH2  ARG  66          2HH2      ARG  66  -5.439  -3.179  10.155
  488    QB   ARG  66           QB       ARG  66  -9.617  -0.372   9.186
  489    QG   ARG  66           QG       ARG  66  -9.925  -1.473   6.998
  490    QD   ARG  66           QD       ARG  66  -7.647  -1.781   7.414
  491    QH1  ARG  66           QH1      ARG  66  -7.184  -5.262   9.498
  492    QH2  ARG  66           QH2      ARG  66  -5.863  -2.460   9.921
  493    H    GLN  67           H        GLN  67 -10.532   2.437   9.337
  494    HA   GLN  67           HA       GLN  67 -12.814   2.700  11.269
  495   1HB   GLN  67          2HB       GLN  67 -11.358   2.647  13.234
  496   2HB   GLN  67          1HB       GLN  67 -11.158   1.143  12.332
  497   1HG   GLN  67          2HG       GLN  67  -9.148   2.087  11.228
  498   2HG   GLN  67          1HG       GLN  67  -9.333   3.561  12.179
  499   1HE2  GLN  67          1HE2      GLN  67  -8.628   3.589  14.370
  500   2HE2  GLN  67          2HE2      GLN  67  -7.870   2.147  15.139
  501    QB   GLN  67           QB       GLN  67 -11.258   1.895  12.783
  502    QG   GLN  67           QG       GLN  67  -9.240   2.824  11.703
  503    QE   GLN  67           QE2      GLN  67  -8.249   2.868  14.755
  504    H    ALA  68           H        ALA  68 -12.989   4.858  12.105
  505    HA   ALA  68           HA       ALA  68 -10.847   6.831  11.721
  506   1HB   ALA  68          2HB       ALA  68 -12.467   6.080   9.445
  507   2HB   ALA  68          3HB       ALA  68 -11.097   7.189   9.507
  508   3HB   ALA  68          1HB       ALA  68 -12.726   7.780   9.837
  509    MB   ALA  68           QB       ALA  68 -12.097   7.016   9.596
  510    H    ASP  69           H        ASP  69 -11.439   8.901  12.563
  511    HA   ASP  69           HA       ASP  69 -13.439   9.003  14.571
  512   1HB   ASP  69          2HB       ASP  69 -13.347  11.566  13.820
  513   2HB   ASP  69          1HB       ASP  69 -11.942  10.779  14.540
  514    QB   ASP  69           QB       ASP  69 -12.645  11.172  14.180

  No H/Q in entry =         514
  Start of MODEL    5
    1    H    THR  24           H        THR  24 -16.178  -3.126   9.770
    2    HA   THR  24           HA       THR  24 -14.043  -2.691   8.775
    3    HB   THR  24           HB       THR  24 -13.364  -5.593   9.222
    4    HG1  THR  24          1HG       THR  24 -13.446  -5.343  11.325
    5   1HG2  THR  24          2HG2      THR  24 -11.909  -2.951   9.429
    6   2HG2  THR  24          1HG2      THR  24 -11.232  -4.461  10.039
    7   3HG2  THR  24          3HG2      THR  24 -11.581  -4.282   8.320
    8    MG   THR  24           QG2      THR  24 -11.574  -3.898   9.263
    9    HA   PRO  25           HA       PRO  25 -14.915  -4.120   4.670
   10   1HB   PRO  25          2HB       PRO  25 -13.016  -2.637   3.382
   11   2HB   PRO  25          1HB       PRO  25 -14.526  -1.939   4.001
   12   1HG   PRO  25          2HG       PRO  25 -11.788  -1.853   5.158
   13   2HG   PRO  25          1HG       PRO  25 -13.046  -0.608   5.137
   14   1HD   PRO  25          2HD       PRO  25 -12.474  -2.179   7.311
   15   2HD   PRO  25          1HD       PRO  25 -14.052  -1.414   7.020
   16    QB   PRO  25           QB       PRO  25 -13.771  -2.288   3.692
   17    QG   PRO  25           QG       PRO  25 -12.417  -1.231   5.147
   18    QD   PRO  25           QD       PRO  25 -13.263  -1.796   7.166
   19    H    VAL  26           H        VAL  26 -14.146  -6.322   5.205
   20    HA   VAL  26           HA       VAL  26 -11.347  -7.057   5.228
   21    HB   VAL  26           HB       VAL  26 -13.445  -8.362   5.862
   22   1HG1  VAL  26          1HG1      VAL  26 -14.609  -7.882   3.681
   23   2HG1  VAL  26          3HG1      VAL  26 -13.470  -8.973   2.892
   24   3HG1  VAL  26          2HG1      VAL  26 -14.585  -9.592   4.109
   25   1HG2  VAL  26          2HG2      VAL  26 -10.971  -9.264   4.642
   26   2HG2  VAL  26          1HG2      VAL  26 -11.863  -9.964   5.992
   27   3HG2  VAL  26          3HG2      VAL  26 -12.270 -10.417   4.337
   28    MG1  VAL  26           QG1      VAL  26 -14.221  -8.816   3.561
   29    MG2  VAL  26           QG2      VAL  26 -11.701  -9.882   4.991
   30    QG   VAL  26           QQG      VAL  26 -12.961  -9.349   4.276
   31    H    LEU  27           H        LEU  27 -13.637  -6.527   2.545
   32    HA   LEU  27           HA       LEU  27 -12.097  -7.735   0.424
   33   1HB   LEU  27          2HB       LEU  27 -14.458  -6.529   0.641
   34   2HB   LEU  27          1HB       LEU  27 -13.549  -5.138   0.052
   35    HG   LEU  27           HG       LEU  27 -14.491  -6.327  -1.852
   36   1HD1  LEU  27          1HD1      LEU  27 -12.013  -5.458  -1.774
   37   2HD1  LEU  27          3HD1      LEU  27 -11.606  -7.173  -1.835
   38   3HD1  LEU  27          2HD1      LEU  27 -12.542  -6.442  -3.139
   39   1HD2  LEU  27          2HD2      LEU  27 -14.123  -8.582  -0.281
   40   2HD2  LEU  27          1HD2      LEU  27 -14.594  -8.589  -1.981
   41   3HD2  LEU  27          3HD2      LEU  27 -12.898  -8.770  -1.535
   42    MD1  LEU  27           QD1      LEU  27 -12.053  -6.358  -2.250
   43    MD2  LEU  27           QD2      LEU  27 -13.872  -8.647  -1.266
   44    QB   LEU  27           QB       LEU  27 -14.003  -5.834   0.347
   45    QD   LEU  27           QQD      LEU  27 -12.963  -7.502  -1.758
   46    H    VAL  28           H        VAL  28 -11.868  -4.508   1.946
   47    HA   VAL  28           HA       VAL  28  -9.997  -3.344   0.069
   48    HB   VAL  28           HB       VAL  28 -10.532  -3.027   3.032
   49   1HG1  VAL  28          3HG1      VAL  28  -8.488  -1.769   1.297
   50   2HG1  VAL  28          2HG1      VAL  28  -9.450  -0.648   2.262
   51   3HG1  VAL  28          1HG1      VAL  28  -8.531  -1.929   3.053
   52   1HG2  VAL  28          2HG2      VAL  28 -12.310  -2.501   1.280
   53   2HG2  VAL  28          1HG2      VAL  28 -11.877  -1.163   2.343
   54   3HG2  VAL  28          3HG2      VAL  28 -11.238  -1.226   0.701
   55    MG1  VAL  28           QG1      VAL  28  -8.823  -1.449   2.204
   56    MG2  VAL  28           QG2      VAL  28 -11.808  -1.630   1.441
   57    QG   VAL  28           QQG      VAL  28 -10.316  -1.539   1.823
   58    H    ILE  29           H        ILE  29  -9.436  -5.249   3.076
   59    HA   ILE  29           HA       ILE  29  -6.524  -5.080   2.949
   60    HB   ILE  29           HB       ILE  29  -8.422  -7.158   4.085
   61   1HG1  ILE  29          2HG1      ILE  29  -7.079  -4.777   5.403
   62   2HG1  ILE  29          1HG1      ILE  29  -8.756  -4.793   4.855
   63   1HG2  ILE  29          2HG2      ILE  29  -6.075  -7.956   3.892
   64   2HG2  ILE  29          1HG2      ILE  29  -5.539  -6.541   4.800
   65   3HG2  ILE  29          3HG2      ILE  29  -6.566  -7.749   5.573
   66   1HD1  ILE  29          3HD1      ILE  29  -7.856  -7.019   6.633
   67   2HD1  ILE  29          2HD1      ILE  29  -8.110  -5.434   7.364
   68   3HD1  ILE  29          1HD1      ILE  29  -9.434  -6.239   6.523
   69    MG   ILE  29           QG2      ILE  29  -6.060  -7.415   4.755
   70    MD   ILE  29           QD1      ILE  29  -8.467  -6.231   6.840
   71    QG   ILE  29           QG1      ILE  29  -7.917  -4.785   5.129
   72    H    LEU  30           H        LEU  30  -8.900  -7.386   1.581
   73    HA   LEU  30           HA       LEU  30  -6.971  -9.352   0.660
   74   1HB   LEU  30          2HB       LEU  30  -9.442  -9.585   0.834
   75   2HB   LEU  30          1HB       LEU  30  -9.625  -8.466  -0.518
   76    HG   LEU  30           HG       LEU  30  -8.161 -10.053  -1.867
   77   1HD1  LEU  30          2HD1      LEU  30  -8.507 -11.583   0.688
   78   2HD1  LEU  30          1HD1      LEU  30  -8.445 -12.474  -0.832
   79   3HD1  LEU  30          3HD1      LEU  30  -7.089 -11.453  -0.352
   80   1HD2  LEU  30          2HD2      LEU  30 -10.662  -9.921  -2.030
   81   2HD2  LEU  30          1HD2      LEU  30 -10.030 -11.528  -2.383
   82   3HD2  LEU  30          3HD2      LEU  30 -10.768 -11.195  -0.817
   83    MD1  LEU  30           QD1      LEU  30  -8.013 -11.837  -0.165
   84    MD2  LEU  30           QD2      LEU  30 -10.487 -10.881  -1.743
   85    QB   LEU  30           QB       LEU  30  -9.533  -9.025   0.158
   86    QD   LEU  30           QQD      LEU  30  -9.250 -11.359  -0.954
   87    H    LEU  31           H        LEU  31  -8.363  -6.448  -0.952
   88    HA   LEU  31           HA       LEU  31  -7.022  -6.864  -3.500
   89   1HB   LEU  31          2HB       LEU  31  -8.930  -5.320  -2.894
   90   2HB   LEU  31          1HB       LEU  31  -7.748  -4.263  -2.121
   91    HG   LEU  31           HG       LEU  31  -7.280  -5.152  -4.948
   92   1HD1  LEU  31          3HD1      LEU  31  -9.531  -3.547  -4.015
   93   2HD1  LEU  31          2HD1      LEU  31  -8.500  -2.650  -5.129
   94   3HD1  LEU  31          1HD1      LEU  31  -9.206  -4.188  -5.626
   95   1HD2  LEU  31          3HD2      LEU  31  -6.355  -3.062  -3.061
   96   2HD2  LEU  31          2HD2      LEU  31  -5.481  -3.868  -4.364
   97   3HD2  LEU  31          1HD2      LEU  31  -6.570  -2.530  -4.728
   98    MD1  LEU  31           QD1      LEU  31  -9.079  -3.461  -4.923
   99    MD2  LEU  31           QD2      LEU  31  -6.135  -3.153  -4.051
  100    QB   LEU  31           QB       LEU  31  -8.339  -4.791  -2.507
  101    QD   LEU  31           QQD      LEU  31  -7.607  -3.307  -4.487
  102    H    GLY  32           H        GLY  32  -6.056  -5.023  -0.559
  103   1HA   GLY  32          1HA       GLY  32  -3.906  -4.179   0.001
  104   2HA   GLY  32          2HA       GLY  32  -3.573  -4.029  -1.725
  105    QA   GLY  32           QA       GLY  32  -3.740  -4.104  -0.862
  106    H    VAL  33           H        VAL  33  -4.416  -7.003   0.061
  107    HA   VAL  33           HA       VAL  33  -1.742  -8.000   0.474
  108    HB   VAL  33           HB       VAL  33  -4.408  -9.321  -0.113
  109   1HG1  VAL  33          1HG1      VAL  33  -1.724 -10.476   0.584
  110   2HG1  VAL  33          3HG1      VAL  33  -3.186 -11.248   1.197
  111   3HG1  VAL  33          2HG1      VAL  33  -2.939 -11.083  -0.541
  112   1HG2  VAL  33          3HG2      VAL  33  -3.536  -7.842   2.061
  113   2HG2  VAL  33          2HG2      VAL  33  -4.851  -9.017   2.090
  114   3HG2  VAL  33          1HG2      VAL  33  -3.223  -9.502   2.566
  115    MG1  VAL  33           QG1      VAL  33  -2.617 -10.936   0.414
  116    MG2  VAL  33           QG2      VAL  33  -3.870  -8.787   2.239
  117    QG   VAL  33           QQG      VAL  33  -3.243  -9.861   1.326
  118    H    VAL  34           H        VAL  34  -3.973  -8.445  -2.314
  119    HA   VAL  34           HA       VAL  34  -2.228 -10.136  -3.878
  120    HB   VAL  34           HB       VAL  34  -4.311  -8.051  -4.581
  121   1HG1  VAL  34          1HG1      VAL  34  -2.710  -9.928  -6.273
  122   2HG1  VAL  34          3HG1      VAL  34  -4.411  -9.693  -6.676
  123   3HG1  VAL  34          2HG1      VAL  34  -3.312  -8.314  -6.653
  124   1HG2  VAL  34          2HG2      VAL  34  -4.377 -10.723  -3.488
  125   2HG2  VAL  34          1HG2      VAL  34  -5.721  -9.622  -3.791
  126   3HG2  VAL  34          3HG2      VAL  34  -5.165 -10.706  -5.066
  127    MG1  VAL  34           QG1      VAL  34  -3.478  -9.312  -6.534
  128    MG2  VAL  34           QG2      VAL  34  -5.087 -10.350  -4.115
  129    QG   VAL  34           QQG      VAL  34  -4.283  -9.831  -5.325
  130    H    GLY  35           H        GLY  35  -2.469  -6.552  -3.685
  131   1HA   GLY  35          1HA       GLY  35  -0.923  -4.938  -4.487
  132   2HA   GLY  35          2HA       GLY  35  -0.614  -6.023  -5.845
  133    QA   GLY  35           QA       GLY  35  -0.768  -5.481  -5.166
  134    H    LEU  36           H        LEU  36  -0.059  -6.613  -2.348
  135    HA   LEU  36           HA       LEU  36   2.780  -6.052  -2.351
  136   1HB   LEU  36          2HB       LEU  36   1.101  -8.069  -0.824
  137   2HB   LEU  36          1HB       LEU  36   2.718  -7.551  -0.349
  138    HG   LEU  36           HG       LEU  36   0.278  -5.770  -0.620
  139   1HD1  LEU  36          1HD1      LEU  36   1.263  -7.383   1.515
  140   2HD1  LEU  36          3HD1      LEU  36   1.568  -5.699   1.938
  141   3HD1  LEU  36          2HD1      LEU  36  -0.070  -6.229   1.555
  142   1HD2  LEU  36          3HD2      LEU  36   3.196  -5.207  -0.081
  143   2HD2  LEU  36          2HD2      LEU  36   2.130  -4.429  -1.250
  144   3HD2  LEU  36          1HD2      LEU  36   1.933  -4.108   0.472
  145    MD1  LEU  36           QD1      LEU  36   0.921  -6.437   1.669
  146    MD2  LEU  36           QD2      LEU  36   2.420  -4.581  -0.286
  147    QB   LEU  36           QB       LEU  36   1.909  -7.810  -0.586
  148    QD   LEU  36           QQD      LEU  36   1.670  -5.509   0.692
  149    H    SER  37           H        SER  37   0.964  -9.031  -3.181
  150    HA   SER  37           HA       SER  37   3.221 -10.810  -3.411
  151   1HB   SER  37          2HB       SER  37   0.686 -10.650  -5.070
  152   2HB   SER  37          1HB       SER  37   1.663 -12.091  -4.810
  153    HG   SER  37           HG       SER  37  -0.044 -12.084  -3.354
  154    QB   SER  37           QB       SER  37   1.174 -11.371  -4.940
  155    H    ALA  38           H        ALA  38   1.667  -8.760  -5.955
  156    HA   ALA  38           HA       ALA  38   3.431  -9.451  -8.111
  157   1HB   ALA  38          3HB       ALA  38   1.438  -8.102  -8.372
  158   2HB   ALA  38          1HB       ALA  38   2.811  -7.121  -8.886
  159   3HB   ALA  38          2HB       ALA  38   2.085  -6.859  -7.301
  160    MB   ALA  38           QB       ALA  38   2.111  -7.361  -8.186
  161    H    LEU  39           H        LEU  39   3.915  -7.217  -5.372
  162    HA   LEU  39           HA       LEU  39   6.676  -6.578  -6.492
  163   1HB   LEU  39          2HB       LEU  39   5.062  -4.748  -5.982
  164   2HB   LEU  39          1HB       LEU  39   5.020  -5.286  -4.301
  165    HG   LEU  39           HG       LEU  39   7.557  -4.998  -4.288
  166   1HD1  LEU  39          1HD1      LEU  39   7.099  -4.569  -7.027
  167   2HD1  LEU  39          3HD1      LEU  39   7.501  -2.982  -6.373
  168   3HD1  LEU  39          2HD1      LEU  39   8.617  -4.330  -6.162
  169   1HD2  LEU  39          3HD2      LEU  39   5.428  -2.995  -4.205
  170   2HD2  LEU  39          2HD2      LEU  39   6.798  -3.216  -3.117
  171   3HD2  LEU  39          1HD2      LEU  39   6.994  -2.288  -4.604
  172    MD1  LEU  39           QD1      LEU  39   7.739  -3.960  -6.521
  173    MD2  LEU  39           QD2      LEU  39   6.407  -2.833  -3.975
  174    QB   LEU  39           QB       LEU  39   5.041  -5.017  -5.141
  175    QD   LEU  39           QQD      LEU  39   7.073  -3.397  -5.248
  176    H    THR  40           H        THR  40   8.045  -8.222  -5.771
  177    HA   THR  40           HA       THR  40   8.178  -8.505  -2.742
  178    HB   THR  40           HB       THR  40   8.449 -10.989  -3.184
  179    HG1  THR  40          1HG       THR  40   8.068 -11.735  -5.174
  180   1HG2  THR  40          3HG2      THR  40   5.858  -9.673  -4.041
  181   2HG2  THR  40          2HG2      THR  40   6.024 -11.360  -3.553
  182   3HG2  THR  40          1HG2      THR  40   6.325 -10.071  -2.388
  183    MG   THR  40           QG2      THR  40   6.069 -10.368  -3.327
  184    H    GLY  41           H        GLY  41   9.870  -6.959  -4.595
  185   1HA   GLY  41          1HA       GLY  41  12.135  -7.846  -5.696
  186   2HA   GLY  41          2HA       GLY  41  12.434  -8.500  -4.085
  187    QA   GLY  41           QA       GLY  41  12.284  -8.173  -4.891
  188    H    TYR  42           H        TYR  42  14.236  -7.191  -3.602
  189    HA   TYR  42           HA       TYR  42  13.644  -4.566  -2.487
  190   1HB   TYR  42          2HB       TYR  42  15.515  -6.184  -1.952
  191   2HB   TYR  42          1HB       TYR  42  16.293  -5.681  -3.453
  192    HD1  TYR  42          1HD       TYR  42  15.068  -4.471  -0.154
  193    HD2  TYR  42          2HD       TYR  42  17.469  -3.612  -3.611
  194    HE1  TYR  42          1HE       TYR  42  16.019  -2.491   0.998
  195    HE2  TYR  42          2HE       TYR  42  18.420  -1.632  -2.459
  196    HH   TYR  42           HH       TYR  42  17.813  -1.010   0.928
  197    QB   TYR  42           QB       TYR  42  15.904  -5.933  -2.703
  198    QD   TYR  42           QD       TYR  42  16.269  -4.042  -1.882
  199    QE   TYR  42           QE       TYR  42  17.220  -2.061  -0.730
  200    QR   TYR  42           QR       TYR  42  16.744  -3.052  -1.306
  201    H    LEU  43           H        LEU  43  14.883  -2.522  -3.190
  202    HA   LEU  43           HA       LEU  43  15.567  -2.230  -6.041
  203   1HB   LEU  43          2HB       LEU  43  13.097  -2.629  -6.136
  204   2HB   LEU  43          1HB       LEU  43  12.861  -1.204  -5.124
  205    HG   LEU  43           HG       LEU  43  14.155   0.109  -6.881
  206   1HD1  LEU  43          1HD1      LEU  43  14.009  -2.594  -8.143
  207   2HD1  LEU  43          3HD1      LEU  43  13.798  -1.194  -9.194
  208   3HD1  LEU  43          2HD1      LEU  43  15.277  -1.372  -8.249
  209   1HD2  LEU  43          1HD2      LEU  43  11.483  -0.482  -6.661
  210   2HD2  LEU  43          3HD2      LEU  43  12.151   0.690  -7.795
  211   3HD2  LEU  43          2HD2      LEU  43  11.811  -0.956  -8.328
  212    MD1  LEU  43           QD1      LEU  43  14.361  -1.720  -8.529
  213    MD2  LEU  43           QD2      LEU  43  11.815  -0.249  -7.594
  214    QB   LEU  43           QB       LEU  43  12.979  -1.917  -5.630
  215    QD   LEU  43           QQD      LEU  43  13.088  -0.984  -8.062
  216    H    ASP  44           H        ASP  44  16.950  -0.496  -6.087
  217    HA   ASP  44           HA       ASP  44  17.208   1.263  -3.750
  218   1HB   ASP  44          2HB       ASP  44  18.192   1.380  -6.617
  219   2HB   ASP  44          1HB       ASP  44  18.768   2.450  -5.339
  220    QB   ASP  44           QB       ASP  44  18.480   1.915  -5.978
  221    H    TYR  45           H        TYR  45  17.345   3.816  -4.356
  222    HA   TYR  45           HA       TYR  45  14.526   4.459  -5.305
  223   1HB   TYR  45          2HB       TYR  45  14.719   6.338  -3.859
  224   2HB   TYR  45          1HB       TYR  45  15.521   5.030  -2.987
  225    HD1  TYR  45          1HD       TYR  45  15.981   8.182  -4.808
  226    HD2  TYR  45          2HD       TYR  45  17.979   4.923  -2.848
  227    HE1  TYR  45          1HE       TYR  45  18.082   9.499  -4.761
  228    HE2  TYR  45          2HE       TYR  45  20.080   6.241  -2.800
  229    HH   TYR  45           HH       TYR  45  20.835   8.499  -2.923
  230    QB   TYR  45           QB       TYR  45  15.120   5.684  -3.423
  231    QD   TYR  45           QD       TYR  45  16.980   6.552  -3.828
  232    QE   TYR  45           QE       TYR  45  19.081   7.870  -3.781
  233    QR   TYR  45           QR       TYR  45  18.031   7.211  -3.804
  234    H    VAL  46           H        VAL  46  14.231   5.523  -7.223
  235    HA   VAL  46           HA       VAL  46  16.735   6.519  -8.614
  236    HB   VAL  46           HB       VAL  46  15.358   6.345 -10.590
  237   1HG1  VAL  46          1HG1      VAL  46  15.884   4.208  -8.908
  238   2HG1  VAL  46          3HG1      VAL  46  14.169   4.014  -9.267
  239   3HG1  VAL  46          2HG1      VAL  46  15.343   4.081 -10.581
  240   1HG2  VAL  46          1HG2      VAL  46  13.216   6.710  -8.610
  241   2HG2  VAL  46          3HG2      VAL  46  13.233   7.103 -10.329
  242   3HG2  VAL  46          2HG2      VAL  46  12.858   5.462  -9.803
  243    MG1  VAL  46           QG1      VAL  46  15.132   4.101  -9.585
  244    MG2  VAL  46           QG2      VAL  46  13.102   6.425  -9.581
  245    QG   VAL  46           QQG      VAL  46  14.117   5.263  -9.583
  246    H    LEU  47           H        LEU  47  14.997   8.252 -10.355
  247    HA   LEU  47           HA       LEU  47  15.440  10.773  -9.023
  248   1HB   LEU  47          2HB       LEU  47  13.461   9.925 -11.163
  249   2HB   LEU  47          1HB       LEU  47  13.911  11.596 -10.825
  250    HG   LEU  47           HG       LEU  47  15.784   9.385 -11.720
  251   1HD1  LEU  47          1HD1      LEU  47  14.194  11.411 -13.102
  252   2HD1  LEU  47          3HD1      LEU  47  15.912  11.544 -13.475
  253   3HD1  LEU  47          2HD1      LEU  47  15.062  10.026 -13.764
  254   1HD2  LEU  47          3HD2      LEU  47  16.214  12.202 -10.747
  255   2HD2  LEU  47          2HD2      LEU  47  17.123  10.743 -10.354
  256   3HD2  LEU  47          1HD2      LEU  47  17.318  11.504 -11.933
  257    MD1  LEU  47           QD1      LEU  47  15.056  10.994 -13.447
  258    MD2  LEU  47           QD2      LEU  47  16.885  11.483 -11.011
  259    QB   LEU  47           QB       LEU  47  13.686  10.761 -10.994
  260    QD   LEU  47           QQD      LEU  47  15.971  11.238 -12.229
  261    H    LEU  48           H        LEU  48  12.602   8.600  -9.052
  262    HA   LEU  48           HA       LEU  48  11.493  10.230  -6.744
  263   1HB   LEU  48          2HB       LEU  48  10.530  10.114  -9.501
  264   2HB   LEU  48          1HB       LEU  48   9.290   9.620  -8.348
  265    HG   LEU  48           HG       LEU  48  10.885  12.036  -7.650
  266   1HD1  LEU  48          3HD1      LEU  48  10.097  12.002 -10.197
  267   2HD1  LEU  48          2HD1      LEU  48   8.545  12.420  -9.471
  268   3HD1  LEU  48          1HD1      LEU  48   9.946  13.458  -9.214
  269   1HD2  LEU  48          3HD2      LEU  48   8.576  10.727  -6.740
  270   2HD2  LEU  48          2HD2      LEU  48   9.155  12.310  -6.223
  271   3HD2  LEU  48          1HD2      LEU  48   7.982  12.186  -7.533
  272    MD1  LEU  48           QD1      LEU  48   9.529  12.627  -9.628
  273    MD2  LEU  48           QD2      LEU  48   8.571  11.741  -6.832
  274    QB   LEU  48           QB       LEU  48   9.910   9.867  -8.925
  275    QD   LEU  48           QQD      LEU  48   9.050  12.184  -8.230
  276    HA   PRO  49           HA       PRO  49  10.996   5.943  -5.558
  277   1HB   PRO  49          2HB       PRO  49  10.116   6.472  -3.020
  278   2HB   PRO  49          1HB       PRO  49  11.828   6.551  -3.483
  279   1HG   PRO  49          2HG       PRO  49   9.851   8.760  -3.168
  280   2HG   PRO  49          1HG       PRO  49  11.553   8.694  -2.681
  281   1HD   PRO  49          2HD       PRO  49  10.715   9.983  -4.914
  282   2HD   PRO  49          1HD       PRO  49  12.314   9.218  -4.786
  283    QB   PRO  49           QB       PRO  49  10.972   6.511  -3.252
  284    QG   PRO  49           QG       PRO  49  10.702   8.727  -2.925
  285    QD   PRO  49           QD       PRO  49  11.514   9.601  -4.850
  286    H    ALA  50           H        ALA  50   9.114   6.447  -7.302
  287    HA   ALA  50           HA       ALA  50   6.459   7.108  -6.448
  288   1HB   ALA  50          1HB       ALA  50   7.660   5.254  -8.504
  289   2HB   ALA  50          2HB       ALA  50   6.914   6.833  -8.752
  290   3HB   ALA  50          3HB       ALA  50   5.911   5.432  -8.369
  291    MB   ALA  50           QB       ALA  50   6.828   5.840  -8.541
  292    H    LEU  51           H        LEU  51   8.315   4.097  -6.047
  293    HA   LEU  51           HA       LEU  51   6.020   2.444  -5.247
  294   1HB   LEU  51          2HB       LEU  51   7.883   0.992  -4.386
  295   2HB   LEU  51          1HB       LEU  51   8.148   1.547  -6.039
  296    HG   LEU  51           HG       LEU  51   9.295   3.581  -4.620
  297   1HD1  LEU  51          2HD1      LEU  51   8.827   1.875  -2.608
  298   2HD1  LEU  51          1HD1      LEU  51  10.351   1.193  -3.176
  299   3HD1  LEU  51          3HD1      LEU  51  10.278   2.878  -2.659
  300   1HD2  LEU  51          2HD2      LEU  51  10.213   1.158  -6.037
  301   2HD2  LEU  51          1HD2      LEU  51  10.707   2.838  -6.246
  302   3HD2  LEU  51          3HD2      LEU  51  11.411   1.867  -4.954
  303    MD1  LEU  51           QD1      LEU  51   9.819   1.982  -2.814
  304    MD2  LEU  51           QD2      LEU  51  10.777   1.955  -5.746
  305    QB   LEU  51           QB       LEU  51   8.016   1.269  -5.212
  306    QD   LEU  51           QQD      LEU  51  10.298   1.968  -4.280
  307    H    ALA  52           H        ALA  52   8.523   4.252  -3.385
  308    HA   ALA  52           HA       ALA  52   7.620   3.542  -0.751
  309   1HB   ALA  52          3HB       ALA  52   9.589   4.998  -1.779
  310   2HB   ALA  52          2HB       ALA  52   8.490   6.331  -1.422
  311   3HB   ALA  52          1HB       ALA  52   9.043   5.272  -0.124
  312    MB   ALA  52           QB       ALA  52   9.041   5.534  -1.108
  313    H    ILE  53           H        ILE  53   6.558   6.256  -2.873
  314    HA   ILE  53           HA       ILE  53   4.603   7.306  -0.971
  315    HB   ILE  53           HB       ILE  53   4.769   7.357  -4.003
  316   1HG1  ILE  53          2HG1      ILE  53   5.741   9.340  -1.921
  317   2HG1  ILE  53          1HG1      ILE  53   6.779   8.209  -2.791
  318   1HG2  ILE  53          3HG2      ILE  53   3.255   9.116  -2.049
  319   2HG2  ILE  53          2HG2      ILE  53   3.431   9.449  -3.772
  320   3HG2  ILE  53          1HG2      ILE  53   2.544   8.022  -3.236
  321   1HD1  ILE  53          3HD1      ILE  53   5.470   9.349  -4.877
  322   2HD1  ILE  53          2HD1      ILE  53   5.482  10.701  -3.744
  323   3HD1  ILE  53          1HD1      ILE  53   7.001   9.958  -4.245
  324    MG   ILE  53           QG2      ILE  53   3.077   8.862  -3.019
  325    MD   ILE  53           QD1      ILE  53   5.984  10.003  -4.288
  326    QG   ILE  53           QG1      ILE  53   6.260   8.775  -2.356
  327    H    PHE  54           H        PHE  54   4.331   4.985  -3.710
  328    HA   PHE  54           HA       PHE  54   1.489   4.597  -3.620
  329   1HB   PHE  54          2HB       PHE  54   3.141   3.727  -5.277
  330   2HB   PHE  54          1HB       PHE  54   3.696   2.562  -4.075
  331    HD1  PHE  54          1HD       PHE  54   0.846   3.577  -6.209
  332    HD2  PHE  54          2HD       PHE  54   2.384   0.619  -3.501
  333    HE1  PHE  54          1HE       PHE  54  -0.984   2.034  -6.855
  334    HE2  PHE  54          2HE       PHE  54   0.554  -0.923  -4.147
  335    HZ   PHE  54           HZ       PHE  54  -1.131  -0.216  -5.824
  336    QB   PHE  54           QB       PHE  54   3.419   3.144  -4.676
  337    QD   PHE  54           QD       PHE  54   1.615   2.098  -4.855
  338    QE   PHE  54           QE       PHE  54  -0.215   0.555  -5.501
  339    QR   PHE  54           QR       PHE  54   0.334   1.018  -5.307
  340    H    ILE  55           H        ILE  55   4.061   2.845  -1.784
  341    HA   ILE  55           HA       ILE  55   2.222   1.134  -0.314
  342    HB   ILE  55           HB       ILE  55   4.937   2.300   0.386
  343   1HG1  ILE  55          2HG1      ILE  55   4.963   1.099  -1.739
  344   2HG1  ILE  55          1HG1      ILE  55   5.746   0.105  -0.509
  345   1HG2  ILE  55          2HG2      ILE  55   3.210   0.193   1.633
  346   2HG2  ILE  55          1HG2      ILE  55   4.957  -0.045   1.627
  347   3HG2  ILE  55          3HG2      ILE  55   4.264   1.378   2.405
  348   1HD1  ILE  55          2HD1      ILE  55   3.439  -0.973  -0.150
  349   2HD1  ILE  55          1HD1      ILE  55   2.971  -0.200  -1.665
  350   3HD1  ILE  55          3HD1      ILE  55   4.281  -1.381  -1.645
  351    MG   ILE  55           QG2      ILE  55   4.144   0.509   1.888
  352    MD   ILE  55           QD1      ILE  55   3.564  -0.851  -1.153
  353    QG   ILE  55           QG1      ILE  55   5.355   0.602  -1.124
  354    H    GLY  56           H        GLY  56   3.658   4.340   0.484
  355   1HA   GLY  56          1HA       GLY  56   2.861   5.948   2.036
  356   2HA   GLY  56          2HA       GLY  56   2.526   4.589   3.109
  357    QA   GLY  56           QA       GLY  56   2.693   5.269   2.572
  358    H    LEU  57           H        LEU  57   1.120   5.714  -0.026
  359    HA   LEU  57           HA       LEU  57  -1.434   6.501   1.108
  360   1HB   LEU  57          2HB       LEU  57  -0.448   6.973  -1.172
  361   2HB   LEU  57          1HB       LEU  57  -0.848   5.315  -1.621
  362    HG   LEU  57           HG       LEU  57  -2.984   7.061  -0.444
  363   1HD1  LEU  57          1HD1      LEU  57  -1.633   7.420  -3.053
  364   2HD1  LEU  57          3HD1      LEU  57  -3.393   7.355  -3.123
  365   3HD1  LEU  57          2HD1      LEU  57  -2.595   8.564  -2.117
  366   1HD2  LEU  57          3HD2      LEU  57  -2.747   4.473  -1.694
  367   2HD2  LEU  57          2HD2      LEU  57  -4.164   5.204  -0.939
  368   3HD2  LEU  57          1HD2      LEU  57  -3.830   5.487  -2.648
  369    MD1  LEU  57           QD1      LEU  57  -2.540   7.780  -2.764
  370    MD2  LEU  57           QD2      LEU  57  -3.580   5.054  -1.760
  371    QB   LEU  57           QB       LEU  57  -0.648   6.144  -1.397
  372    QD   LEU  57           QQD      LEU  57  -3.060   6.417  -2.262
  373    H    THR  58           H        THR  58  -0.224   3.356  -0.107
  374    HA   THR  58           HA       THR  58  -2.786   1.969   0.021
  375    HB   THR  58           HB       THR  58   0.067   1.001   0.390
  376    HG1  THR  58          1HG       THR  58   0.205   1.093  -1.721
  377   1HG2  THR  58          1HG2      THR  58  -2.472  -0.365   0.433
  378   2HG2  THR  58          3HG2      THR  58  -1.532  -0.890  -0.964
  379   3HG2  THR  58          2HG2      THR  58  -0.854  -1.029   0.658
  380    MG   THR  58           QG2      THR  58  -1.620  -0.762   0.042
  381    H    ILE  59           H        ILE  59  -0.042   2.085   2.363
  382    HA   ILE  59           HA       ILE  59  -1.449   0.578   4.429
  383    HB   ILE  59           HB       ILE  59   0.779   2.635   4.538
  384   1HG1  ILE  59          2HG1      ILE  59   1.292   0.792   3.025
  385   2HG1  ILE  59          1HG1      ILE  59   2.212   0.574   4.514
  386   1HG2  ILE  59          2HG2      ILE  59  -0.202   0.564   6.516
  387   2HG2  ILE  59          1HG2      ILE  59   1.408   1.277   6.606
  388   3HG2  ILE  59          3HG2      ILE  59  -0.020   2.299   6.773
  389   1HD1  ILE  59          2HD1      ILE  59   0.043  -0.794   5.234
  390   2HD1  ILE  59          1HD1      ILE  59  -0.130  -0.978   3.489
  391   3HD1  ILE  59          3HD1      ILE  59   1.330  -1.553   4.296
  392    MG   ILE  59           QG2      ILE  59   0.395   1.380   6.632
  393    MD   ILE  59           QD1      ILE  59   0.414  -1.108   4.340
  394    QG   ILE  59           QG1      ILE  59   1.752   0.683   3.770
  395    H    TYR  60           H        TYR  60  -1.106   4.127   3.847
  396    HA   TYR  60           HA       TYR  60  -2.485   4.969   6.254
  397   1HB   TYR  60          2HB       TYR  60  -1.200   6.368   4.609
  398   2HB   TYR  60          1HB       TYR  60  -2.531   6.186   3.468
  399    HD1  TYR  60          1HD       TYR  60  -4.443   7.569   3.594
  400    HD2  TYR  60          2HD       TYR  60  -1.674   7.452   6.876
  401    HE1  TYR  60          1HE       TYR  60  -5.633   9.461   4.664
  402    HE2  TYR  60          2HE       TYR  60  -2.865   9.349   7.945
  403    HH   TYR  60           HH       TYR  60  -5.925  10.486   6.781
  404    QB   TYR  60           QB       TYR  60  -1.866   6.277   4.038
  405    QD   TYR  60           QD       TYR  60  -3.059   7.511   5.235
  406    QE   TYR  60           QE       TYR  60  -4.249   9.405   6.305
  407    QR   TYR  60           QR       TYR  60  -3.654   8.458   5.770
  408    H    ALA  61           H        ALA  61  -3.758   4.378   2.930
  409    HA   ALA  61           HA       ALA  61  -6.533   4.860   3.523
  410   1HB   ALA  61          2HB       ALA  61  -5.127   2.941   1.648
  411   2HB   ALA  61          3HB       ALA  61  -5.630   4.593   1.289
  412   3HB   ALA  61          1HB       ALA  61  -6.843   3.334   1.538
  413    MB   ALA  61           QB       ALA  61  -5.867   3.623   1.491
  414    H    ILE  62           H        ILE  62  -4.597   1.850   3.866
  415    HA   ILE  62           HA       ILE  62  -6.836   0.146   4.591
  416    HB   ILE  62           HB       ILE  62  -3.879   0.165   5.233
  417   1HG1  ILE  62          2HG1      ILE  62  -5.450  -1.595   3.336
  418   2HG1  ILE  62          1HG1      ILE  62  -4.754  -0.052   2.835
  419   1HG2  ILE  62          2HG2      ILE  62  -6.040  -1.575   6.206
  420   2HG2  ILE  62          1HG2      ILE  62  -4.732  -2.456   5.415
  421   3HG2  ILE  62          3HG2      ILE  62  -4.384  -1.407   6.789
  422   1HD1  ILE  62          2HD1      ILE  62  -2.975  -1.960   4.285
  423   2HD1  ILE  62          1HD1      ILE  62  -3.391  -2.342   2.613
  424   3HD1  ILE  62          3HD1      ILE  62  -2.587  -0.819   2.997
  425    MG   ILE  62           QG2      ILE  62  -5.052  -1.813   6.137
  426    MD   ILE  62           QD1      ILE  62  -2.985  -1.707   3.298
  427    QG   ILE  62           QG1      ILE  62  -5.102  -0.823   3.085
  428    H    GLN  63           H        GLN  63  -4.573   2.071   6.642
  429    HA   GLN  63           HA       GLN  63  -5.667   1.235   9.186
  430   1HB   GLN  63          2HB       GLN  63  -3.584   2.560   8.687
  431   2HB   GLN  63          1HB       GLN  63  -4.611   3.961   8.382
  432   1HG   GLN  63          2HG       GLN  63  -5.549   3.726  10.684
  433   2HG   GLN  63          1HG       GLN  63  -4.407   2.414  10.981
  434   1HE2  GLN  63          1HE2      GLN  63  -2.592   3.088  12.109
  435   2HE2  GLN  63          2HE2      GLN  63  -1.841   4.715  11.918
  436    QB   GLN  63           QB       GLN  63  -4.098   3.261   8.535
  437    QG   GLN  63           QG       GLN  63  -4.978   3.070  10.832
  438    QE   GLN  63           QE2      GLN  63  -2.217   3.901  12.014
  439    H    ARG  64           H        ARG  64  -6.655   3.873   6.958
  440    HA   ARG  64           HA       ARG  64  -8.705   4.957   8.743
  441   1HB   ARG  64          2HB       ARG  64  -8.246   4.929   5.749
  442   2HB   ARG  64          1HB       ARG  64  -9.527   5.875   6.506
  443   1HG   ARG  64          2HG       ARG  64  -7.788   6.963   7.950
  444   2HG   ARG  64          1HG       ARG  64  -6.551   6.120   7.017
  445   1HD   ARG  64          2HD       ARG  64  -8.623   7.981   5.799
  446   2HD   ARG  64          1HD       ARG  64  -6.949   8.444   6.171
  447    HE   ARG  64           HE       ARG  64  -6.244   6.432   4.669
  448   1HH1  ARG  64          1HH1      ARG  64  -6.674   8.438   2.742
  449   2HH1  ARG  64          2HH1      ARG  64  -8.035   7.939   1.795
  450   1HH2  ARG  64          1HH2      ARG  64  -9.186   5.677   4.158
  451   2HH2  ARG  64          2HH2      ARG  64  -9.457   6.375   2.597
  452    QB   ARG  64           QB       ARG  64  -8.887   5.402   6.128
  453    QG   ARG  64           QG       ARG  64  -7.169   6.542   7.484
  454    QD   ARG  64           QD       ARG  64  -7.786   8.212   5.985
  455    QH1  ARG  64           QH1      ARG  64  -7.355   8.189   2.269
  456    QH2  ARG  64           QH2      ARG  64  -9.321   6.026   3.378
  457    H    LYS  65           H        LYS  65  -8.907   2.687   5.942
  458    HA   LYS  65           HA       LYS  65 -11.732   2.145   6.177
  459   1HB   LYS  65          2HB       LYS  65  -9.280   0.868   5.075
  460   2HB   LYS  65          1HB       LYS  65 -10.691  -0.177   5.250
  461   1HG   LYS  65          2HG       LYS  65 -10.986   0.732   3.103
  462   2HG   LYS  65          1HG       LYS  65 -11.986   1.779   4.110
  463   1HD   LYS  65          2HD       LYS  65 -10.081   3.379   4.277
  464   2HD   LYS  65          1HD       LYS  65  -9.161   2.356   3.172
  465   1HE   LYS  65          2HE       LYS  65 -11.763   2.852   2.034
  466   2HE   LYS  65          1HE       LYS  65 -11.001   4.395   2.466
  467   1HZ   LYS  65          2HZ       LYS  65  -8.932   3.544   1.432
  468   2HZ   LYS  65          1HZ       LYS  65  -9.799   2.195   0.872
  469   3HZ   LYS  65          3HZ       LYS  65 -10.200   3.748   0.320
  470    QB   LYS  65           QB       LYS  65  -9.986   0.345   5.162
  471    QD   LYS  65           QD       LYS  65  -9.621   2.868   3.725
  472    QG   LYS  65           QG       LYS  65 -11.486   1.255   3.607
  473    QE   LYS  65           QE       LYS  65 -11.382   3.623   2.250
  474    QZ   LYS  65           QZ       LYS  65  -9.644   3.162   0.875
  475    H    ARG  66           H        ARG  66  -8.945   0.298   7.557
  476    HA   ARG  66           HA       ARG  66 -10.505  -1.591   9.064
  477   1HB   ARG  66          2HB       ARG  66  -7.843  -0.222   9.540
  478   2HB   ARG  66          1HB       ARG  66  -8.403  -1.585  10.510
  479   1HG   ARG  66          2HG       ARG  66  -8.667  -2.907   8.392
  480   2HG   ARG  66          1HG       ARG  66  -7.930  -1.566   7.516
  481   1HD   ARG  66          2HD       ARG  66  -5.902  -1.775   8.977
  482   2HD   ARG  66          1HD       ARG  66  -6.634  -3.212   9.717
  483    HE   ARG  66           HE       ARG  66  -6.732  -3.427   6.793
  484   1HH1  ARG  66          1HH1      ARG  66  -3.940  -2.644   8.417
  485   2HH1  ARG  66          2HH1      ARG  66  -3.129  -4.159   8.201
  486   1HH2  ARG  66          1HH2      ARG  66  -5.953  -5.814   7.060
  487   2HH2  ARG  66          2HH2      ARG  66  -4.267  -5.952   7.434
  488    QB   ARG  66           QB       ARG  66  -8.123  -0.903  10.025
  489    QG   ARG  66           QG       ARG  66  -8.298  -2.236   7.954
  490    QD   ARG  66           QD       ARG  66  -6.268  -2.494   9.347
  491    QH1  ARG  66           QH1      ARG  66  -3.534  -3.402   8.309
  492    QH2  ARG  66           QH2      ARG  66  -5.110  -5.883   7.247
  493    H    GLN  67           H        GLN  67  -9.462   1.742   9.878
  494    HA   GLN  67           HA       GLN  67 -11.693   1.946  11.855
  495   1HB   GLN  67          2HB       GLN  67  -9.885   0.654  13.026
  496   2HB   GLN  67          1HB       GLN  67  -8.800   2.022  12.776
  497   1HG   GLN  67          2HG       GLN  67 -10.282   3.477  14.072
  498   2HG   GLN  67          1HG       GLN  67 -11.437   2.158  14.267
  499   1HE2  GLN  67          1HE2      GLN  67 -10.570   3.228  16.636
  500   2HE2  GLN  67          2HE2      GLN  67  -9.355   2.141  17.400
  501    QB   GLN  67           QB       GLN  67  -9.343   1.338  12.901
  502    QG   GLN  67           QG       GLN  67 -10.860   2.818  14.170
  503    QE   GLN  67           QE2      GLN  67  -9.962   2.685  17.018
  504    H    ALA  68           H        ALA  68 -11.711   4.174  12.877
  505    HA   ALA  68           HA       ALA  68 -11.452   6.536  12.602
  506   1HB   ALA  68          1HB       ALA  68  -8.991   5.506  12.712
  507   2HB   ALA  68          2HB       ALA  68  -9.248   7.219  12.378
  508   3HB   ALA  68          3HB       ALA  68  -8.931   6.100  11.052
  509    MB   ALA  68           QB       ALA  68  -9.057   6.275  12.048
  510    H    ASP  69           H        ASP  69 -13.206   5.492  10.805
  511    HA   ASP  69           HA       ASP  69 -12.355   6.106   8.014
  512   1HB   ASP  69          2HB       ASP  69 -14.039   4.375   8.867
  513   2HB   ASP  69          1HB       ASP  69 -15.139   5.725   9.143
  514    QB   ASP  69           QB       ASP  69 -14.589   5.050   9.005

  No H/Q in entry =         514
  Start of MODEL    6
    1    H    THR  24           H        THR  24 -17.829  -4.108   5.587
    2    HA   THR  24           HA       THR  24 -16.022  -5.740   5.417
    3    HB   THR  24           HB       THR  24 -17.683  -6.199   3.686
    4    HG1  THR  24          1HG       THR  24 -15.831  -7.466   3.597
    5   1HG2  THR  24          1HG2      THR  24 -16.101  -4.151   2.124
    6   2HG2  THR  24          3HG2      THR  24 -17.227  -5.272   1.356
    7   3HG2  THR  24          2HG2      THR  24 -17.815  -4.105   2.543
    8    MG   THR  24           QG2      THR  24 -17.048  -4.510   2.008
    9    HA   PRO  25           HA       PRO  25 -12.827  -2.579   4.034
   10   1HB   PRO  25          2HB       PRO  25 -11.559  -2.334   6.452
   11   2HB   PRO  25          1HB       PRO  25 -12.918  -1.304   5.957
   12   1HG   PRO  25          2HG       PRO  25 -12.896  -3.673   7.759
   13   2HG   PRO  25          1HG       PRO  25 -13.811  -2.164   7.890
   14   1HD   PRO  25          2HD       PRO  25 -14.895  -4.499   7.004
   15   2HD   PRO  25          1HD       PRO  25 -15.475  -2.897   6.496
   16    QB   PRO  25           QB       PRO  25 -12.239  -1.819   6.205
   17    QG   PRO  25           QG       PRO  25 -13.353  -2.918   7.824
   18    QD   PRO  25           QD       PRO  25 -15.185  -3.698   6.750
   19    H    VAL  26           H        VAL  26 -13.003  -5.674   5.546
   20    HA   VAL  26           HA       VAL  26 -10.152  -6.305   5.679
   21    HB   VAL  26           HB       VAL  26 -12.674  -7.948   5.302
   22   1HG1  VAL  26          1HG1      VAL  26  -9.801  -8.738   5.750
   23   2HG1  VAL  26          3HG1      VAL  26 -11.113  -9.750   6.355
   24   3HG1  VAL  26          2HG1      VAL  26 -10.974  -9.427   4.626
   25   1HG2  VAL  26          2HG2      VAL  26 -11.599  -6.486   7.491
   26   2HG2  VAL  26          1HG2      VAL  26 -12.980  -7.583   7.504
   27   3HG2  VAL  26          3HG2      VAL  26 -11.363  -8.196   7.852
   28    MG1  VAL  26           QG1      VAL  26 -10.629  -9.305   5.577
   29    MG2  VAL  26           QG2      VAL  26 -11.981  -7.422   7.616
   30    QG   VAL  26           QQG      VAL  26 -11.305  -8.363   6.596
   31    H    LEU  27           H        LEU  27 -12.604  -6.533   3.085
   32    HA   LEU  27           HA       LEU  27 -11.065  -8.115   1.218
   33   1HB   LEU  27          2HB       LEU  27 -13.481  -7.372   1.137
   34   2HB   LEU  27          1HB       LEU  27 -12.912  -5.778   0.640
   35    HG   LEU  27           HG       LEU  27 -11.968  -8.200  -0.858
   36   1HD1  LEU  27          2HD1      LEU  27 -14.663  -6.843  -1.119
   37   2HD1  LEU  27          1HD1      LEU  27 -13.946  -7.813  -2.406
   38   3HD1  LEU  27          3HD1      LEU  27 -14.344  -8.557  -0.857
   39   1HD2  LEU  27          3HD2      LEU  27 -12.254  -5.250  -1.278
   40   2HD2  LEU  27          2HD2      LEU  27 -10.905  -6.312  -1.680
   41   3HD2  LEU  27          1HD2      LEU  27 -12.350  -6.301  -2.691
   42    MD1  LEU  27           QD1      LEU  27 -14.318  -7.738  -1.461
   43    MD2  LEU  27           QD2      LEU  27 -11.836  -5.954  -1.883
   44    QB   LEU  27           QB       LEU  27 -13.197  -6.575   0.888
   45    QD   LEU  27           QQD      LEU  27 -13.077  -6.846  -1.672
   46    H    VAL  28           H        VAL  28 -11.032  -4.614   1.934
   47    HA   VAL  28           HA       VAL  28  -9.383  -3.787  -0.294
   48    HB   VAL  28           HB       VAL  28  -9.535  -2.781   2.566
   49   1HG1  VAL  28          1HG1      VAL  28  -7.772  -1.950   0.687
   50   2HG1  VAL  28          3HG1      VAL  28  -9.159  -0.947   0.261
   51   3HG1  VAL  28          2HG1      VAL  28  -8.479  -0.868   1.886
   52   1HG2  VAL  28          2HG2      VAL  28 -11.351  -2.629   0.204
   53   2HG2  VAL  28          1HG2      VAL  28 -11.743  -2.651   1.924
   54   3HG2  VAL  28          3HG2      VAL  28 -11.169  -1.164   1.171
   55    MG1  VAL  28           QG1      VAL  28  -8.470  -1.255   0.944
   56    MG2  VAL  28           QG2      VAL  28 -11.421  -2.148   1.100
   57    QG   VAL  28           QQG      VAL  28  -9.945  -1.702   1.022
   58    H    ILE  29           H        ILE  29  -8.483  -4.928   3.002
   59    HA   ILE  29           HA       ILE  29  -5.609  -4.576   2.622
   60    HB   ILE  29           HB       ILE  29  -7.251  -6.482   4.320
   61   1HG1  ILE  29          2HG1      ILE  29  -6.027  -3.793   5.007
   62   2HG1  ILE  29          1HG1      ILE  29  -7.722  -4.022   4.575
   63   1HG2  ILE  29          1HG2      ILE  29  -4.372  -6.084   4.008
   64   2HG2  ILE  29          3HG2      ILE  29  -4.908  -5.826   5.668
   65   3HG2  ILE  29          2HG2      ILE  29  -5.241  -7.359   4.863
   66   1HD1  ILE  29          3HD1      ILE  29  -7.424  -5.937   6.493
   67   2HD1  ILE  29          2HD1      ILE  29  -6.306  -4.706   7.079
   68   3HD1  ILE  29          1HD1      ILE  29  -8.003  -4.304   6.819
   69    MG   ILE  29           QG2      ILE  29  -4.840  -6.423   4.846
   70    MD   ILE  29           QD1      ILE  29  -7.244  -4.982   6.797
   71    QG   ILE  29           QG1      ILE  29  -6.875  -3.907   4.791
   72    H    LEU  30           H        LEU  30  -7.847  -7.290   1.956
   73    HA   LEU  30           HA       LEU  30  -5.803  -9.264   1.343
   74   1HB   LEU  30          2HB       LEU  30  -8.278  -9.554   1.751
   75   2HB   LEU  30          1HB       LEU  30  -8.561  -8.913   0.132
   76    HG   LEU  30           HG       LEU  30  -6.640 -11.187   0.482
   77   1HD1  LEU  30          2HD1      LEU  30  -9.662 -11.423   0.348
   78   2HD1  LEU  30          1HD1      LEU  30  -8.532 -12.768   0.186
   79   3HD1  LEU  30          3HD1      LEU  30  -8.646 -11.892   1.713
   80   1HD2  LEU  30          2HD2      LEU  30  -8.366  -9.995  -1.664
   81   2HD2  LEU  30          1HD2      LEU  30  -6.664 -10.457  -1.729
   82   3HD2  LEU  30          3HD2      LEU  30  -7.917 -11.697  -1.777
   83    MD1  LEU  30           QD1      LEU  30  -8.946 -12.028   0.749
   84    MD2  LEU  30           QD2      LEU  30  -7.649 -10.716  -1.723
   85    QB   LEU  30           QB       LEU  30  -8.420  -9.233   0.941
   86    QD   LEU  30           QQD      LEU  30  -8.298 -11.372  -0.487
   87    H    LEU  31           H        LEU  31  -7.553  -6.911  -0.749
   88    HA   LEU  31           HA       LEU  31  -6.322  -7.778  -3.240
   89   1HB   LEU  31          2HB       LEU  31  -8.330  -6.337  -2.945
   90   2HB   LEU  31          1HB       LEU  31  -7.291  -5.045  -2.342
   91    HG   LEU  31           HG       LEU  31  -6.002  -5.230  -4.532
   92   1HD1  LEU  31          2HD1      LEU  31  -8.357  -7.030  -5.097
   93   2HD1  LEU  31          1HD1      LEU  31  -7.511  -6.191  -6.397
   94   3HD1  LEU  31          3HD1      LEU  31  -6.645  -7.343  -5.381
   95   1HD2  LEU  31          2HD2      LEU  31  -8.606  -4.051  -3.975
   96   2HD2  LEU  31          1HD2      LEU  31  -7.234  -3.362  -4.843
   97   3HD2  LEU  31          3HD2      LEU  31  -8.402  -4.369  -5.697
   98    MD1  LEU  31           QD1      LEU  31  -7.504  -6.855  -5.625
   99    MD2  LEU  31           QD2      LEU  31  -8.081  -3.927  -4.838
  100    QB   LEU  31           QB       LEU  31  -7.811  -5.691  -2.643
  101    QD   LEU  31           QQD      LEU  31  -7.792  -5.391  -5.232
  102    H    GLY  32           H        GLY  32  -5.377  -5.258  -0.848
  103   1HA   GLY  32          1HA       GLY  32  -3.295  -4.129  -0.654
  104   2HA   GLY  32          2HA       GLY  32  -3.070  -4.349  -2.391
  105    QA   GLY  32           QA       GLY  32  -3.182  -4.239  -1.522
  106    H    VAL  33           H        VAL  33  -3.519  -6.890   0.079
  107    HA   VAL  33           HA       VAL  33  -0.737  -7.541   0.487
  108    HB   VAL  33           HB       VAL  33  -3.297  -9.167   0.456
  109   1HG1  VAL  33          1HG1      VAL  33  -0.472  -9.916   1.137
  110   2HG1  VAL  33          3HG1      VAL  33  -1.792 -10.613   2.076
  111   3HG1  VAL  33          2HG1      VAL  33  -1.718 -10.872   0.333
  112   1HG2  VAL  33          1HG2      VAL  33  -2.511  -7.143   2.124
  113   2HG2  VAL  33          3HG2      VAL  33  -3.589  -8.455   2.601
  114   3HG2  VAL  33          2HG2      VAL  33  -1.866  -8.551   2.968
  115    MG1  VAL  33           QG1      VAL  33  -1.327 -10.467   1.182
  116    MG2  VAL  33           QG2      VAL  33  -2.655  -8.049   2.565
  117    QG   VAL  33           QQG      VAL  33  -1.991  -9.258   1.873
  118    H    VAL  34           H        VAL  34  -3.094  -8.831  -1.909
  119    HA   VAL  34           HA       VAL  34  -1.282 -10.691  -3.183
  120    HB   VAL  34           HB       VAL  34  -3.632  -9.045  -4.161
  121   1HG1  VAL  34          3HG1      VAL  34  -2.025 -11.227  -5.472
  122   2HG1  VAL  34          2HG1      VAL  34  -3.743 -11.055  -5.833
  123   3HG1  VAL  34          1HG1      VAL  34  -2.634  -9.727  -6.171
  124   1HG2  VAL  34          1HG2      VAL  34  -3.368 -11.908  -3.184
  125   2HG2  VAL  34          3HG2      VAL  34  -4.111 -10.578  -2.295
  126   3HG2  VAL  34          2HG2      VAL  34  -4.855 -11.170  -3.779
  127    MG1  VAL  34           QG1      VAL  34  -2.801 -10.670  -5.825
  128    MG2  VAL  34           QG2      VAL  34  -4.111 -11.219  -3.086
  129    QG   VAL  34           QQG      VAL  34  -3.456 -10.944  -4.456
  130    H    GLY  35           H        GLY  35  -1.920  -7.209  -3.832
  131   1HA   GLY  35          1HA       GLY  35  -0.628  -5.705  -5.137
  132   2HA   GLY  35          2HA       GLY  35  -0.294  -7.058  -6.219
  133    QA   GLY  35           QA       GLY  35  -0.461  -6.381  -5.678
  134    H    LEU  36           H        LEU  36   0.571  -6.703  -2.753
  135    HA   LEU  36           HA       LEU  36   3.322  -5.904  -3.173
  136   1HB   LEU  36          2HB       LEU  36   2.012  -5.908  -1.049
  137   2HB   LEU  36          1HB       LEU  36   2.105  -7.669  -1.023
  138    HG   LEU  36           HG       LEU  36   4.639  -7.408  -1.120
  139   1HD1  LEU  36          2HD1      LEU  36   3.948  -4.735  -1.567
  140   2HD1  LEU  36          1HD1      LEU  36   4.550  -4.761   0.090
  141   3HD1  LEU  36          3HD1      LEU  36   5.564  -5.353  -1.225
  142   1HD2  LEU  36          3HD2      LEU  36   3.134  -6.284   1.266
  143   2HD2  LEU  36          2HD2      LEU  36   3.472  -7.987   0.962
  144   3HD2  LEU  36          1HD2      LEU  36   4.795  -6.873   1.307
  145    MD1  LEU  36           QD1      LEU  36   4.688  -4.949  -0.901
  146    MD2  LEU  36           QD2      LEU  36   3.800  -7.048   1.178
  147    QB   LEU  36           QB       LEU  36   2.058  -6.788  -1.036
  148    QD   LEU  36           QQD      LEU  36   4.244  -5.999   0.139
  149    H    SER  37           H        SER  37   1.791  -9.144  -3.073
  150    HA   SER  37           HA       SER  37   4.206 -10.718  -3.050
  151   1HB   SER  37          2HB       SER  37   1.798 -11.416  -2.780
  152   2HB   SER  37          1HB       SER  37   1.606 -11.245  -4.522
  153    HG   SER  37           HG       SER  37   3.429 -12.949  -3.159
  154    QB   SER  37           QB       SER  37   1.702 -11.330  -3.651
  155    H    ALA  38           H        ALA  38   2.294  -9.516  -5.876
  156    HA   ALA  38           HA       ALA  38   3.971 -10.598  -7.938
  157   1HB   ALA  38          2HB       ALA  38   1.777  -9.432  -8.161
  158   2HB   ALA  38          3HB       ALA  38   2.983  -8.796  -9.278
  159   3HB   ALA  38          1HB       ALA  38   2.581  -7.902  -7.812
  160    MB   ALA  38           QB       ALA  38   2.447  -8.710  -8.417
  161    H    LEU  39           H        LEU  39   4.415  -7.710  -5.894
  162    HA   LEU  39           HA       LEU  39   6.998  -7.134  -7.401
  163   1HB   LEU  39          2HB       LEU  39   5.242  -5.381  -7.161
  164   2HB   LEU  39          1HB       LEU  39   5.394  -5.503  -5.408
  165    HG   LEU  39           HG       LEU  39   7.879  -5.003  -5.727
  166   1HD1  LEU  39          3HD1      LEU  39   7.249  -5.359  -8.397
  167   2HD1  LEU  39          2HD1      LEU  39   7.326  -3.603  -8.247
  168   3HD1  LEU  39          1HD1      LEU  39   8.716  -4.590  -7.791
  169   1HD2  LEU  39          1HD2      LEU  39   5.595  -3.302  -5.634
  170   2HD2  LEU  39          3HD2      LEU  39   7.225  -2.952  -5.059
  171   3HD2  LEU  39          2HD2      LEU  39   6.767  -2.545  -6.713
  172    MD1  LEU  39           QD1      LEU  39   7.764  -4.518  -8.145
  173    MD2  LEU  39           QD2      LEU  39   6.529  -2.933  -5.802
  174    QB   LEU  39           QB       LEU  39   5.318  -5.442  -6.284
  175    QD   LEU  39           QQD      LEU  39   7.146  -3.725  -6.973
  176    H    THR  40           H        THR  40   8.704  -8.240  -6.484
  177    HA   THR  40           HA       THR  40   9.130  -7.794  -3.526
  178    HB   THR  40           HB       THR  40   9.500 -10.589  -4.407
  179    HG1  THR  40          1HG       THR  40   7.153 -10.881  -4.163
  180   1HG2  THR  40          2HG2      THR  40   9.574  -9.484  -2.042
  181   2HG2  THR  40          1HG2      THR  40   7.816  -9.590  -2.125
  182   3HG2  THR  40          3HG2      THR  40   8.793 -11.056  -2.223
  183    MG   THR  40           QG2      THR  40   8.728 -10.043  -2.130
  184    H    GLY  41           H        GLY  41  10.520  -6.754  -5.860
  185   1HA   GLY  41          1HA       GLY  41  12.635  -7.196  -7.053
  186   2HA   GLY  41          2HA       GLY  41  13.017  -8.477  -5.901
  187    QA   GLY  41           QA       GLY  41  12.826  -7.837  -6.477
  188    H    TYR  42           H        TYR  42  14.648  -6.114  -6.733
  189    HA   TYR  42           HA       TYR  42  14.749  -4.670  -4.046
  190   1HB   TYR  42          2HB       TYR  42  17.025  -5.924  -5.616
  191   2HB   TYR  42          1HB       TYR  42  17.200  -5.022  -4.109
  192    HD1  TYR  42          1HD       TYR  42  16.347  -8.212  -5.616
  193    HD2  TYR  42          2HD       TYR  42  16.104  -5.894  -2.008
  194    HE1  TYR  42          1HE       TYR  42  15.870 -10.274  -4.323
  195    HE2  TYR  42          2HE       TYR  42  15.626  -7.955  -0.716
  196    HH   TYR  42           HH       TYR  42  15.762 -11.145  -2.228
  197    QB   TYR  42           QB       TYR  42  17.113  -5.473  -4.862
  198    QD   TYR  42           QD       TYR  42  16.226  -7.053  -3.812
  199    QE   TYR  42           QE       TYR  42  15.748  -9.115  -2.519
  200    QR   TYR  42           QR       TYR  42  15.987  -8.084  -3.166
  201    H    LEU  43           H        LEU  43  15.385  -2.498  -4.149
  202    HA   LEU  43           HA       LEU  43  16.592  -1.392  -6.630
  203   1HB   LEU  43          2HB       LEU  43  14.219  -1.852  -7.281
  204   2HB   LEU  43          1HB       LEU  43  13.687  -0.791  -5.975
  205    HG   LEU  43           HG       LEU  43  15.152   1.016  -7.046
  206   1HD1  LEU  43          3HD1      LEU  43  16.419  -0.638  -8.468
  207   2HD1  LEU  43          2HD1      LEU  43  14.956  -0.847  -9.430
  208   3HD1  LEU  43          1HD1      LEU  43  15.756   0.723  -9.371
  209   1HD2  LEU  43          1HD2      LEU  43  12.613   0.766  -7.231
  210   2HD2  LEU  43          3HD2      LEU  43  13.389   1.689  -8.518
  211   3HD2  LEU  43          2HD2      LEU  43  12.896   0.020  -8.804
  212    MD1  LEU  43           QD1      LEU  43  15.710  -0.254  -9.090
  213    MD2  LEU  43           QD2      LEU  43  12.966   0.825  -8.184
  214    QB   LEU  43           QB       LEU  43  13.953  -1.322  -6.628
  215    QD   LEU  43           QQD      LEU  43  14.338   0.285  -8.637
  216    H    ASP  44           H        ASP  44  17.603   0.548  -6.130
  217    HA   ASP  44           HA       ASP  44  17.325   1.533  -3.326
  218   1HB   ASP  44          2HB       ASP  44  19.322   1.381  -5.133
  219   2HB   ASP  44          1HB       ASP  44  18.787   3.033  -5.447
  220    QB   ASP  44           QB       ASP  44  19.054   2.207  -5.290
  221    H    TYR  45           H        TYR  45  17.608   4.281  -3.579
  222    HA   TYR  45           HA       TYR  45  14.797   5.022  -4.352
  223   1HB   TYR  45          2HB       TYR  45  15.237   6.922  -3.011
  224   2HB   TYR  45          1HB       TYR  45  16.180   5.647  -2.239
  225    HD1  TYR  45          1HD       TYR  45  16.307   8.751  -4.170
  226    HD2  TYR  45          2HD       TYR  45  18.633   5.510  -2.577
  227    HE1  TYR  45          1HE       TYR  45  18.381  10.061  -4.530
  228    HE2  TYR  45          2HE       TYR  45  20.708   6.820  -2.937
  229    HH   TYR  45           HH       TYR  45  21.387   9.151  -3.181
  230    QB   TYR  45           QB       TYR  45  15.709   6.284  -2.625
  231    QD   TYR  45           QD       TYR  45  17.470   7.130  -3.374
  232    QE   TYR  45           QE       TYR  45  19.544   8.441  -3.734
  233    QR   TYR  45           QR       TYR  45  18.507   7.786  -3.554
  234    H    VAL  46           H        VAL  46  14.299   5.830  -6.344
  235    HA   VAL  46           HA       VAL  46  16.611   6.895  -8.007
  236    HB   VAL  46           HB       VAL  46  15.160   6.379  -9.864
  237   1HG1  VAL  46          3HG1      VAL  46  16.231   4.449  -8.674
  238   2HG1  VAL  46          2HG1      VAL  46  14.742   4.242  -7.751
  239   3HG1  VAL  46          1HG1      VAL  46  14.735   4.010  -9.499
  240   1HG2  VAL  46          1HG2      VAL  46  13.093   6.663  -7.774
  241   2HG2  VAL  46          3HG2      VAL  46  12.990   6.974  -9.507
  242   3HG2  VAL  46          2HG2      VAL  46  12.814   5.330  -8.895
  243    MG1  VAL  46           QG1      VAL  46  15.236   4.234  -8.641
  244    MG2  VAL  46           QG2      VAL  46  12.966   6.322  -8.725
  245    QG   VAL  46           QQG      VAL  46  14.101   5.278  -8.683
  246    H    LEU  47           H        LEU  47  14.568   8.242  -9.774
  247    HA   LEU  47           HA       LEU  47  14.818  10.921  -8.766
  248   1HB   LEU  47          2HB       LEU  47  14.255  10.177 -11.079
  249   2HB   LEU  47          1HB       LEU  47  12.651   9.708 -10.514
  250    HG   LEU  47           HG       LEU  47  12.373  12.108  -9.702
  251   1HD1  LEU  47          1HD1      LEU  47  14.911  12.360 -11.333
  252   2HD1  LEU  47          3HD1      LEU  47  13.867  13.735 -10.976
  253   3HD1  LEU  47          2HD1      LEU  47  14.650  12.857  -9.662
  254   1HD2  LEU  47          1HD2      LEU  47  12.779  11.619 -12.673
  255   2HD2  LEU  47          3HD2      LEU  47  11.306  11.276 -11.763
  256   3HD2  LEU  47          2HD2      LEU  47  11.843  12.943 -11.977
  257    MD1  LEU  47           QD1      LEU  47  14.476  12.984 -10.657
  258    MD2  LEU  47           QD2      LEU  47  11.976  11.946 -12.137
  259    QB   LEU  47           QB       LEU  47  13.453   9.942 -10.796
  260    QD   LEU  47           QQD      LEU  47  13.226  12.465 -11.397
  261    H    LEU  48           H        LEU  48  12.189   8.522  -8.324
  262    HA   LEU  48           HA       LEU  48  11.268  10.100  -5.929
  263   1HB   LEU  48          2HB       LEU  48  10.206  11.069  -8.010
  264   2HB   LEU  48          1HB       LEU  48   9.437   9.504  -8.272
  265    HG   LEU  48           HG       LEU  48   8.629   9.794  -5.791
  266   1HD1  LEU  48          3HD1      LEU  48  10.121  12.054  -5.918
  267   2HD1  LEU  48          2HD1      LEU  48   8.555  12.694  -6.417
  268   3HD1  LEU  48          1HD1      LEU  48   8.720  11.882  -4.860
  269   1HD2  LEU  48          2HD2      LEU  48   7.205   9.772  -7.856
  270   2HD2  LEU  48          1HD2      LEU  48   6.591  10.857  -6.607
  271   3HD2  LEU  48          3HD2      LEU  48   7.453  11.513  -7.999
  272    MD1  LEU  48           QD1      LEU  48   9.132  12.210  -5.732
  273    MD2  LEU  48           QD2      LEU  48   7.083  10.714  -7.487
  274    QB   LEU  48           QB       LEU  48   9.822  10.287  -8.141
  275    QD   LEU  48           QQD      LEU  48   8.108  11.462  -6.610
  276    HA   PRO  49           HA       PRO  49  10.531   5.891  -4.756
  277   1HB   PRO  49          2HB       PRO  49   9.278   6.396  -2.380
  278   2HB   PRO  49          1HB       PRO  49  11.031   6.573  -2.597
  279   1HG   PRO  49          2HG       PRO  49   8.906   8.661  -2.590
  280   2HG   PRO  49          1HG       PRO  49  10.531   8.704  -1.886
  281   1HD   PRO  49          2HD       PRO  49   9.895   9.902  -4.247
  282   2HD   PRO  49          1HD       PRO  49  11.519   9.283  -3.872
  283    QB   PRO  49           QB       PRO  49  10.154   6.485  -2.488
  284    QG   PRO  49           QG       PRO  49   9.718   8.683  -2.238
  285    QD   PRO  49           QD       PRO  49  10.707   9.592  -4.060
  286    H    ALA  50           H        ALA  50   8.894   6.311  -6.763
  287    HA   ALA  50           HA       ALA  50   6.119   6.850  -6.301
  288   1HB   ALA  50          1HB       ALA  50   7.295   4.706  -8.097
  289   2HB   ALA  50          2HB       ALA  50   7.395   6.431  -8.454
  290   3HB   ALA  50          3HB       ALA  50   5.822   5.637  -8.374
  291    MB   ALA  50           QB       ALA  50   6.837   5.592  -8.308
  292    H    LEU  51           H        LEU  51   7.925   3.759  -5.944
  293    HA   LEU  51           HA       LEU  51   5.567   2.169  -5.248
  294   1HB   LEU  51          2HB       LEU  51   8.514   1.888  -4.569
  295   2HB   LEU  51          1HB       LEU  51   7.323   0.592  -4.460
  296    HG   LEU  51           HG       LEU  51   8.130   2.080  -6.978
  297   1HD1  LEU  51          3HD1      LEU  51   9.741   0.365  -6.133
  298   2HD1  LEU  51          2HD1      LEU  51   8.449  -0.834  -6.194
  299   3HD1  LEU  51          1HD1      LEU  51   9.023  -0.078  -7.681
  300   1HD2  LEU  51          3HD2      LEU  51   5.866   0.244  -6.314
  301   2HD2  LEU  51          2HD2      LEU  51   5.921   1.591  -7.450
  302   3HD2  LEU  51          1HD2      LEU  51   6.649   0.044  -7.882
  303    MD1  LEU  51           QD1      LEU  51   9.071  -0.182  -6.669
  304    MD2  LEU  51           QD2      LEU  51   6.145   0.626  -7.215
  305    QB   LEU  51           QB       LEU  51   7.919   1.240  -4.515
  306    QD   LEU  51           QQD      LEU  51   7.608   0.222  -6.942
  307    H    ALA  52           H        ALA  52   8.135   3.677  -3.206
  308    HA   ALA  52           HA       ALA  52   7.048   2.934  -0.653
  309   1HB   ALA  52          3HB       ALA  52   9.127   4.409  -1.671
  310   2HB   ALA  52          2HB       ALA  52   8.149   5.662  -0.908
  311   3HB   ALA  52          1HB       ALA  52   8.736   4.300   0.045
  312    MB   ALA  52           QB       ALA  52   8.671   4.790  -0.845
  313    H    ILE  53           H        ILE  53   6.326   5.812  -2.695
  314    HA   ILE  53           HA       ILE  53   4.429   6.999  -0.823
  315    HB   ILE  53           HB       ILE  53   5.152   7.153  -3.716
  316   1HG1  ILE  53          2HG1      ILE  53   5.696   9.399  -3.152
  317   2HG1  ILE  53          1HG1      ILE  53   4.680   9.365  -1.711
  318   1HG2  ILE  53          3HG2      ILE  53   2.555   8.127  -2.527
  319   2HG2  ILE  53          2HG2      ILE  53   3.294   8.945  -3.903
  320   3HG2  ILE  53          1HG2      ILE  53   2.811   7.255  -4.038
  321   1HD1  ILE  53          2HD1      ILE  53   7.069   7.541  -2.035
  322   2HD1  ILE  53          1HD1      ILE  53   7.202   9.148  -1.320
  323   3HD1  ILE  53          3HD1      ILE  53   6.187   7.926  -0.557
  324    MG   ILE  53           QG2      ILE  53   2.887   8.109  -3.489
  325    MD   ILE  53           QD1      ILE  53   6.820   8.205  -1.304
  326    QG   ILE  53           QG1      ILE  53   5.188   9.382  -2.431
  327    H    PHE  54           H        PHE  54   3.994   4.771  -3.620
  328    HA   PHE  54           HA       PHE  54   1.132   4.632  -3.589
  329   1HB   PHE  54          2HB       PHE  54   2.745   3.630  -5.215
  330   2HB   PHE  54          1HB       PHE  54   3.148   2.403  -4.015
  331    HD1  PHE  54          1HD       PHE  54   1.675   0.562  -3.557
  332    HD2  PHE  54          2HD       PHE  54   0.437   3.748  -6.160
  333    HE1  PHE  54          1HE       PHE  54  -0.283  -0.783  -4.273
  334    HE2  PHE  54          2HE       PHE  54  -1.519   2.403  -6.876
  335    HZ   PHE  54           HZ       PHE  54  -1.879   0.138  -5.932
  336    QB   PHE  54           QB       PHE  54   2.946   3.017  -4.615
  337    QD   PHE  54           QD       PHE  54   1.056   2.155  -4.858
  338    QE   PHE  54           QE       PHE  54  -0.901   0.810  -5.574
  339    QR   PHE  54           QR       PHE  54  -0.314   1.213  -5.360
  340    H    ILE  55           H        ILE  55   3.502   2.700  -1.674
  341    HA   ILE  55           HA       ILE  55   1.490   1.113  -0.283
  342    HB   ILE  55           HB       ILE  55   4.255   2.070   0.531
  343   1HG1  ILE  55          2HG1      ILE  55   4.314   0.920  -1.608
  344   2HG1  ILE  55          1HG1      ILE  55   4.927  -0.181  -0.373
  345   1HG2  ILE  55          1HG2      ILE  55   2.326   0.088   1.671
  346   2HG2  ILE  55          3HG2      ILE  55   4.042  -0.315   1.701
  347   3HG2  ILE  55          2HG2      ILE  55   3.466   1.147   2.501
  348   1HD1  ILE  55          3HD1      ILE  55   2.377  -0.892  -0.213
  349   2HD1  ILE  55          2HD1      ILE  55   2.327  -0.258  -1.859
  350   3HD1  ILE  55          1HD1      ILE  55   3.424  -1.578  -1.454
  351    MG   ILE  55           QG2      ILE  55   3.278   0.306   1.958
  352    MD   ILE  55           QD1      ILE  55   2.710  -0.909  -1.175
  353    QG   ILE  55           QG1      ILE  55   4.621   0.369  -0.991
  354    H    GLY  56           H        GLY  56   3.128   4.206   0.570
  355   1HA   GLY  56          1HA       GLY  56   2.384   5.873   2.087
  356   2HA   GLY  56          2HA       GLY  56   1.960   4.541   3.162
  357    QA   GLY  56           QA       GLY  56   2.172   5.207   2.625
  358    H    LEU  57           H        LEU  57   0.658   5.679  -0.011
  359    HA   LEU  57           HA       LEU  57  -1.860   6.635   1.088
  360   1HB   LEU  57          2HB       LEU  57  -1.118   5.467  -1.615
  361   2HB   LEU  57          1HB       LEU  57  -2.564   6.425  -1.294
  362    HG   LEU  57           HG       LEU  57   0.305   7.351  -0.969
  363   1HD1  LEU  57          2HD1      LEU  57  -1.859   7.802  -3.009
  364   2HD1  LEU  57          1HD1      LEU  57  -0.656   9.058  -2.713
  365   3HD1  LEU  57          3HD1      LEU  57  -0.148   7.460  -3.263
  366   1HD2  LEU  57          2HD2      LEU  57  -2.353   8.529  -0.195
  367   2HD2  LEU  57          1HD2      LEU  57  -0.836   8.521   0.706
  368   3HD2  LEU  57          3HD2      LEU  57  -1.035   9.598  -0.676
  369    MD1  LEU  57           QD1      LEU  57  -0.888   8.107  -2.995
  370    MD2  LEU  57           QD2      LEU  57  -1.408   8.883  -0.055
  371    QB   LEU  57           QB       LEU  57  -1.841   5.946  -1.455
  372    QD   LEU  57           QQD      LEU  57  -1.148   8.495  -1.525
  373    H    THR  58           H        THR  58  -0.801   3.416  -0.066
  374    HA   THR  58           HA       THR  58  -3.435   2.168   0.018
  375    HB   THR  58           HB       THR  58  -0.663   1.030   0.503
  376    HG1  THR  58          1HG       THR  58  -0.680   0.742  -1.742
  377   1HG2  THR  58          2HG2      THR  58  -3.340  -0.143   0.188
  378   2HG2  THR  58          1HG2      THR  58  -2.128  -0.828  -0.895
  379   3HG2  THR  58          3HG2      THR  58  -1.869  -0.856   0.850
  380    MG   THR  58           QG2      THR  58  -2.446  -0.609   0.048
  381    H    ILE  59           H        ILE  59  -0.748   2.189   2.428
  382    HA   ILE  59           HA       ILE  59  -2.290   0.798   4.484
  383    HB   ILE  59           HB       ILE  59   0.046   2.727   4.633
  384   1HG1  ILE  59          2HG1      ILE  59   0.503   0.866   3.126
  385   2HG1  ILE  59          1HG1      ILE  59   1.368   0.590   4.640
  386   1HG2  ILE  59          1HG2      ILE  59  -1.459   1.346   6.670
  387   2HG2  ILE  59          3HG2      ILE  59   0.180   0.697   6.604
  388   3HG2  ILE  59          2HG2      ILE  59  -0.076   2.422   6.862
  389   1HD1  ILE  59          1HD1      ILE  59  -0.706  -0.754   5.374
  390   2HD1  ILE  59          3HD1      ILE  59  -1.174  -0.723   3.673
  391   3HD1  ILE  59          2HD1      ILE  59   0.337  -1.493   4.158
  392    MG   ILE  59           QG2      ILE  59  -0.452   1.488   6.712
  393    MD   ILE  59           QD1      ILE  59  -0.514  -0.990   4.402
  394    QG   ILE  59           QG1      ILE  59   0.936   0.728   3.883
  395    H    TYR  60           H        TYR  60  -1.710   4.309   3.862
  396    HA   TYR  60           HA       TYR  60  -3.103   5.269   6.217
  397   1HB   TYR  60          2HB       TYR  60  -2.487   6.271   3.449
  398   2HB   TYR  60          1HB       TYR  60  -3.529   7.236   4.491
  399    HD1  TYR  60          1HD       TYR  60  -0.404   7.341   3.397
  400    HD2  TYR  60          2HD       TYR  60  -2.410   6.809   7.158
  401    HE1  TYR  60          1HE       TYR  60   1.584   8.226   4.582
  402    HE2  TYR  60          2HE       TYR  60  -0.419   7.694   8.344
  403    HH   TYR  60           HH       TYR  60   2.273   9.112   6.605
  404    QB   TYR  60           QB       TYR  60  -3.008   6.754   3.970
  405    QD   TYR  60           QD       TYR  60  -1.407   7.075   5.277
  406    QE   TYR  60           QE       TYR  60   0.583   7.960   6.463
  407    QR   TYR  60           QR       TYR  60  -0.412   7.518   5.870
  408    H    ALA  61           H        ALA  61  -4.309   4.726   2.860
  409    HA   ALA  61           HA       ALA  61  -7.068   5.385   3.389
  410   1HB   ALA  61          2HB       ALA  61  -6.158   3.185   1.544
  411   2HB   ALA  61          3HB       ALA  61  -5.704   4.861   1.233
  412   3HB   ALA  61          1HB       ALA  61  -7.407   4.400   1.274
  413    MB   ALA  61           QB       ALA  61  -6.423   4.149   1.350
  414    H    ILE  62           H        ILE  62  -5.322   2.260   3.720
  415    HA   ILE  62           HA       ILE  62  -7.672   0.674   4.342
  416    HB   ILE  62           HB       ILE  62  -4.754   0.496   5.132
  417   1HG1  ILE  62          2HG1      ILE  62  -5.847   0.383   2.652
  418   2HG1  ILE  62          1HG1      ILE  62  -4.422  -0.548   3.117
  419   1HG2  ILE  62          1HG2      ILE  62  -7.032  -1.476   5.412
  420   2HG2  ILE  62          3HG2      ILE  62  -5.343  -1.984   5.382
  421   3HG2  ILE  62          2HG2      ILE  62  -5.921  -0.919   6.663
  422   1HD1  ILE  62          1HD1      ILE  62  -7.229  -1.604   3.483
  423   2HD1  ILE  62          3HD1      ILE  62  -6.309  -1.866   2.002
  424   3HD1  ILE  62          2HD1      ILE  62  -5.715  -2.507   3.533
  425    MG   ILE  62           QG2      ILE  62  -6.098  -1.460   5.819
  426    MD   ILE  62           QD1      ILE  62  -6.418  -1.992   3.006
  427    QG   ILE  62           QG1      ILE  62  -5.134  -0.082   2.885
  428    H    GLN  63           H        GLN  63  -5.353   2.388   6.518
  429    HA   GLN  63           HA       GLN  63  -6.622   1.576   8.993
  430   1HB   GLN  63          2HB       GLN  63  -5.143   4.093   8.167
  431   2HB   GLN  63          1HB       GLN  63  -5.464   3.636   9.841
  432   1HG   GLN  63          2HG       GLN  63  -4.214   1.550   9.537
  433   2HG   GLN  63          1HG       GLN  63  -3.927   1.950   7.844
  434   1HE2  GLN  63          1HE2      GLN  63  -1.714   1.503   9.570
  435   2HE2  GLN  63          2HE2      GLN  63  -0.895   3.084   9.843
  436    QB   GLN  63           QB       GLN  63  -5.304   3.864   9.004
  437    QG   GLN  63           QG       GLN  63  -4.070   1.750   8.690
  438    QE   GLN  63           QE2      GLN  63  -1.305   2.294   9.706
  439    H    ARG  64           H        ARG  64  -7.275   4.335   6.792
  440    HA   ARG  64           HA       ARG  64  -9.258   5.593   8.538
  441   1HB   ARG  64          2HB       ARG  64  -8.047   6.593   6.590
  442   2HB   ARG  64          1HB       ARG  64  -9.002   5.573   5.514
  443   1HG   ARG  64          2HG       ARG  64 -11.077   6.596   6.452
  444   2HG   ARG  64          1HG       ARG  64 -10.070   7.685   7.407
  445   1HD   ARG  64          2HD       ARG  64 -10.046   7.489   4.372
  446   2HD   ARG  64          1HD       ARG  64 -10.778   8.801   5.321
  447    HE   ARG  64           HE       ARG  64  -8.502   9.365   6.229
  448   1HH1  ARG  64          1HH1      ARG  64  -8.858   8.607   2.991
  449   2HH1  ARG  64          2HH1      ARG  64  -7.206   8.185   2.691
  450   1HH2  ARG  64          1HH2      ARG  64  -6.329   8.155   6.046
  451   2HH2  ARG  64          2HH2      ARG  64  -5.774   7.928   4.422
  452    QB   ARG  64           QB       ARG  64  -8.524   6.083   6.052
  453    QG   ARG  64           QG       ARG  64 -10.574   7.140   6.929
  454    QD   ARG  64           QD       ARG  64 -10.412   8.145   4.847
  455    QH1  ARG  64           QH1      ARG  64  -8.032   8.396   2.841
  456    QH2  ARG  64           QH2      ARG  64  -6.052   8.042   5.234
  457    H    LYS  65           H        LYS  65  -9.622   3.442   5.660
  458    HA   LYS  65           HA       LYS  65 -12.487   3.186   5.810
  459   1HB   LYS  65          2HB       LYS  65 -10.280   1.286   4.959
  460   2HB   LYS  65          1HB       LYS  65 -11.986   1.031   4.587
  461   1HG   LYS  65          2HG       LYS  65 -12.040   3.247   3.453
  462   2HG   LYS  65          1HG       LYS  65 -10.312   3.418   3.755
  463   1HD   LYS  65          2HD       LYS  65  -9.926   1.298   2.485
  464   2HD   LYS  65          1HD       LYS  65 -11.645   1.262   2.093
  465   1HE   LYS  65          2HE       LYS  65 -11.372   2.787   0.435
  466   2HE   LYS  65          1HE       LYS  65 -10.461   3.871   1.505
  467   1HZ   LYS  65          3HZ       LYS  65  -8.527   2.436   1.249
  468   2HZ   LYS  65          2HZ       LYS  65  -9.395   1.422   0.198
  469   3HZ   LYS  65          1HZ       LYS  65  -9.040   3.019  -0.259
  470    QB   LYS  65           QB       LYS  65 -11.133   1.158   4.773
  471    QD   LYS  65           QD       LYS  65 -10.786   1.280   2.289
  472    QG   LYS  65           QG       LYS  65 -11.176   3.333   3.604
  473    QE   LYS  65           QE       LYS  65 -10.916   3.329   0.970
  474    QZ   LYS  65           QZ       LYS  65  -8.987   2.292   0.396
  475    H    ARG  66           H        ARG  66  -9.937   1.072   7.258
  476    HA   ARG  66           HA       ARG  66 -11.740  -0.699   8.652
  477   1HB   ARG  66          2HB       ARG  66  -8.974   0.378   9.284
  478   2HB   ARG  66          1HB       ARG  66  -9.706  -0.980  10.139
  479   1HG   ARG  66          2HG       ARG  66  -9.909  -2.230   8.040
  480   2HG   ARG  66          1HG       ARG  66  -9.249  -0.861   7.144
  481   1HD   ARG  66          2HD       ARG  66  -7.429  -2.421   7.505
  482   2HD   ARG  66          1HD       ARG  66  -7.165  -1.060   8.614
  483    HE   ARG  66           HE       ARG  66  -8.885  -3.025   9.915
  484   1HH1  ARG  66          1HH1      ARG  66  -5.800  -1.646   9.958
  485   2HH1  ARG  66          2HH1      ARG  66  -4.991  -3.009  10.657
  486   1HH2  ARG  66          1HH2      ARG  66  -7.706  -5.136  10.312
  487   2HH2  ARG  66          2HH2      ARG  66  -6.069  -4.983  10.858
  488    QB   ARG  66           QB       ARG  66  -9.340  -0.301   9.711
  489    QG   ARG  66           QG       ARG  66  -9.579  -1.546   7.592
  490    QD   ARG  66           QD       ARG  66  -7.297  -1.740   8.060
  491    QH1  ARG  66           QH1      ARG  66  -5.395  -2.327  10.308
  492    QH2  ARG  66           QH2      ARG  66  -6.888  -5.060  10.585
  493    H    GLN  67           H        GLN  67 -10.416   2.505   9.555
  494    HA   GLN  67           HA       GLN  67 -12.675   2.861  11.485
  495   1HB   GLN  67          2HB       GLN  67 -10.983   1.459  12.690
  496   2HB   GLN  67          1HB       GLN  67  -9.795   2.739  12.440
  497   1HG   GLN  67          2HG       GLN  67 -11.201   4.316  13.696
  498   2HG   GLN  67          1HG       GLN  67 -12.421   3.064  13.921
  499   1HE2  GLN  67          1HE2      GLN  67 -11.435   4.177  16.252
  500   2HE2  GLN  67          2HE2      GLN  67 -10.298   3.022  17.038
  501    QB   GLN  67           QB       GLN  67 -10.389   2.099  12.565
  502    QG   GLN  67           QG       GLN  67 -11.811   3.690  13.809
  503    QE   GLN  67           QE2      GLN  67 -10.866   3.599  16.645
  504    H    ALA  68           H        ALA  68 -13.076   5.060  11.838
  505    HA   ALA  68           HA       ALA  68 -11.441   6.925  10.161
  506   1HB   ALA  68          1HB       ALA  68 -14.029   6.822  11.595
  507   2HB   ALA  68          3HB       ALA  68 -13.291   8.420  11.500
  508   3HB   ALA  68          2HB       ALA  68 -13.644   7.523  10.024
  509    MB   ALA  68           QB       ALA  68 -13.655   7.588  11.040
  510    H    ASP  69           H        ASP  69 -12.676   7.276  13.529
  511    HA   ASP  69           HA       ASP  69  -9.939   7.746  14.592
  512   1HB   ASP  69          2HB       ASP  69 -10.375  10.182  15.035
  513   2HB   ASP  69          1HB       ASP  69 -10.250   9.803  13.316
  514    QB   ASP  69           QB       ASP  69 -10.312   9.992  14.175

  No H/Q in entry =         514
  Start of MODEL    7
    1    H    THR  24           H        THR  24 -13.980  -5.881  11.347
    2    HA   THR  24           HA       THR  24 -13.587  -4.190   9.695
    3    HB   THR  24           HB       THR  24 -11.246  -5.319   8.487
    4    HG1  THR  24          1HG       THR  24 -10.776  -6.744   9.950
    5   1HG2  THR  24          1HG2      THR  24 -11.918  -2.943   9.445
    6   2HG2  THR  24          3HG2      THR  24 -11.150  -3.560  10.907
    7   3HG2  THR  24          2HG2      THR  24 -10.230  -3.450   9.407
    8    MG   THR  24           QG2      THR  24 -11.100  -3.318   9.919
    9    HA   PRO  25           HA       PRO  25 -14.792  -5.487   5.658
   10   1HB   PRO  25          2HB       PRO  25 -13.371  -3.919   3.940
   11   2HB   PRO  25          1HB       PRO  25 -14.650  -3.274   4.986
   12   1HG   PRO  25          2HG       PRO  25 -11.706  -3.110   5.279
   13   2HG   PRO  25          1HG       PRO  25 -12.956  -1.943   5.736
   14   1HD   PRO  25          2HD       PRO  25 -11.661  -3.678   7.477
   15   2HD   PRO  25          1HD       PRO  25 -13.203  -2.852   7.799
   16    QB   PRO  25           QB       PRO  25 -14.010  -3.596   4.463
   17    QG   PRO  25           QG       PRO  25 -12.331  -2.527   5.508
   18    QD   PRO  25           QD       PRO  25 -12.432  -3.265   7.638
   19    H    VAL  26           H        VAL  26 -14.245  -7.583   5.131
   20    HA   VAL  26           HA       VAL  26 -11.516  -8.551   4.935
   21    HB   VAL  26           HB       VAL  26 -14.159  -9.443   3.744
   22   1HG1  VAL  26          1HG1      VAL  26 -11.443 -10.759   3.804
   23   2HG1  VAL  26          3HG1      VAL  26 -12.922 -11.716   3.727
   24   3HG1  VAL  26          2HG1      VAL  26 -12.541 -10.573   2.437
   25   1HG2  VAL  26          2HG2      VAL  26 -12.596 -10.189   6.234
   26   2HG2  VAL  26          1HG2      VAL  26 -14.178  -9.415   6.162
   27   3HG2  VAL  26          3HG2      VAL  26 -13.994 -11.093   5.654
   28    MG1  VAL  26           QG1      VAL  26 -12.302 -11.016   3.323
   29    MG2  VAL  26           QG2      VAL  26 -13.589 -10.232   6.017
   30    QG   VAL  26           QQG      VAL  26 -12.946 -10.624   4.670
   31    H    LEU  27           H        LEU  27 -13.777  -7.266   2.463
   32    HA   LEU  27           HA       LEU  27 -12.234  -7.915   0.124
   33   1HB   LEU  27          2HB       LEU  27 -14.536  -6.985   0.234
   34   2HB   LEU  27          1HB       LEU  27 -13.872  -5.438   0.761
   35    HG   LEU  27           HG       LEU  27 -12.474  -5.459  -1.372
   36   1HD1  LEU  27          3HD1      LEU  27 -14.203  -7.878  -1.759
   37   2HD1  LEU  27          2HD1      LEU  27 -13.783  -6.899  -3.165
   38   3HD1  LEU  27          1HD1      LEU  27 -12.510  -7.635  -2.190
   39   1HD2  LEU  27          2HD2      LEU  27 -15.368  -5.008  -1.046
   40   2HD2  LEU  27          1HD2      LEU  27 -14.135  -3.945  -1.726
   41   3HD2  LEU  27          3HD2      LEU  27 -14.860  -5.207  -2.723
   42    MD1  LEU  27           QD1      LEU  27 -13.499  -7.471  -2.372
   43    MD2  LEU  27           QD2      LEU  27 -14.788  -4.720  -1.832
   44    QB   LEU  27           QB       LEU  27 -14.204  -6.211   0.498
   45    QD   LEU  27           QQD      LEU  27 -14.143  -6.095  -2.102
   46    H    VAL  28           H        VAL  28 -12.061  -5.039   2.272
   47    HA   VAL  28           HA       VAL  28 -10.006  -3.650   0.761
   48    HB   VAL  28           HB       VAL  28 -10.731  -3.737   3.705
   49   1HG1  VAL  28          1HG1      VAL  28  -8.787  -2.101   2.152
   50   2HG1  VAL  28          3HG1      VAL  28  -9.788  -1.244   3.326
   51   3HG1  VAL  28          2HG1      VAL  28  -8.755  -2.573   3.850
   52   1HG2  VAL  28          2HG2      VAL  28 -11.580  -1.934   1.416
   53   2HG2  VAL  28          1HG2      VAL  28 -12.593  -3.116   2.245
   54   3HG2  VAL  28          3HG2      VAL  28 -12.020  -1.688   3.106
   55    MG1  VAL  28           QG1      VAL  28  -9.110  -1.973   3.109
   56    MG2  VAL  28           QG2      VAL  28 -12.064  -2.246   2.255
   57    QG   VAL  28           QQG      VAL  28 -10.587  -2.109   2.682
   58    H    ILE  29           H        ILE  29  -9.761  -5.907   3.566
   59    HA   ILE  29           HA       ILE  29  -6.837  -5.825   3.667
   60    HB   ILE  29           HB       ILE  29  -8.880  -7.918   4.485
   61   1HG1  ILE  29          2HG1      ILE  29  -7.561  -5.701   6.084
   62   2HG1  ILE  29          1HG1      ILE  29  -9.200  -5.624   5.439
   63   1HG2  ILE  29          2HG2      ILE  29  -5.969  -7.833   4.641
   64   2HG2  ILE  29          1HG2      ILE  29  -6.708  -7.969   6.237
   65   3HG2  ILE  29          3HG2      ILE  29  -7.069  -9.166   4.994
   66   1HD1  ILE  29          2HD1      ILE  29  -9.006  -8.100   6.789
   67   2HD1  ILE  29          1HD1      ILE  29  -8.269  -6.903   7.853
   68   3HD1  ILE  29          3HD1      ILE  29  -9.925  -6.681   7.290
   69    MG   ILE  29           QG2      ILE  29  -6.582  -8.323   5.291
   70    MD   ILE  29           QD1      ILE  29  -9.066  -7.228   7.310
   71    QG   ILE  29           QG1      ILE  29  -8.380  -5.662   5.761
   72    H    LEU  30           H        LEU  30  -9.181  -7.927   1.955
   73    HA   LEU  30           HA       LEU  30  -7.221  -9.855   0.989
   74   1HB   LEU  30          2HB       LEU  30  -9.700 -10.080   1.041
   75   2HB   LEU  30          1HB       LEU  30  -9.818  -8.862  -0.230
   76    HG   LEU  30           HG       LEU  30  -8.301 -10.356  -1.630
   77   1HD1  LEU  30          3HD1      LEU  30  -8.721 -12.032   0.807
   78   2HD1  LEU  30          2HD1      LEU  30  -8.706 -12.851  -0.755
   79   3HD1  LEU  30          1HD1      LEU  30  -7.308 -11.908  -0.239
   80   1HD2  LEU  30          2HD2      LEU  30 -10.841 -10.178  -1.797
   81   2HD2  LEU  30          1HD2      LEU  30 -10.146 -11.681  -2.405
   82   3HD2  LEU  30          3HD2      LEU  30 -10.920 -11.644  -0.820
   83    MD1  LEU  30           QD1      LEU  30  -8.245 -12.264  -0.062
   84    MD2  LEU  30           QD2      LEU  30 -10.636 -11.167  -1.674
   85    QB   LEU  30           QB       LEU  30  -9.759  -9.471   0.406
   86    QD   LEU  30           QQD      LEU  30  -9.440 -11.716  -0.868
   87    H    LEU  31           H        LEU  31  -8.529  -6.825  -0.452
   88    HA   LEU  31           HA       LEU  31  -7.088  -7.066  -2.971
   89   1HB   LEU  31          2HB       LEU  31  -9.018  -5.563  -2.345
   90   2HB   LEU  31          1HB       LEU  31  -7.876  -4.571  -1.435
   91    HG   LEU  31           HG       LEU  31  -7.267  -5.240  -4.294
   92   1HD1  LEU  31          1HD1      LEU  31  -9.448  -3.482  -3.288
   93   2HD1  LEU  31          3HD1      LEU  31  -8.442  -2.835  -4.585
   94   3HD1  LEU  31          2HD1      LEU  31  -9.318  -4.348  -4.820
   95   1HD2  LEU  31          3HD2      LEU  31  -6.196  -3.592  -2.210
   96   2HD2  LEU  31          2HD2      LEU  31  -5.577  -3.819  -3.846
   97   3HD2  LEU  31          1HD2      LEU  31  -6.748  -2.542  -3.515
   98    MD1  LEU  31           QD1      LEU  31  -9.069  -3.555  -4.231
   99    MD2  LEU  31           QD2      LEU  31  -6.174  -3.318  -3.190
  100    QB   LEU  31           QB       LEU  31  -8.447  -5.067  -1.890
  101    QD   LEU  31           QQD      LEU  31  -7.621  -3.436  -3.711
  102    H    GLY  32           H        GLY  32  -6.247  -5.420   0.123
  103   1HA   GLY  32          1HA       GLY  32  -4.122  -4.622   0.827
  104   2HA   GLY  32          2HA       GLY  32  -3.716  -4.364  -0.871
  105    QA   GLY  32           QA       GLY  32  -3.919  -4.493  -0.022
  106    H    VAL  33           H        VAL  33  -4.631  -7.441   0.695
  107    HA   VAL  33           HA       VAL  33  -1.970  -8.462   1.146
  108    HB   VAL  33           HB       VAL  33  -4.630  -9.721   0.425
  109   1HG1  VAL  33          3HG1      VAL  33  -1.959 -10.933   0.788
  110   2HG1  VAL  33          2HG1      VAL  33  -3.241 -11.667   1.751
  111   3HG1  VAL  33          1HG1      VAL  33  -3.393 -11.586  -0.004
  112   1HG2  VAL  33          3HG2      VAL  33  -3.932  -8.378   2.663
  113   2HG2  VAL  33          2HG2      VAL  33  -5.041  -9.748   2.683
  114   3HG2  VAL  33          1HG2      VAL  33  -3.343  -9.984   3.095
  115    MG1  VAL  33           QG1      VAL  33  -2.864 -11.396   0.845
  116    MG2  VAL  33           QG2      VAL  33  -4.106  -9.370   2.814
  117    QG   VAL  33           QQG      VAL  33  -3.485 -10.383   1.829
  118    H    VAL  34           H        VAL  34  -4.121  -8.796  -1.723
  119    HA   VAL  34           HA       VAL  34  -2.304 -10.380  -3.317
  120    HB   VAL  34           HB       VAL  34  -4.408  -8.301  -3.978
  121   1HG1  VAL  34          3HG1      VAL  34  -2.686 -10.010  -5.708
  122   2HG1  VAL  34          2HG1      VAL  34  -4.395  -9.911  -6.135
  123   3HG1  VAL  34          1HG1      VAL  34  -3.420  -8.443  -6.049
  124   1HG2  VAL  34          1HG2      VAL  34  -4.626 -10.786  -2.781
  125   2HG2  VAL  34          3HG2      VAL  34  -5.919  -9.964  -3.656
  126   3HG2  VAL  34          2HG2      VAL  34  -4.910 -11.153  -4.482
  127    MG1  VAL  34           QG1      VAL  34  -3.500  -9.454  -5.964
  128    MG2  VAL  34           QG2      VAL  34  -5.152 -10.634  -3.640
  129    QG   VAL  34           QQG      VAL  34  -4.326 -10.044  -4.802
  130    H    GLY  35           H        GLY  35  -2.629  -6.811  -2.986
  131   1HA   GLY  35          1HA       GLY  35  -1.107  -5.131  -3.692
  132   2HA   GLY  35          2HA       GLY  35  -0.715  -6.169  -5.065
  133    QA   GLY  35           QA       GLY  35  -0.911  -5.650  -4.378
  134    H    LEU  36           H        LEU  36  -0.276  -6.817  -1.559
  135    HA   LEU  36           HA       LEU  36   2.545  -6.180  -1.452
  136   1HB   LEU  36          2HB       LEU  36   0.982  -6.622   0.441
  137   2HB   LEU  36          1HB       LEU  36   0.967  -8.329   0.000
  138    HG   LEU  36           HG       LEU  36   3.503  -8.285   0.248
  139   1HD1  LEU  36          3HD1      LEU  36   2.849  -5.498   0.763
  140   2HD1  LEU  36          2HD1      LEU  36   3.744  -6.204   2.109
  141   3HD1  LEU  36          1HD1      LEU  36   4.424  -6.240   0.482
  142   1HD2  LEU  36          2HD2      LEU  36   1.654  -8.975   2.008
  143   2HD2  LEU  36          1HD2      LEU  36   3.341  -8.849   2.507
  144   3HD2  LEU  36          3HD2      LEU  36   2.217  -7.536   2.857
  145    MD1  LEU  36           QD1      LEU  36   3.672  -5.981   1.118
  146    MD2  LEU  36           QD2      LEU  36   2.404  -8.453   2.457
  147    QB   LEU  36           QB       LEU  36   0.974  -7.476   0.221
  148    QD   LEU  36           QQD      LEU  36   3.038  -7.217   1.788
  149    H    SER  37           H        SER  37   0.849  -9.229  -2.307
  150    HA   SER  37           HA       SER  37   3.193 -10.903  -2.511
  151   1HB   SER  37          2HB       SER  37   1.691 -12.350  -3.657
  152   2HB   SER  37          1HB       SER  37   0.664 -11.389  -2.597
  153    HG   SER  37           HG       SER  37  -0.290 -10.682  -4.320
  154    QB   SER  37           QB       SER  37   1.178 -11.870  -3.127
  155    H    ALA  38           H        ALA  38   1.522  -8.986  -5.085
  156    HA   ALA  38           HA       ALA  38   3.329  -9.623  -7.227
  157   1HB   ALA  38          3HB       ALA  38   1.224  -8.405  -7.464
  158   2HB   ALA  38          1HB       ALA  38   2.534  -7.409  -8.100
  159   3HB   ALA  38          2HB       ALA  38   1.860  -7.068  -6.506
  160    MB   ALA  38           QB       ALA  38   1.873  -7.627  -7.357
  161    H    LEU  39           H        LEU  39   3.651  -7.271  -4.561
  162    HA   LEU  39           HA       LEU  39   6.368  -6.487  -5.695
  163   1HB   LEU  39          2HB       LEU  39   4.627  -4.758  -5.247
  164   2HB   LEU  39          1HB       LEU  39   4.623  -5.237  -3.548
  165    HG   LEU  39           HG       LEU  39   7.140  -4.778  -3.567
  166   1HD1  LEU  39          3HD1      LEU  39   6.761  -4.570  -6.279
  167   2HD1  LEU  39          2HD1      LEU  39   6.772  -2.876  -5.788
  168   3HD1  LEU  39          1HD1      LEU  39   8.148  -3.912  -5.410
  169   1HD2  LEU  39          3HD2      LEU  39   4.883  -3.042  -3.308
  170   2HD2  LEU  39          2HD2      LEU  39   6.451  -2.912  -2.510
  171   3HD2  LEU  39          1HD2      LEU  39   6.185  -2.126  -4.066
  172    MD1  LEU  39           QD1      LEU  39   7.227  -3.786  -5.826
  173    MD2  LEU  39           QD2      LEU  39   5.840  -2.693  -3.295
  174    QB   LEU  39           QB       LEU  39   4.625  -4.997  -4.398
  175    QD   LEU  39           QQD      LEU  39   6.533  -3.240  -4.560
  176    H    THR  40           H        THR  40   7.883  -7.948  -4.909
  177    HA   THR  40           HA       THR  40   8.039  -8.114  -1.880
  178    HB   THR  40           HB       THR  40   8.514 -10.612  -3.416
  179    HG1  THR  40          1HG       THR  40   6.633 -10.565  -4.313
  180   1HG2  THR  40          1HG2      THR  40   8.543 -10.197  -0.857
  181   2HG2  THR  40          3HG2      THR  40   6.784 -10.189  -0.984
  182   3HG2  THR  40          2HG2      THR  40   7.696 -11.624  -1.453
  183    MG   THR  40           QG2      THR  40   7.675 -10.670  -1.098
  184    H    GLY  41           H        GLY  41   9.640  -6.593  -3.814
  185   1HA   GLY  41          1HA       GLY  41  11.914  -7.420  -4.929
  186   2HA   GLY  41          2HA       GLY  41  12.268  -8.025  -3.309
  187    QA   GLY  41           QA       GLY  41  12.091  -7.723  -4.119
  188    H    TYR  42           H        TYR  42  14.023  -6.646  -2.872
  189    HA   TYR  42           HA       TYR  42  13.317  -3.981  -1.874
  190   1HB   TYR  42          2HB       TYR  42  15.857  -5.501  -2.478
  191   2HB   TYR  42          1HB       TYR  42  15.901  -3.866  -1.817
  192    HD1  TYR  42          1HD       TYR  42  14.771  -7.344  -1.191
  193    HD2  TYR  42          2HD       TYR  42  15.296  -3.416   0.466
  194    HE1  TYR  42          1HE       TYR  42  14.351  -8.247   1.080
  195    HE2  TYR  42          2HE       TYR  42  14.876  -4.319   2.737
  196    HH   TYR  42           HH       TYR  42  14.128  -6.107   3.895
  197    QB   TYR  42           QB       TYR  42  15.879  -4.684  -2.147
  198    QD   TYR  42           QD       TYR  42  15.033  -5.380  -0.363
  199    QE   TYR  42           QE       TYR  42  14.613  -6.283   1.909
  200    QR   TYR  42           QR       TYR  42  14.823  -5.831   0.773
  201    H    LEU  43           H        LEU  43  14.667  -1.984  -2.618
  202    HA   LEU  43           HA       LEU  43  15.459  -1.832  -5.444
  203   1HB   LEU  43          2HB       LEU  43  13.002  -2.242  -5.650
  204   2HB   LEU  43          1HB       LEU  43  12.706  -0.779  -4.710
  205    HG   LEU  43           HG       LEU  43  14.090   0.465  -6.457
  206   1HD1  LEU  43          2HD1      LEU  43  13.730  -2.209  -7.834
  207   2HD1  LEU  43          1HD1      LEU  43  14.107  -0.724  -8.707
  208   3HD1  LEU  43          3HD1      LEU  43  15.242  -1.360  -7.514
  209   1HD2  LEU  43          3HD2      LEU  43  11.447  -0.862  -7.082
  210   2HD2  LEU  43          2HD2      LEU  43  11.736   0.784  -6.519
  211   3HD2  LEU  43          1HD2      LEU  43  12.165   0.329  -8.168
  212    MD1  LEU  43           QD1      LEU  43  14.360  -1.431  -8.019
  213    MD2  LEU  43           QD2      LEU  43  11.783   0.084  -7.256
  214    QB   LEU  43           QB       LEU  43  12.854  -1.511  -5.180
  215    QD   LEU  43           QQD      LEU  43  13.071  -0.674  -7.637
  216    H    ASP  44           H        ASP  44  16.823  -0.082  -5.534
  217    HA   ASP  44           HA       ASP  44  16.969   1.796  -3.275
  218   1HB   ASP  44          2HB       ASP  44  18.095   1.758  -6.092
  219   2HB   ASP  44          1HB       ASP  44  18.602   2.903  -4.850
  220    QB   ASP  44           QB       ASP  44  18.348   2.330  -5.471
  221    H    TYR  45           H        TYR  45  17.176   4.316  -4.098
  222    HA   TYR  45           HA       TYR  45  14.397   4.889  -5.221
  223   1HB   TYR  45          2HB       TYR  45  14.467   6.828  -3.834
  224   2HB   TYR  45          1HB       TYR  45  15.172   5.544  -2.852
  225    HD1  TYR  45          1HD       TYR  45  15.827   8.636  -4.713
  226    HD2  TYR  45          2HD       TYR  45  17.607   5.425  -2.482
  227    HE1  TYR  45          1HE       TYR  45  17.925   9.942  -4.507
  228    HE2  TYR  45          2HE       TYR  45  19.706   6.732  -2.276
  229    HH   TYR  45           HH       TYR  45  19.963  10.019  -3.639
  230    QB   TYR  45           QB       TYR  45  14.819   6.186  -3.343
  231    QD   TYR  45           QD       TYR  45  16.717   7.031  -3.597
  232    QE   TYR  45           QE       TYR  45  18.815   8.337  -3.392
  233    QR   TYR  45           QR       TYR  45  17.766   7.684  -3.494
  234    H    VAL  46           H        VAL  46  14.236   5.924  -7.172
  235    HA   VAL  46           HA       VAL  46  16.829   6.852  -8.428
  236    HB   VAL  46           HB       VAL  46  15.553   6.700 -10.470
  237   1HG1  VAL  46          3HG1      VAL  46  16.125   4.561  -9.056
  238   2HG1  VAL  46          2HG1      VAL  46  14.376   4.463  -8.843
  239   3HG1  VAL  46          1HG1      VAL  46  15.072   4.412 -10.463
  240   1HG2  VAL  46          1HG2      VAL  46  13.324   7.167  -8.609
  241   2HG2  VAL  46          3HG2      VAL  46  13.448   7.540 -10.329
  242   3HG2  VAL  46          2HG2      VAL  46  12.984   5.920  -9.810
  243    MG1  VAL  46           QG1      VAL  46  15.191   4.478  -9.454
  244    MG2  VAL  46           QG2      VAL  46  13.252   6.875  -9.583
  245    QG   VAL  46           QQG      VAL  46  14.221   5.677  -9.518
  246    H    LEU  47           H        LEU  47  15.258   8.628 -10.272
  247    HA   LEU  47           HA       LEU  47  15.684  11.137  -8.881
  248   1HB   LEU  47          2HB       LEU  47  15.299  10.344 -11.411
  249   2HB   LEU  47          1HB       LEU  47  13.654  10.879 -11.062
  250    HG   LEU  47           HG       LEU  47  14.772  12.797 -11.929
  251   1HD1  LEU  47          1HD1      LEU  47  13.461  13.105  -9.789
  252   2HD1  LEU  47          3HD1      LEU  47  14.991  13.041  -8.915
  253   3HD1  LEU  47          2HD1      LEU  47  14.689  14.338 -10.073
  254   1HD2  LEU  47          1HD2      LEU  47  17.075  11.555 -11.110
  255   2HD2  LEU  47          3HD2      LEU  47  16.995  13.228 -11.663
  256   3HD2  LEU  47          2HD2      LEU  47  16.955  12.867  -9.938
  257    MD1  LEU  47           QD1      LEU  47  14.381  13.495  -9.592
  258    MD2  LEU  47           QD2      LEU  47  17.008  12.550 -10.904
  259    QB   LEU  47           QB       LEU  47  14.476  10.611 -11.236
  260    QD   LEU  47           QQD      LEU  47  15.694  13.022 -10.248
  261    H    LEU  48           H        LEU  48  12.766   9.102  -9.300
  262    HA   LEU  48           HA       LEU  48  11.452  10.818  -7.151
  263   1HB   LEU  48          2HB       LEU  48  10.668  10.285  -9.972
  264   2HB   LEU  48          1HB       LEU  48   9.369  10.231  -8.779
  265    HG   LEU  48           HG       LEU  48  11.223  12.509  -8.473
  266   1HD1  LEU  48          1HD1      LEU  48  10.936  12.148 -11.008
  267   2HD1  LEU  48          3HD1      LEU  48   9.243  12.572 -10.754
  268   3HD1  LEU  48          2HD1      LEU  48  10.511  13.738 -10.374
  269   1HD2  LEU  48          1HD2      LEU  48   8.274  11.938  -8.353
  270   2HD2  LEU  48          3HD2      LEU  48   9.327  12.603  -7.105
  271   3HD2  LEU  48          2HD2      LEU  48   8.830  13.607  -8.467
  272    MD1  LEU  48           QD1      LEU  48  10.230  12.819 -10.712
  273    MD2  LEU  48           QD2      LEU  48   8.810  12.716  -7.975
  274    QB   LEU  48           QB       LEU  48  10.019  10.258  -9.376
  275    QD   LEU  48           QQD      LEU  48   9.520  12.768  -9.343
  276    HA   PRO  49           HA       PRO  49  10.954   6.550  -5.815
  277   1HB   PRO  49          2HB       PRO  49  10.126   7.180  -3.285
  278   2HB   PRO  49          1HB       PRO  49  11.833   7.199  -3.772
  279   1HG   PRO  49          2HG       PRO  49   9.920   9.469  -3.495
  280   2HG   PRO  49          1HG       PRO  49  11.627   9.372  -3.035
  281   1HD   PRO  49          2HD       PRO  49  10.777  10.612  -5.295
  282   2HD   PRO  49          1HD       PRO  49  12.365   9.822  -5.163
  283    QB   PRO  49           QB       PRO  49  10.979   7.190  -3.528
  284    QG   PRO  49           QG       PRO  49  10.773   9.421  -3.265
  285    QD   PRO  49           QD       PRO  49  11.571  10.217  -5.229
  286    H    ALA  50           H        ALA  50   9.057   7.124  -7.555
  287    HA   ALA  50           HA       ALA  50   6.425   7.803  -6.546
  288   1HB   ALA  50          2HB       ALA  50   7.241   5.911  -8.778
  289   2HB   ALA  50          1HB       ALA  50   5.705   6.770  -8.651
  290   3HB   ALA  50          3HB       ALA  50   7.199   7.669  -8.919
  291    MB   ALA  50           QB       ALA  50   6.715   6.783  -8.783
  292    H    LEU  51           H        LEU  51   8.277   4.770  -6.516
  293    HA   LEU  51           HA       LEU  51   6.017   3.011  -5.902
  294   1HB   LEU  51          2HB       LEU  51   8.980   2.858  -5.250
  295   2HB   LEU  51          1HB       LEU  51   7.864   1.493  -5.215
  296    HG   LEU  51           HG       LEU  51   8.589   3.166  -7.639
  297   1HD1  LEU  51          3HD1      LEU  51   9.753   0.844  -6.462
  298   2HD1  LEU  51          2HD1      LEU  51   8.947   0.340  -7.948
  299   3HD1  LEU  51          1HD1      LEU  51  10.172   1.609  -7.996
  300   1HD2  LEU  51          3HD2      LEU  51   6.454   1.111  -7.126
  301   2HD2  LEU  51          2HD2      LEU  51   6.354   2.613  -8.045
  302   3HD2  LEU  51          1HD2      LEU  51   7.189   1.217  -8.726
  303    MD1  LEU  51           QD1      LEU  51   9.624   0.931  -7.469
  304    MD2  LEU  51           QD2      LEU  51   6.666   1.647  -7.966
  305    QB   LEU  51           QB       LEU  51   8.422   2.176  -5.233
  306    QD   LEU  51           QQD      LEU  51   8.145   1.289  -7.717
  307    H    ALA  52           H        ALA  52   8.498   4.574  -3.796
  308    HA   ALA  52           HA       ALA  52   7.480   3.618  -1.281
  309   1HB   ALA  52          2HB       ALA  52   9.550   5.060  -2.054
  310   2HB   ALA  52          1HB       ALA  52   8.497   6.420  -1.661
  311   3HB   ALA  52          3HB       ALA  52   8.921   5.245  -0.417
  312    MB   ALA  52           QB       ALA  52   8.989   5.575  -1.377
  313    H    ILE  53           H        ILE  53   6.582   6.565  -3.150
  314    HA   ILE  53           HA       ILE  53   4.620   7.516  -1.206
  315    HB   ILE  53           HB       ILE  53   4.799   7.820  -4.223
  316   1HG1  ILE  53          2HG1      ILE  53   6.892   8.474  -3.219
  317   2HG1  ILE  53          1HG1      ILE  53   6.002   9.956  -3.570
  318   1HG2  ILE  53          2HG2      ILE  53   3.424   9.467  -2.079
  319   2HG2  ILE  53          1HG2      ILE  53   3.647  10.001  -3.746
  320   3HG2  ILE  53          3HG2      ILE  53   2.647   8.590  -3.397
  321   1HD1  ILE  53          3HD1      ILE  53   5.115   9.810  -1.168
  322   2HD1  ILE  53          2HD1      ILE  53   6.357   8.588  -0.898
  323   3HD1  ILE  53          1HD1      ILE  53   6.819  10.228  -1.349
  324    MG   ILE  53           QG2      ILE  53   3.240   9.353  -3.074
  325    MD   ILE  53           QD1      ILE  53   6.097   9.542  -1.138
  326    QG   ILE  53           QG1      ILE  53   6.447   9.215  -3.394
  327    H    PHE  54           H        PHE  54   4.321   5.460  -4.148
  328    HA   PHE  54           HA       PHE  54   1.472   5.158  -4.144
  329   1HB   PHE  54          2HB       PHE  54   3.132   4.363  -5.830
  330   2HB   PHE  54          1HB       PHE  54   3.618   3.088  -4.713
  331    HD1  PHE  54          1HD       PHE  54   0.844   4.378  -6.801
  332    HD2  PHE  54          2HD       PHE  54   2.243   1.146  -4.341
  333    HE1  PHE  54          1HE       PHE  54  -1.021   2.957  -7.608
  334    HE2  PHE  54          2HE       PHE  54   0.378  -0.275  -5.148
  335    HZ   PHE  54           HZ       PHE  54  -1.255   0.629  -6.782
  336    QB   PHE  54           QB       PHE  54   3.375   3.726  -5.271
  337    QD   PHE  54           QD       PHE  54   1.543   2.762  -5.571
  338    QE   PHE  54           QE       PHE  54  -0.322   1.341  -6.378
  339    QR   PHE  54           QR       PHE  54   0.238   1.767  -6.136
  340    H    ILE  55           H        ILE  55   3.944   3.227  -2.359
  341    HA   ILE  55           HA       ILE  55   2.027   1.436  -1.095
  342    HB   ILE  55           HB       ILE  55   4.731   2.497  -0.212
  343   1HG1  ILE  55          2HG1      ILE  55   4.815   1.464  -2.422
  344   2HG1  ILE  55          1HG1      ILE  55   5.543   0.367  -1.247
  345   1HG2  ILE  55          3HG2      ILE  55   2.845   0.639   1.008
  346   2HG2  ILE  55          2HG2      ILE  55   4.395  -0.133   0.671
  347   3HG2  ILE  55          1HG2      ILE  55   4.331   1.318   1.672
  348   1HD1  ILE  55          3HD1      ILE  55   3.247  -0.732  -1.051
  349   2HD1  ILE  55          2HD1      ILE  55   2.783   0.199  -2.476
  350   3HD1  ILE  55          1HD1      ILE  55   4.089  -0.983  -2.580
  351    MG   ILE  55           QG2      ILE  55   3.857   0.608   1.117
  352    MD   ILE  55           QD1      ILE  55   3.373  -0.506  -2.036
  353    QG   ILE  55           QG1      ILE  55   5.179   0.915  -1.835
  354    H    GLY  56           H        GLY  56   3.470   4.553  -0.015
  355   1HA   GLY  56          1HA       GLY  56   2.640   6.053   1.626
  356   2HA   GLY  56          2HA       GLY  56   2.254   4.623   2.584
  357    QA   GLY  56           QA       GLY  56   2.447   5.338   2.105
  358    H    LEU  57           H        LEU  57   0.968   5.984  -0.509
  359    HA   LEU  57           HA       LEU  57  -1.617   6.716   0.604
  360   1HB   LEU  57          2HB       LEU  57  -0.417   6.114  -2.073
  361   2HB   LEU  57          1HB       LEU  57  -2.171   6.271  -1.966
  362    HG   LEU  57           HG       LEU  57  -1.034   8.434  -2.489
  363   1HD1  LEU  57          1HD1      LEU  57  -3.189   8.062  -0.998
  364   2HD1  LEU  57          3HD1      LEU  57  -2.152   8.694   0.281
  365   3HD1  LEU  57          2HD1      LEU  57  -2.479   9.670  -1.151
  366   1HD2  LEU  57          3HD2      LEU  57   1.009   7.892  -1.094
  367   2HD2  LEU  57          2HD2      LEU  57   0.350   9.505  -0.821
  368   3HD2  LEU  57          1HD2      LEU  57   0.035   8.215   0.341
  369    MD1  LEU  57           QD1      LEU  57  -2.607   8.809  -0.623
  370    MD2  LEU  57           QD2      LEU  57   0.464   8.537  -0.524
  371    QB   LEU  57           QB       LEU  57  -1.294   6.192  -2.020
  372    QD   LEU  57           QQD      LEU  57  -1.071   8.673  -0.574
  373    H    THR  58           H        THR  58  -0.401   3.675  -0.854
  374    HA   THR  58           HA       THR  58  -2.975   2.306  -0.899
  375    HB   THR  58           HB       THR  58  -0.136   1.288  -0.551
  376    HG1  THR  58          1HG       THR  58  -1.056   0.992  -2.995
  377   1HG2  THR  58          1HG2      THR  58  -2.659  -0.071  -1.531
  378   2HG2  THR  58          3HG2      THR  58  -1.041  -0.766  -1.631
  379   3HG2  THR  58          2HG2      THR  58  -1.771  -0.451  -0.057
  380    MG   THR  58           QG2      THR  58  -1.824  -0.430  -1.073
  381    H    ILE  59           H        ILE  59  -0.286   2.206   1.508
  382    HA   ILE  59           HA       ILE  59  -1.765   0.552   3.410
  383    HB   ILE  59           HB       ILE  59   0.504   2.542   3.728
  384   1HG1  ILE  59          2HG1      ILE  59   0.539  -0.472   3.355
  385   2HG1  ILE  59          1HG1      ILE  59   0.843   0.691   2.063
  386   1HG2  ILE  59          3HG2      ILE  59  -0.963   1.006   5.664
  387   2HG2  ILE  59          2HG2      ILE  59   0.672   0.359   5.543
  388   3HG2  ILE  59          1HG2      ILE  59   0.424   2.062   5.927
  389   1HD1  ILE  59          1HD1      ILE  59   2.432   0.527   4.641
  390   2HD1  ILE  59          3HD1      ILE  59   2.950  -0.150   3.097
  391   3HD1  ILE  59          2HD1      ILE  59   2.760   1.594   3.278
  392    MG   ILE  59           QG2      ILE  59   0.044   1.142   5.712
  393    MD   ILE  59           QD1      ILE  59   2.714   0.657   3.672
  394    QG   ILE  59           QG1      ILE  59   0.691   0.109   2.709
  395    H    TYR  60           H        TYR  60  -1.317   4.130   3.152
  396    HA   TYR  60           HA       TYR  60  -2.763   4.785   5.582
  397   1HB   TYR  60          2HB       TYR  60  -2.142   6.096   2.948
  398   2HB   TYR  60          1HB       TYR  60  -3.243   6.907   4.058
  399    HD1  TYR  60          1HD       TYR  60  -2.172   8.587   5.246
  400    HD2  TYR  60          2HD       TYR  60  -0.093   4.902   4.503
  401    HE1  TYR  60          1HE       TYR  60  -0.250   9.401   6.585
  402    HE2  TYR  60          2HE       TYR  60   1.831   5.718   5.841
  403    HH   TYR  60           HH       TYR  60   1.666   8.258   7.930
  404    QB   TYR  60           QB       TYR  60  -2.693   6.502   3.503
  405    QD   TYR  60           QD       TYR  60  -1.133   6.745   4.875
  406    QE   TYR  60           QE       TYR  60   0.790   7.560   6.213
  407    QR   TYR  60           QR       TYR  60  -0.171   7.152   5.544
  408    H    ALA  61           H        ALA  61  -3.912   4.551   2.171
  409    HA   ALA  61           HA       ALA  61  -6.697   5.067   2.723
  410   1HB   ALA  61          1HB       ALA  61  -6.959   3.750   0.564
  411   2HB   ALA  61          3HB       ALA  61  -5.771   5.055   0.501
  412   3HB   ALA  61          2HB       ALA  61  -5.238   3.384   0.674
  413    MB   ALA  61           QB       ALA  61  -5.989   4.063   0.580
  414    H    ILE  62           H        ILE  62  -4.853   1.982   2.764
  415    HA   ILE  62           HA       ILE  62  -7.170   0.278   3.208
  416    HB   ILE  62           HB       ILE  62  -4.237   0.093   3.939
  417   1HG1  ILE  62          2HG1      ILE  62  -5.178   0.255   1.490
  418   2HG1  ILE  62          1HG1      ILE  62  -3.964  -0.968   1.869
  419   1HG2  ILE  62          2HG2      ILE  62  -6.508  -1.853   4.239
  420   2HG2  ILE  62          1HG2      ILE  62  -4.897  -2.456   3.848
  421   3HG2  ILE  62          3HG2      ILE  62  -5.160  -1.540   5.332
  422   1HD1  ILE  62          2HD1      ILE  62  -6.856  -1.657   2.231
  423   2HD1  ILE  62          1HD1      ILE  62  -6.189  -1.635   0.598
  424   3HD1  ILE  62          3HD1      ILE  62  -5.499  -2.706   1.818
  425    MG   ILE  62           QG2      ILE  62  -5.521  -1.950   4.473
  426    MD   ILE  62           QD1      ILE  62  -6.181  -1.999   1.549
  427    QG   ILE  62           QG1      ILE  62  -4.571  -0.357   1.679
  428    H    GLN  63           H        GLN  63  -4.890   1.836   5.534
  429    HA   GLN  63           HA       GLN  63  -6.127   0.716   7.915
  430   1HB   GLN  63          2HB       GLN  63  -3.915   1.887   7.670
  431   2HB   GLN  63          1HB       GLN  63  -4.792   3.411   7.526
  432   1HG   GLN  63          2HG       GLN  63  -5.850   2.961   9.745
  433   2HG   GLN  63          1HG       GLN  63  -4.836   1.526   9.898
  434   1HE2  GLN  63          1HE2      GLN  63  -2.937   1.841  11.046
  435   2HE2  GLN  63          2HE2      GLN  63  -2.080   3.421  11.147
  436    QB   GLN  63           QB       GLN  63  -4.353   2.649   7.598
  437    QG   GLN  63           QG       GLN  63  -5.343   2.244   9.822
  438    QE   GLN  63           QE2      GLN  63  -2.509   2.631  11.097
  439    H    ARG  64           H        ARG  64  -6.766   3.748   6.090
  440    HA   ARG  64           HA       ARG  64  -8.776   4.746   7.968
  441   1HB   ARG  64          2HB       ARG  64  -8.256   5.136   5.006
  442   2HB   ARG  64          1HB       ARG  64  -9.384   6.124   5.937
  443   1HG   ARG  64          2HG       ARG  64  -7.518   6.721   7.484
  444   2HG   ARG  64          1HG       ARG  64  -6.410   5.826   6.444
  445   1HD   ARG  64          2HD       ARG  64  -8.110   8.188   5.559
  446   2HD   ARG  64          1HD       ARG  64  -6.365   8.238   5.882
  447    HE   ARG  64           HE       ARG  64  -6.125   6.398   4.072
  448   1HH1  ARG  64          1HH1      ARG  64  -8.611   5.642   3.109
  449   2HH1  ARG  64          2HH1      ARG  64  -9.100   6.816   1.934
  450   1HH2  ARG  64          1HH2      ARG  64  -6.895   9.245   3.056
  451   2HH2  ARG  64          2HH2      ARG  64  -8.129   8.857   1.904
  452    QB   ARG  64           QB       ARG  64  -8.820   5.630   5.471
  453    QG   ARG  64           QG       ARG  64  -6.964   6.274   6.964
  454    QD   ARG  64           QD       ARG  64  -7.237   8.213   5.720
  455    QH1  ARG  64           QH1      ARG  64  -8.856   6.229   2.521
  456    QH2  ARG  64           QH2      ARG  64  -7.512   9.051   2.480
  457    H    LYS  65           H        LYS  65  -9.099   3.021   4.809
  458    HA   LYS  65           HA       LYS  65 -11.969   2.736   4.906
  459   1HB   LYS  65          2HB       LYS  65  -9.762   0.978   3.787
  460   2HB   LYS  65          1HB       LYS  65 -11.464   0.822   3.352
  461   1HG   LYS  65          2HG       LYS  65  -9.862   3.374   3.029
  462   2HG   LYS  65          1HG       LYS  65 -10.146   2.215   1.731
  463   1HD   LYS  65          2HD       LYS  65 -12.619   2.497   2.125
  464   2HD   LYS  65          1HD       LYS  65 -12.234   3.805   3.245
  465   1HE   LYS  65          2HE       LYS  65 -11.414   5.199   1.540
  466   2HE   LYS  65          1HE       LYS  65 -11.115   3.838   0.441
  467   1HZ   LYS  65          1HZ       LYS  65 -13.619   3.438   0.657
  468   2HZ   LYS  65          3HZ       LYS  65 -13.700   5.031   1.234
  469   3HZ   LYS  65          2HZ       LYS  65 -13.109   4.724  -0.329
  470    QB   LYS  65           QB       LYS  65 -10.613   0.900   3.570
  471    QD   LYS  65           QD       LYS  65 -12.427   3.151   2.685
  472    QG   LYS  65           QG       LYS  65 -10.004   2.794   2.380
  473    QE   LYS  65           QE       LYS  65 -11.264   4.518   0.990
  474    QZ   LYS  65           QZ       LYS  65 -13.476   4.398   0.521
  475    H    ARG  66           H        ARG  66  -9.403   0.448   6.021
  476    HA   ARG  66           HA       ARG  66 -11.194  -1.543   7.100
  477   1HB   ARG  66          2HB       ARG  66  -8.424  -0.549   7.807
  478   2HB   ARG  66          1HB       ARG  66  -9.140  -1.952   8.602
  479   1HG   ARG  66          2HG       ARG  66  -9.530  -2.946   6.314
  480   2HG   ARG  66          1HG       ARG  66  -8.591  -1.614   5.641
  481   1HD   ARG  66          2HD       ARG  66  -7.606  -3.684   7.640
  482   2HD   ARG  66          1HD       ARG  66  -7.081  -3.497   5.955
  483    HE   ARG  66           HE       ARG  66  -6.642  -0.937   6.969
  484   1HH1  ARG  66          1HH1      ARG  66  -4.509  -3.190   6.435
  485   2HH1  ARG  66          2HH1      ARG  66  -3.641  -3.157   7.934
  486   1HH2  ARG  66          1HH2      ARG  66  -6.090  -1.373   9.619
  487   2HH2  ARG  66          2HH2      ARG  66  -4.535  -2.129   9.736
  488    QB   ARG  66           QB       ARG  66  -8.782  -1.251   8.205
  489    QG   ARG  66           QG       ARG  66  -9.060  -2.280   5.978
  490    QD   ARG  66           QD       ARG  66  -7.343  -3.590   6.797
  491    QH1  ARG  66           QH1      ARG  66  -4.075  -3.174   7.184
  492    QH2  ARG  66           QH2      ARG  66  -5.312  -1.751   9.677
  493    H    GLN  67           H        GLN  67  -9.880   1.470   8.538
  494    HA   GLN  67           HA       GLN  67 -12.158   1.481  10.489
  495   1HB   GLN  67          2HB       GLN  67 -10.703   1.360  12.447
  496   2HB   GLN  67          1HB       GLN  67 -10.413  -0.059  11.440
  497   1HG   GLN  67          2HG       GLN  67  -8.488   1.180  10.383
  498   2HG   GLN  67          1HG       GLN  67  -8.721   2.451  11.582
  499   1HE2  GLN  67          1HE2      GLN  67  -6.887   2.203  12.922
  500   2HE2  GLN  67          2HE2      GLN  67  -6.515   0.655  13.765
  501    QB   GLN  67           QB       GLN  67 -10.558   0.650  11.944
  502    QG   GLN  67           QG       GLN  67  -8.604   1.815  10.983
  503    QE   GLN  67           QE2      GLN  67  -6.701   1.429  13.343
  504    H    ALA  68           H        ALA  68 -12.305   3.549  11.636
  505    HA   ALA  68           HA       ALA  68 -10.712   5.695  10.170
  506   1HB   ALA  68          3HB       ALA  68 -13.326   5.760  11.712
  507   2HB   ALA  68          1HB       ALA  68 -13.176   5.670   9.957
  508   3HB   ALA  68          2HB       ALA  68 -12.633   7.111  10.816
  509    MB   ALA  68           QB       ALA  68 -13.045   6.180  10.828
  510    H    ASP  69           H        ASP  69  -9.285   6.966  11.301
  511    HA   ASP  69           HA       ASP  69  -9.599   7.000  14.334
  512   1HB   ASP  69          2HB       ASP  69  -7.962   5.263  13.553
  513   2HB   ASP  69          1HB       ASP  69  -7.030   6.546  12.782
  514    QB   ASP  69           QB       ASP  69  -7.496   5.905  13.167

  No H/Q in entry =         514
  Start of MODEL    8
    1    H    THR  24           H        THR  24 -18.325  -4.270   4.913
    2    HA   THR  24           HA       THR  24 -16.680  -5.953   4.480
    3    HB   THR  24           HB       THR  24 -16.412  -4.773   1.723
    4    HG1  THR  24          1HG       THR  24 -18.588  -6.393   2.211
    5   1HG2  THR  24          2HG2      THR  24 -15.390  -7.008   2.654
    6   2HG2  THR  24          1HG2      THR  24 -17.029  -7.624   2.433
    7   3HG2  THR  24          3HG2      THR  24 -16.132  -6.988   1.054
    8    MG   THR  24           QG2      THR  24 -16.184  -7.207   2.047
    9    HA   PRO  25           HA       PRO  25 -13.293  -2.775   4.832
   10   1HB   PRO  25          2HB       PRO  25 -12.544  -3.434   7.380
   11   2HB   PRO  25          1HB       PRO  25 -13.805  -2.237   7.022
   12   1HG   PRO  25          2HG       PRO  25 -14.077  -5.075   7.867
   13   2HG   PRO  25          1HG       PRO  25 -15.045  -3.664   8.319
   14   1HD   PRO  25          2HD       PRO  25 -15.838  -5.522   6.477
   15   2HD   PRO  25          1HD       PRO  25 -16.387  -3.832   6.476
   16    QB   PRO  25           QB       PRO  25 -13.174  -2.835   7.201
   17    QG   PRO  25           QG       PRO  25 -14.561  -4.370   8.093
   18    QD   PRO  25           QD       PRO  25 -16.112  -4.677   6.477
   19    H    VAL  26           H        VAL  26 -13.563  -6.187   5.838
   20    HA   VAL  26           HA       VAL  26 -10.727  -6.806   5.822
   21    HB   VAL  26           HB       VAL  26 -13.238  -8.391   5.212
   22   1HG1  VAL  26          3HG1      VAL  26 -10.428  -9.131   4.999
   23   2HG1  VAL  26          2HG1      VAL  26 -11.270 -10.121   6.191
   24   3HG1  VAL  26          1HG1      VAL  26 -11.860 -10.046   4.530
   25   1HG2  VAL  26          2HG2      VAL  26 -11.574  -7.848   7.676
   26   2HG2  VAL  26          1HG2      VAL  26 -13.306  -7.610   7.451
   27   3HG2  VAL  26          3HG2      VAL  26 -12.651  -9.242   7.583
   28    MG1  VAL  26           QG1      VAL  26 -11.186  -9.766   5.240
   29    MG2  VAL  26           QG2      VAL  26 -12.510  -8.234   7.570
   30    QG   VAL  26           QQG      VAL  26 -11.848  -9.000   6.405
   31    H    LEU  27           H        LEU  27 -13.152  -6.606   3.212
   32    HA   LEU  27           HA       LEU  27 -11.643  -7.927   1.135
   33   1HB   LEU  27          2HB       LEU  27 -14.032  -7.101   1.152
   34   2HB   LEU  27          1HB       LEU  27 -13.407  -5.469   0.912
   35    HG   LEU  27           HG       LEU  27 -12.493  -7.640  -0.939
   36   1HD1  LEU  27          3HD1      LEU  27 -15.144  -6.175  -1.146
   37   2HD1  LEU  27          2HD1      LEU  27 -14.444  -7.203  -2.396
   38   3HD1  LEU  27          1HD1      LEU  27 -14.942  -7.904  -0.857
   39   1HD2  LEU  27          2HD2      LEU  27 -12.676  -4.677  -0.839
   40   2HD2  LEU  27          1HD2      LEU  27 -11.446  -5.703  -1.575
   41   3HD2  LEU  27          3HD2      LEU  27 -12.970  -5.412  -2.414
   42    MD1  LEU  27           QD1      LEU  27 -14.843  -7.094  -1.466
   43    MD2  LEU  27           QD2      LEU  27 -12.364  -5.264  -1.609
   44    QB   LEU  27           QB       LEU  27 -13.719  -6.285   1.032
   45    QD   LEU  27           QQD      LEU  27 -13.604  -6.179  -1.538
   46    H    VAL  28           H        VAL  28 -11.513  -4.572   2.364
   47    HA   VAL  28           HA       VAL  28  -9.797  -3.480   0.308
   48    HB   VAL  28           HB       VAL  28 -10.058  -2.933   3.282
   49   1HG1  VAL  28          3HG1      VAL  28  -8.194  -1.884   1.436
   50   2HG1  VAL  28          2HG1      VAL  28  -9.424  -0.637   1.648
   51   3HG1  VAL  28          1HG1      VAL  28  -8.559  -1.270   3.049
   52   1HG2  VAL  28          1HG2      VAL  28 -11.908  -2.695   1.192
   53   2HG2  VAL  28          3HG2      VAL  28 -12.014  -1.928   2.776
   54   3HG2  VAL  28          2HG2      VAL  28 -11.288  -1.061   1.422
   55    MG1  VAL  28           QG1      VAL  28  -8.726  -1.264   2.044
   56    MG2  VAL  28           QG2      VAL  28 -11.737  -1.894   1.797
   57    QG   VAL  28           QQG      VAL  28 -10.231  -1.579   1.920
   58    H    ILE  29           H        ILE  29  -8.989  -5.124   3.411
   59    HA   ILE  29           HA       ILE  29  -6.099  -4.839   3.111
   60    HB   ILE  29           HB       ILE  29  -7.838  -6.911   4.490
   61   1HG1  ILE  29          2HG1      ILE  29  -6.534  -4.389   5.563
   62   2HG1  ILE  29          1HG1      ILE  29  -8.236  -4.514   5.118
   63   1HG2  ILE  29          2HG2      ILE  29  -4.996  -6.753   4.163
   64   2HG2  ILE  29          1HG2      ILE  29  -5.382  -6.405   5.848
   65   3HG2  ILE  29          3HG2      ILE  29  -5.924  -7.913   5.114
   66   1HD1  ILE  29          2HD1      ILE  29  -7.997  -6.685   6.737
   67   2HD1  ILE  29          1HD1      ILE  29  -6.816  -5.605   7.478
   68   3HD1  ILE  29          3HD1      ILE  29  -8.496  -5.094   7.311
   69    MG   ILE  29           QG2      ILE  29  -5.434  -7.024   5.042
   70    MD   ILE  29           QD1      ILE  29  -7.770  -5.795   7.175
   71    QG   ILE  29           QG1      ILE  29  -7.385  -4.451   5.341
   72    H    LEU  30           H        LEU  30  -8.432  -7.330   2.029
   73    HA   LEU  30           HA       LEU  30  -6.488  -9.291   1.151
   74   1HB   LEU  30          2HB       LEU  30  -8.989  -9.482   1.421
   75   2HB   LEU  30          1HB       LEU  30  -9.166  -8.570  -0.079
   76    HG   LEU  30           HG       LEU  30  -7.398 -10.994  -0.043
   77   1HD1  LEU  30          3HD1      LEU  30 -10.104 -11.090   0.731
   78   2HD1  LEU  30          2HD1      LEU  30 -10.080 -11.597  -0.958
   79   3HD1  LEU  30          1HD1      LEU  30  -9.097 -12.449   0.233
   80   1HD2  LEU  30          3HD2      LEU  30  -8.908  -9.321  -2.011
   81   2HD2  LEU  30          2HD2      LEU  30  -7.271  -9.969  -2.117
   82   3HD2  LEU  30          1HD2      LEU  30  -8.657 -11.024  -2.395
   83    MD1  LEU  30           QD1      LEU  30  -9.760 -11.712   0.002
   84    MD2  LEU  30           QD2      LEU  30  -8.279 -10.105  -2.174
   85    QB   LEU  30           QB       LEU  30  -9.078  -9.026   0.671
   86    QD   LEU  30           QQD      LEU  30  -9.020 -10.908  -1.086
   87    H    LEU  31           H        LEU  31  -7.991  -6.518  -0.587
   88    HA   LEU  31           HA       LEU  31  -6.724  -7.051  -3.147
   89   1HB   LEU  31          2HB       LEU  31  -8.629  -5.496  -2.563
   90   2HB   LEU  31          1HB       LEU  31  -7.436  -4.387  -1.883
   91    HG   LEU  31           HG       LEU  31  -7.056  -5.419  -4.676
   92   1HD1  LEU  31          1HD1      LEU  31  -9.448  -4.388  -4.166
   93   2HD1  LEU  31          3HD1      LEU  31  -8.557  -2.867  -4.227
   94   3HD1  LEU  31          2HD1      LEU  31  -8.566  -3.939  -5.626
   95   1HD2  LEU  31          3HD2      LEU  31  -5.921  -3.413  -2.904
   96   2HD2  LEU  31          2HD2      LEU  31  -5.294  -4.027  -4.433
   97   3HD2  LEU  31          1HD2      LEU  31  -6.443  -2.689  -4.424
   98    MD1  LEU  31           QD1      LEU  31  -8.857  -3.732  -4.673
   99    MD2  LEU  31           QD2      LEU  31  -5.886  -3.376  -3.920
  100    QB   LEU  31           QB       LEU  31  -8.033  -4.942  -2.223
  101    QD   LEU  31           QQD      LEU  31  -7.371  -3.554  -4.297
  102    H    GLY  32           H        GLY  32  -5.674  -5.084  -0.323
  103   1HA   GLY  32          1HA       GLY  32  -3.517  -4.194   0.124
  104   2HA   GLY  32          2HA       GLY  32  -3.256  -4.091  -1.619
  105    QA   GLY  32           QA       GLY  32  -3.387  -4.142  -0.748
  106    H    VAL  33           H        VAL  33  -3.985  -7.028   0.271
  107    HA   VAL  33           HA       VAL  33  -1.287  -7.976   0.623
  108    HB   VAL  33           HB       VAL  33  -3.942  -9.358   0.129
  109   1HG1  VAL  33          2HG1      VAL  33  -1.249 -10.453   0.371
  110   2HG1  VAL  33          1HG1      VAL  33  -2.316 -11.046   1.646
  111   3HG1  VAL  33          3HG1      VAL  33  -2.755 -11.270  -0.048
  112   1HG2  VAL  33          2HG2      VAL  33  -3.184  -7.783   2.215
  113   2HG2  VAL  33          1HG2      VAL  33  -4.307  -9.132   2.376
  114   3HG2  VAL  33          3HG2      VAL  33  -2.604  -9.352   2.776
  115    MG1  VAL  33           QG1      VAL  33  -2.107 -10.923   0.656
  116    MG2  VAL  33           QG2      VAL  33  -3.365  -8.756   2.456
  117    QG   VAL  33           QQG      VAL  33  -2.736  -9.839   1.556
  118    H    VAL  34           H        VAL  34  -3.584  -8.495  -2.097
  119    HA   VAL  34           HA       VAL  34  -1.868 -10.200  -3.677
  120    HB   VAL  34           HB       VAL  34  -3.978  -8.134  -4.358
  121   1HG1  VAL  34          2HG1      VAL  34  -2.447 -10.070  -6.068
  122   2HG1  VAL  34          1HG1      VAL  34  -4.138  -9.738  -6.449
  123   3HG1  VAL  34          3HG1      VAL  34  -2.961  -8.423  -6.436
  124   1HG2  VAL  34          3HG2      VAL  34  -3.940 -11.036  -3.624
  125   2HG2  VAL  34          2HG2      VAL  34  -5.085  -9.779  -3.158
  126   3HG2  VAL  34          1HG2      VAL  34  -5.162 -10.484  -4.771
  127    MG1  VAL  34           QG1      VAL  34  -3.182  -9.410  -6.317
  128    MG2  VAL  34           QG2      VAL  34  -4.729 -10.433  -3.851
  129    QG   VAL  34           QQG      VAL  34  -3.956  -9.922  -5.084
  130    H    GLY  35           H        GLY  35  -2.094  -6.617  -3.499
  131   1HA   GLY  35          1HA       GLY  35  -0.555  -5.014  -4.334
  132   2HA   GLY  35          2HA       GLY  35  -0.332  -6.080  -5.723
  133    QA   GLY  35           QA       GLY  35  -0.443  -5.547  -5.028
  134    H    LEU  36           H        LEU  36   0.390  -6.741  -2.270
  135    HA   LEU  36           HA       LEU  36   3.218  -6.208  -2.358
  136   1HB   LEU  36          2HB       LEU  36   1.790  -6.726  -0.379
  137   2HB   LEU  36          1HB       LEU  36   1.711  -8.407  -0.905
  138    HG   LEU  36           HG       LEU  36   4.261  -8.409  -0.850
  139   1HD1  LEU  36          1HD1      LEU  36   3.941  -5.695  -0.551
  140   2HD1  LEU  36          3HD1      LEU  36   4.239  -6.209   1.110
  141   3HD1  LEU  36          2HD1      LEU  36   5.414  -6.580  -0.153
  142   1HD2  LEU  36          3HD2      LEU  36   2.720  -7.932   1.722
  143   2HD2  LEU  36          2HD2      LEU  36   2.936  -9.482   0.909
  144   3HD2  LEU  36          1HD2      LEU  36   4.322  -8.665   1.631
  145    MD1  LEU  36           QD1      LEU  36   4.531  -6.161   0.136
  146    MD2  LEU  36           QD2      LEU  36   3.326  -8.693   1.421
  147    QB   LEU  36           QB       LEU  36   1.751  -7.567  -0.642
  148    QD   LEU  36           QQD      LEU  36   3.929  -7.427   0.778
  149    H    SER  37           H        SER  37   1.373  -9.110  -3.355
  150    HA   SER  37           HA       SER  37   3.610 -10.882  -3.774
  151   1HB   SER  37          2HB       SER  37   1.123 -11.329  -3.830
  152   2HB   SER  37          1HB       SER  37   1.085 -10.597  -5.430
  153    HG   SER  37           HG       SER  37   2.319 -12.226  -6.209
  154    QB   SER  37           QB       SER  37   1.104 -10.963  -4.630
  155    H    ALA  38           H        ALA  38   2.005  -8.657  -6.135
  156    HA   ALA  38           HA       ALA  38   3.725  -9.178  -8.367
  157   1HB   ALA  38          2HB       ALA  38   1.640  -7.576  -7.817
  158   2HB   ALA  38          3HB       ALA  38   2.681  -7.298  -9.215
  159   3HB   ALA  38          1HB       ALA  38   2.926  -6.372  -7.734
  160    MB   ALA  38           QB       ALA  38   2.416  -7.082  -8.255
  161    H    LEU  39           H        LEU  39   4.248  -7.062  -5.527
  162    HA   LEU  39           HA       LEU  39   7.023  -6.443  -6.626
  163   1HB   LEU  39          2HB       LEU  39   6.885  -4.575  -5.002
  164   2HB   LEU  39          1HB       LEU  39   5.503  -4.571  -6.100
  165    HG   LEU  39           HG       LEU  39   4.733  -6.239  -3.981
  166   1HD1  LEU  39          3HD1      LEU  39   6.823  -4.752  -3.001
  167   2HD1  LEU  39          2HD1      LEU  39   5.440  -3.730  -2.605
  168   3HD1  LEU  39          1HD1      LEU  39   5.505  -5.392  -2.019
  169   1HD2  LEU  39          2HD2      LEU  39   3.438  -4.518  -5.355
  170   2HD2  LEU  39          1HD2      LEU  39   3.045  -4.573  -3.637
  171   3HD2  LEU  39          3HD2      LEU  39   4.086  -3.294  -4.263
  172    MD1  LEU  39           QD1      LEU  39   5.923  -4.625  -2.542
  173    MD2  LEU  39           QD2      LEU  39   3.523  -4.128  -4.418
  174    QB   LEU  39           QB       LEU  39   6.194  -4.573  -5.551
  175    QD   LEU  39           QQD      LEU  39   4.723  -4.376  -3.480
  176    H    THR  40           H        THR  40   8.349  -8.142  -5.945
  177    HA   THR  40           HA       THR  40   8.483  -8.486  -2.923
  178    HB   THR  40           HB       THR  40   8.593 -10.784  -4.885
  179    HG1  THR  40          1HG       THR  40   6.422 -11.056  -4.565
  180   1HG2  THR  40          3HG2      THR  40   9.227 -10.624  -2.229
  181   2HG2  THR  40          2HG2      THR  40   7.531 -11.104  -2.154
  182   3HG2  THR  40          1HG2      THR  40   8.690 -12.098  -3.036
  183    MG   THR  40           QG2      THR  40   8.483 -11.275  -2.473
  184    H    GLY  41           H        GLY  41  10.216  -6.954  -4.735
  185   1HA   GLY  41          1HA       GLY  41  12.449  -7.918  -5.867
  186   2HA   GLY  41          2HA       GLY  41  12.737  -8.565  -4.251
  187    QA   GLY  41           QA       GLY  41  12.593  -8.242  -5.059
  188    H    TYR  42           H        TYR  42  14.594  -7.290  -3.839
  189    HA   TYR  42           HA       TYR  42  14.083  -4.661  -2.700
  190   1HB   TYR  42          2HB       TYR  42  15.941  -6.279  -2.202
  191   2HB   TYR  42          1HB       TYR  42  16.666  -5.853  -3.753
  192    HD1  TYR  42          1HD       TYR  42  15.698  -4.545  -0.416
  193    HD2  TYR  42          2HD       TYR  42  17.828  -3.776  -4.067
  194    HE1  TYR  42          1HE       TYR  42  16.759  -2.558   0.621
  195    HE2  TYR  42          2HE       TYR  42  18.888  -1.789  -3.029
  196    HH   TYR  42           HH       TYR  42  17.798  -0.288  -0.396
  197    QB   TYR  42           QB       TYR  42  16.303  -6.066  -2.978
  198    QD   TYR  42           QD       TYR  42  16.763  -4.160  -2.242
  199    QE   TYR  42           QE       TYR  42  17.824  -2.173  -1.204
  200    QR   TYR  42           QR       TYR  42  17.293  -3.167  -1.723
  201    H    LEU  43           H        LEU  43  15.286  -2.622  -3.433
  202    HA   LEU  43           HA       LEU  43  15.922  -2.316  -6.291
  203   1HB   LEU  43          2HB       LEU  43  13.461  -2.747  -6.374
  204   2HB   LEU  43          1HB       LEU  43  13.208  -1.342  -5.339
  205    HG   LEU  43           HG       LEU  43  14.455   0.025  -7.086
  206   1HD1  LEU  43          2HD1      LEU  43  14.715  -2.631  -8.210
  207   2HD1  LEU  43          1HD1      LEU  43  13.887  -1.565  -9.345
  208   3HD1  LEU  43          3HD1      LEU  43  15.480  -1.129  -8.728
  209   1HD2  LEU  43          2HD2      LEU  43  11.786  -1.288  -7.479
  210   2HD2  LEU  43          1HD2      LEU  43  12.160   0.402  -7.136
  211   3HD2  LEU  43          3HD2      LEU  43  12.416  -0.247  -8.756
  212    MD1  LEU  43           QD1      LEU  43  14.694  -1.775  -8.761
  213    MD2  LEU  43           QD2      LEU  43  12.121  -0.378  -7.790
  214    QB   LEU  43           QB       LEU  43  13.335  -2.044  -5.856
  215    QD   LEU  43           QQD      LEU  43  13.407  -1.076  -8.276
  216    H    ASP  44           H        ASP  44  17.261  -0.547  -6.372
  217    HA   ASP  44           HA       ASP  44  17.586   1.189  -4.040
  218   1HB   ASP  44          2HB       ASP  44  18.377   1.402  -6.961
  219   2HB   ASP  44          1HB       ASP  44  19.001   2.461  -5.696
  220    QB   ASP  44           QB       ASP  44  18.689   1.932  -6.329
  221    H    TYR  45           H        TYR  45  17.574   3.747  -4.536
  222    HA   TYR  45           HA       TYR  45  14.681   4.320  -5.252
  223   1HB   TYR  45          2HB       TYR  45  14.964   6.195  -3.833
  224   2HB   TYR  45          1HB       TYR  45  15.941   4.944  -3.065
  225    HD1  TYR  45          1HD       TYR  45  15.986   8.103  -4.920
  226    HD2  TYR  45          2HD       TYR  45  18.404   4.960  -3.270
  227    HE1  TYR  45          1HE       TYR  45  18.000   9.532  -5.149
  228    HE2  TYR  45          2HE       TYR  45  20.418   6.389  -3.499
  229    HH   TYR  45           HH       TYR  45  20.167   9.757  -4.569
  230    QB   TYR  45           QB       TYR  45  15.453   5.570  -3.449
  231    QD   TYR  45           QD       TYR  45  17.195   6.532  -4.095
  232    QE   TYR  45           QE       TYR  45  19.209   7.961  -4.324
  233    QR   TYR  45           QR       TYR  45  18.202   7.246  -4.209
  234    H    VAL  46           H        VAL  46  14.173   5.282  -7.174
  235    HA   VAL  46           HA       VAL  46  16.466   6.312  -8.850
  236    HB   VAL  46           HB       VAL  46  14.445   4.737  -9.466
  237   1HG1  VAL  46          2HG1      VAL  46  12.965   6.829  -8.617
  238   2HG1  VAL  46          1HG1      VAL  46  13.113   7.255 -10.322
  239   3HG1  VAL  46          3HG1      VAL  46  12.403   5.708  -9.858
  240   1HG2  VAL  46          1HG2      VAL  46  16.060   6.620 -10.924
  241   2HG2  VAL  46          3HG2      VAL  46  15.416   5.073 -11.472
  242   3HG2  VAL  46          2HG2      VAL  46  14.461   6.542 -11.664
  243    MG1  VAL  46           QG1      VAL  46  12.827   6.598  -9.599
  244    MG2  VAL  46           QG2      VAL  46  15.312   6.079 -11.353
  245    QG   VAL  46           QQG      VAL  46  14.070   6.338 -10.476
  246    H    LEU  47           H        LEU  47  14.834   8.146 -10.398
  247    HA   LEU  47           HA       LEU  47  15.340  10.589  -8.913
  248   1HB   LEU  47          2HB       LEU  47  13.863   9.720 -11.366
  249   2HB   LEU  47          1HB       LEU  47  13.595  11.362 -10.784
  250    HG   LEU  47           HG       LEU  47  15.467  11.190 -12.446
  251   1HD1  LEU  47          1HD1      LEU  47  15.390  12.526  -9.938
  252   2HD1  LEU  47          3HD1      LEU  47  17.054  11.996 -10.188
  253   3HD1  LEU  47          2HD1      LEU  47  16.262  13.013 -11.393
  254   1HD2  LEU  47          2HD2      LEU  47  16.247   8.938 -11.693
  255   2HD2  LEU  47          1HD2      LEU  47  17.553  10.122 -11.746
  256   3HD2  LEU  47          3HD2      LEU  47  16.832   9.672 -10.199
  257    MD1  LEU  47           QD1      LEU  47  16.235  12.511 -10.506
  258    MD2  LEU  47           QD2      LEU  47  16.877   9.577 -11.213
  259    QB   LEU  47           QB       LEU  47  13.729  10.541 -11.075
  260    QD   LEU  47           QQD      LEU  47  16.556  11.044 -10.860
  261    H    LEU  48           H        LEU  48  12.304   8.738  -9.486
  262    HA   LEU  48           HA       LEU  48  11.095  10.359  -7.191
  263   1HB   LEU  48          2HB       LEU  48  10.402  10.214  -9.948
  264   2HB   LEU  48          1HB       LEU  48   9.138   9.368  -9.054
  265    HG   LEU  48           HG       LEU  48  10.155  12.091  -8.223
  266   1HD1  LEU  48          2HD1      LEU  48   8.152  11.306 -10.305
  267   2HD1  LEU  48          1HD1      LEU  48   7.803  12.711  -9.296
  268   3HD1  LEU  48          3HD1      LEU  48   9.265  12.674 -10.282
  269   1HD2  LEU  48          3HD2      LEU  48   8.924  10.703  -6.558
  270   2HD2  LEU  48          2HD2      LEU  48   8.032  12.160  -6.998
  271   3HD2  LEU  48          1HD2      LEU  48   7.567  10.601  -7.680
  272    MD1  LEU  48           QD1      LEU  48   8.407  12.230  -9.961
  273    MD2  LEU  48           QD2      LEU  48   8.174  11.155  -7.079
  274    QB   LEU  48           QB       LEU  48   9.770   9.791  -9.501
  275    QD   LEU  48           QQD      LEU  48   8.290  11.692  -8.520
  276    HA   PRO  49           HA       PRO  49  10.773   6.093  -5.778
  277   1HB   PRO  49          2HB       PRO  49  10.051   6.746  -3.219
  278   2HB   PRO  49          1HB       PRO  49  11.733   6.784  -3.787
  279   1HG   PRO  49          2HG       PRO  49   9.800   9.029  -3.456
  280   2HG   PRO  49          1HG       PRO  49  11.527   8.964  -3.070
  281   1HD   PRO  49          2HD       PRO  49  10.566  10.160  -5.305
  282   2HD   PRO  49          1HD       PRO  49  12.163   9.384  -5.238
  283    QB   PRO  49           QB       PRO  49  10.892   6.765  -3.503
  284    QG   PRO  49           QG       PRO  49  10.663   8.997  -3.263
  285    QD   PRO  49           QD       PRO  49  11.364   9.772  -5.271
  286    H    ALA  50           H        ALA  50   8.797   6.509  -7.424
  287    HA   ALA  50           HA       ALA  50   6.199   7.221  -6.350
  288   1HB   ALA  50          3HB       ALA  50   7.354   5.695  -8.633
  289   2HB   ALA  50          1HB       ALA  50   6.238   7.060  -8.648
  290   3HB   ALA  50          2HB       ALA  50   5.642   5.437  -8.301
  291    MB   ALA  50           QB       ALA  50   6.412   6.064  -8.527
  292    H    LEU  51           H        LEU  51   8.075   4.197  -6.242
  293    HA   LEU  51           HA       LEU  51   5.870   2.467  -5.410
  294   1HB   LEU  51          2HB       LEU  51   8.187   1.893  -6.296
  295   2HB   LEU  51          1HB       LEU  51   8.811   2.280  -4.691
  296    HG   LEU  51           HG       LEU  51   6.505   0.380  -4.904
  297   1HD1  LEU  51          1HD1      LEU  51   9.393  -0.251  -5.552
  298   2HD1  LEU  51          3HD1      LEU  51   8.230  -1.483  -5.062
  299   3HD1  LEU  51          2HD1      LEU  51   7.973  -0.568  -6.548
  300   1HD2  LEU  51          2HD2      LEU  51   8.374   1.311  -2.922
  301   2HD2  LEU  51          1HD2      LEU  51   6.981   0.251  -2.704
  302   3HD2  LEU  51          3HD2      LEU  51   8.555  -0.434  -3.111
  303    MD1  LEU  51           QD1      LEU  51   8.532  -0.767  -5.721
  304    MD2  LEU  51           QD2      LEU  51   7.970   0.376  -2.912
  305    QB   LEU  51           QB       LEU  51   8.499   2.086  -5.494
  306    QD   LEU  51           QQD      LEU  51   8.251  -0.196  -4.317
  307    H    ALA  52           H        ALA  52   8.433   4.155  -3.505
  308    HA   ALA  52           HA       ALA  52   7.518   3.356  -0.899
  309   1HB   ALA  52          1HB       ALA  52   8.964   5.067  -0.184
  310   2HB   ALA  52          3HB       ALA  52   9.568   4.715  -1.803
  311   3HB   ALA  52          2HB       ALA  52   8.536   6.119  -1.534
  312    MB   ALA  52           QB       ALA  52   9.023   5.300  -1.174
  313    H    ILE  53           H        ILE  53   6.559   6.206  -2.887
  314    HA   ILE  53           HA       ILE  53   4.663   7.247  -0.918
  315    HB   ILE  53           HB       ILE  53   4.758   7.447  -3.948
  316   1HG1  ILE  53          2HG1      ILE  53   6.887   8.118  -3.053
  317   2HG1  ILE  53          1HG1      ILE  53   5.993   9.601  -3.386
  318   1HG2  ILE  53          1HG2      ILE  53   3.301   8.958  -1.790
  319   2HG2  ILE  53          3HG2      ILE  53   3.761   9.776  -3.283
  320   3HG2  ILE  53          2HG2      ILE  53   2.692   8.374  -3.339
  321   1HD1  ILE  53          2HD1      ILE  53   5.178   9.178  -0.856
  322   2HD1  ILE  53          1HD1      ILE  53   6.757   8.395  -0.776
  323   3HD1  ILE  53          3HD1      ILE  53   6.637  10.092  -1.238
  324    MG   ILE  53           QG2      ILE  53   3.251   9.036  -2.804
  325    MD   ILE  53           QD1      ILE  53   6.191   9.222  -0.956
  326    QG   ILE  53           QG1      ILE  53   6.440   8.859  -3.220
  327    H    PHE  54           H        PHE  54   4.278   5.087  -3.774
  328    HA   PHE  54           HA       PHE  54   1.423   4.815  -3.683
  329   1HB   PHE  54          2HB       PHE  54   3.034   3.965  -5.394
  330   2HB   PHE  54          1HB       PHE  54   3.534   2.711  -4.260
  331    HD1  PHE  54          1HD       PHE  54   0.727   3.983  -6.316
  332    HD2  PHE  54          2HD       PHE  54   2.137   0.801  -3.798
  333    HE1  PHE  54          1HE       PHE  54  -1.175   2.567  -7.039
  334    HE2  PHE  54          2HE       PHE  54   0.234  -0.616  -4.522
  335    HZ   PHE  54           HZ       PHE  54  -1.422   0.267  -6.143
  336    QB   PHE  54           QB       PHE  54   3.284   3.338  -4.827
  337    QD   PHE  54           QD       PHE  54   1.432   2.392  -5.057
  338    QE   PHE  54           QE       PHE  54  -0.471   0.976  -5.781
  339    QR   PHE  54           QR       PHE  54   0.100   1.400  -5.564
  340    H    ILE  55           H        ILE  55   3.930   2.876  -1.952
  341    HA   ILE  55           HA       ILE  55   2.029   1.156  -0.570
  342    HB   ILE  55           HB       ILE  55   4.792   2.175   0.170
  343   1HG1  ILE  55          2HG1      ILE  55   4.740   1.072  -2.013
  344   2HG1  ILE  55          1HG1      ILE  55   5.512   0.006  -0.839
  345   1HG2  ILE  55          1HG2      ILE  55   2.918   0.398   1.526
  346   2HG2  ILE  55          3HG2      ILE  55   4.436  -0.416   1.148
  347   3HG2  ILE  55          2HG2      ILE  55   4.445   1.064   2.106
  348   1HD1  ILE  55          2HD1      ILE  55   2.871  -0.696  -0.571
  349   2HD1  ILE  55          1HD1      ILE  55   2.973  -0.334  -2.294
  350   3HD1  ILE  55          3HD1      ILE  55   4.035  -1.550  -1.585
  351    MG   ILE  55           QG2      ILE  55   3.933   0.349   1.593
  352    MD   ILE  55           QD1      ILE  55   3.293  -0.860  -1.483
  353    QG   ILE  55           QG1      ILE  55   5.126   0.539  -1.426
  354    H    GLY  56           H        GLY  56   3.599   4.250   0.402
  355   1HA   GLY  56          1HA       GLY  56   2.868   5.802   2.042
  356   2HA   GLY  56          2HA       GLY  56   2.476   4.400   3.037
  357    QA   GLY  56           QA       GLY  56   2.672   5.101   2.539
  358    H    LEU  57           H        LEU  57   1.116   5.742  -0.032
  359    HA   LEU  57           HA       LEU  57  -1.403   6.569   1.162
  360   1HB   LEU  57          2HB       LEU  57  -0.178   6.855  -1.202
  361   2HB   LEU  57          1HB       LEU  57  -1.250   5.522  -1.633
  362    HG   LEU  57           HG       LEU  57  -2.462   7.521  -2.129
  363   1HD1  LEU  57          3HD1      LEU  57  -3.623   5.691  -0.766
  364   2HD1  LEU  57          2HD1      LEU  57  -3.415   6.741   0.635
  365   3HD1  LEU  57          1HD1      LEU  57  -4.386   7.281  -0.734
  366   1HD2  LEU  57          1HD2      LEU  57  -0.858   8.666  -0.175
  367   2HD2  LEU  57          3HD2      LEU  57  -2.194   9.470  -0.999
  368   3HD2  LEU  57          2HD2      LEU  57  -2.460   8.694   0.562
  369    MD1  LEU  57           QD1      LEU  57  -3.808   6.571  -0.288
  370    MD2  LEU  57           QD2      LEU  57  -1.837   8.943  -0.204
  371    QB   LEU  57           QB       LEU  57  -0.714   6.189  -1.418
  372    QD   LEU  57           QQD      LEU  57  -2.823   7.757  -0.246
  373    H    THR  58           H        THR  58  -0.328   3.472  -0.287
  374    HA   THR  58           HA       THR  58  -2.941   2.182  -0.232
  375    HB   THR  58           HB       THR  58  -0.120   1.093   0.035
  376    HG1  THR  58          1HG       THR  58  -0.949   0.723  -2.350
  377   1HG2  THR  58          1HG2      THR  58  -2.711  -0.228  -0.815
  378   2HG2  THR  58          3HG2      THR  58  -1.115  -0.964  -0.955
  379   3HG2  THR  58          2HG2      THR  58  -1.778  -0.592   0.636
  380    MG   THR  58           QG2      THR  58  -1.868  -0.595  -0.378
  381    H    ILE  59           H        ILE  59  -0.181   2.021   2.089
  382    HA   ILE  59           HA       ILE  59  -1.654   0.444   4.062
  383    HB   ILE  59           HB       ILE  59   0.691   2.357   4.280
  384   1HG1  ILE  59          2HG1      ILE  59   0.619  -0.660   3.951
  385   2HG1  ILE  59          1HG1      ILE  59   0.903   0.472   2.627
  386   1HG2  ILE  59          3HG2      ILE  59  -0.360   1.791   6.470
  387   2HG2  ILE  59          2HG2      ILE  59  -0.150   0.080   6.100
  388   3HG2  ILE  59          1HG2      ILE  59   1.261   1.116   6.310
  389   1HD1  ILE  59          2HD1      ILE  59   2.585   0.359   5.146
  390   2HD1  ILE  59          1HD1      ILE  59   3.019  -0.441   3.634
  391   3HD1  ILE  59          3HD1      ILE  59   2.906   1.317   3.700
  392    MG   ILE  59           QG2      ILE  59   0.250   0.995   6.294
  393    MD   ILE  59           QD1      ILE  59   2.837   0.411   4.160
  394    QG   ILE  59           QG1      ILE  59   0.761  -0.094   3.289
  395    H    TYR  60           H        TYR  60  -1.092   4.001   3.741
  396    HA   TYR  60           HA       TYR  60  -2.421   4.746   6.205
  397   1HB   TYR  60          2HB       TYR  60  -1.052   6.185   4.668
  398   2HB   TYR  60          1HB       TYR  60  -2.386   6.162   3.515
  399    HD1  TYR  60          1HD       TYR  60  -4.244   7.611   3.756
  400    HD2  TYR  60          2HD       TYR  60  -1.449   7.159   6.987
  401    HE1  TYR  60          1HE       TYR  60  -5.329   9.489   4.958
  402    HE2  TYR  60          2HE       TYR  60  -2.534   9.041   8.188
  403    HH   TYR  60           HH       TYR  60  -4.678  10.189   8.243
  404    QB   TYR  60           QB       TYR  60  -1.719   6.173   4.092
  405    QD   TYR  60           QD       TYR  60  -2.847   7.385   5.371
  406    QE   TYR  60           QE       TYR  60  -3.932   9.265   6.573
  407    QR   TYR  60           QR       TYR  60  -3.389   8.325   5.972
  408    H    ALA  61           H        ALA  61  -3.725   4.467   2.854
  409    HA   ALA  61           HA       ALA  61  -6.466   5.080   3.497
  410   1HB   ALA  61          1HB       ALA  61  -5.425   3.065   1.487
  411   2HB   ALA  61          2HB       ALA  61  -5.315   4.810   1.262
  412   3HB   ALA  61          3HB       ALA  61  -6.895   4.033   1.360
  413    MB   ALA  61           QB       ALA  61  -5.878   3.969   1.370
  414    H    ILE  62           H        ILE  62  -4.703   1.952   3.625
  415    HA   ILE  62           HA       ILE  62  -7.030   0.310   4.180
  416    HB   ILE  62           HB       ILE  62  -4.106   0.126   4.948
  417   1HG1  ILE  62          2HG1      ILE  62  -5.093   0.178   2.473
  418   2HG1  ILE  62          1HG1      ILE  62  -3.791  -0.930   2.908
  419   1HG2  ILE  62          1HG2      ILE  62  -6.400  -1.800   5.253
  420   2HG2  ILE  62          3HG2      ILE  62  -4.769  -2.407   4.968
  421   3HG2  ILE  62          2HG2      ILE  62  -5.108  -1.426   6.394
  422   1HD1  ILE  62          2HD1      ILE  62  -6.661  -1.766   3.244
  423   2HD1  ILE  62          1HD1      ILE  62  -5.882  -1.878   1.666
  424   3HD1  ILE  62          3HD1      ILE  62  -5.229  -2.775   3.037
  425    MG   ILE  62           QG2      ILE  62  -5.426  -1.878   5.539
  426    MD   ILE  62           QD1      ILE  62  -5.924  -2.140   2.649
  427    QG   ILE  62           QG1      ILE  62  -4.442  -0.376   2.691
  428    H    GLN  63           H        GLN  63  -4.733   1.961   6.425
  429    HA   GLN  63           HA       GLN  63  -5.944   0.999   8.869
  430   1HB   GLN  63          2HB       GLN  63  -4.580   3.608   8.140
  431   2HB   GLN  63          1HB       GLN  63  -4.866   3.070   9.796
  432   1HG   GLN  63          2HG       GLN  63  -3.533   1.053   9.401
  433   2HG   GLN  63          1HG       GLN  63  -3.283   1.528   7.721
  434   1HE2  GLN  63          1HE2      GLN  63  -1.026   1.110   9.380
  435   2HE2  GLN  63          2HE2      GLN  63  -0.272   2.711   9.715
  436    QB   GLN  63           QB       GLN  63  -4.723   3.339   8.968
  437    QG   GLN  63           QG       GLN  63  -3.408   1.291   8.561
  438    QE   GLN  63           QE2      GLN  63  -0.649   1.911   9.548
  439    H    ARG  64           H        ARG  64  -6.724   3.845   6.821
  440    HA   ARG  64           HA       ARG  64  -8.759   4.904   8.644
  441   1HB   ARG  64          2HB       ARG  64  -8.197   5.105   5.675
  442   2HB   ARG  64          1HB       ARG  64  -9.452   6.057   6.470
  443   1HG   ARG  64          2HG       ARG  64  -7.711   6.919   8.056
  444   2HG   ARG  64          1HG       ARG  64  -6.488   6.080   7.101
  445   1HD   ARG  64          2HD       ARG  64  -8.387   8.184   6.002
  446   2HD   ARG  64          1HD       ARG  64  -6.683   8.463   6.414
  447    HE   ARG  64           HE       ARG  64  -6.109   6.580   4.740
  448   1HH1  ARG  64          1HH1      ARG  64  -9.447   6.928   4.676
  449   2HH1  ARG  64          2HH1      ARG  64  -9.581   7.290   2.988
  450   1HH2  ARG  64          1HH2      ARG  64  -6.169   7.716   2.539
  451   2HH2  ARG  64          2HH2      ARG  64  -7.725   7.737   1.777
  452    QB   ARG  64           QB       ARG  64  -8.824   5.581   6.073
  453    QG   ARG  64           QG       ARG  64  -7.100   6.499   7.579
  454    QD   ARG  64           QD       ARG  64  -7.535   8.323   6.208
  455    QH1  ARG  64           QH1      ARG  64  -9.514   7.109   3.832
  456    QH2  ARG  64           QH2      ARG  64  -6.947   7.727   2.158
  457    H    LYS  65           H        LYS  65  -9.001   2.902   5.648
  458    HA   LYS  65           HA       LYS  65 -11.859   2.540   5.729
  459   1HB   LYS  65          2HB       LYS  65  -9.453   1.180   4.627
  460   2HB   LYS  65          1HB       LYS  65 -10.938   0.229   4.656
  461   1HG   LYS  65          2HG       LYS  65 -11.068   1.325   2.581
  462   2HG   LYS  65          1HG       LYS  65 -12.043   2.355   3.630
  463   1HD   LYS  65          2HD       LYS  65 -10.023   3.785   4.018
  464   2HD   LYS  65          1HD       LYS  65  -9.152   2.806   2.837
  465   1HE   LYS  65          2HE       LYS  65  -9.930   4.450   1.404
  466   2HE   LYS  65          1HE       LYS  65 -11.360   3.399   1.378
  467   1HZ   LYS  65          3HZ       LYS  65 -12.099   4.635   3.423
  468   2HZ   LYS  65          2HZ       LYS  65 -10.877   5.769   3.093
  469   3HZ   LYS  65          1HZ       LYS  65 -12.140   5.528   1.982
  470    QB   LYS  65           QB       LYS  65 -10.196   0.705   4.641
  471    QD   LYS  65           QD       LYS  65  -9.588   3.296   3.428
  472    QG   LYS  65           QG       LYS  65 -11.555   1.840   3.106
  473    QE   LYS  65           QE       LYS  65 -10.645   3.924   1.391
  474    QZ   LYS  65           QZ       LYS  65 -11.705   5.311   2.832
  475    H    ARG  66           H        ARG  66  -9.270   0.401   7.074
  476    HA   ARG  66           HA       ARG  66 -11.061  -1.457   8.378
  477   1HB   ARG  66          2HB       ARG  66  -8.288  -0.418   9.046
  478   2HB   ARG  66          1HB       ARG  66  -9.012  -1.831   9.815
  479   1HG   ARG  66          2HG       ARG  66  -9.311  -2.847   7.543
  480   2HG   ARG  66          1HG       ARG  66  -8.433  -1.480   6.860
  481   1HD   ARG  66          2HD       ARG  66  -7.346  -3.456   8.901
  482   2HD   ARG  66          1HD       ARG  66  -6.860  -3.324   7.199
  483    HE   ARG  66           HE       ARG  66  -6.458  -0.722   8.034
  484   1HH1  ARG  66          1HH1      ARG  66  -4.109  -2.602   7.697
  485   2HH1  ARG  66          2HH1      ARG  66  -3.378  -2.576   9.266
  486   1HH2  ARG  66          1HH2      ARG  66  -6.177  -1.270  10.841
  487   2HH2  ARG  66          2HH2      ARG  66  -4.548  -1.821  11.046
  488    QB   ARG  66           QB       ARG  66  -8.650  -1.125   9.430
  489    QG   ARG  66           QG       ARG  66  -8.872  -2.164   7.202
  490    QD   ARG  66           QD       ARG  66  -7.103  -3.390   8.050
  491    QH1  ARG  66           QH1      ARG  66  -3.743  -2.589   8.482
  492    QH2  ARG  66           QH2      ARG  66  -5.362  -1.546  10.943
  493    H    GLN  67           H        GLN  67  -9.808   1.734   9.379
  494    HA   GLN  67           HA       GLN  67 -11.999   1.946  11.397
  495   1HB   GLN  67          2HB       GLN  67 -10.238   0.512  12.475
  496   2HB   GLN  67          1HB       GLN  67  -9.097   1.843  12.283
  497   1HG   GLN  67          2HG       GLN  67 -10.585   3.298  13.632
  498   2HG   GLN  67          1HG       GLN  67 -11.686   1.939  13.859
  499   1HE2  GLN  67          1HE2      GLN  67 -10.784   2.939  16.216
  500   2HE2  GLN  67          2HE2      GLN  67  -9.475   1.902  16.890
  501    QB   GLN  67           QB       GLN  67  -9.667   1.178  12.379
  502    QG   GLN  67           QG       GLN  67 -11.136   2.619  13.746
  503    QE   GLN  67           QE2      GLN  67 -10.130   2.421  16.553
  504    H    ALA  68           H        ALA  68 -12.467   4.113  11.781
  505    HA   ALA  68           HA       ALA  68 -10.354   6.181  11.427
  506   1HB   ALA  68          3HB       ALA  68 -12.156   5.323   9.242
  507   2HB   ALA  68          1HB       ALA  68 -10.595   6.139   9.155
  508   3HB   ALA  68          2HB       ALA  68 -12.058   7.067   9.482
  509    MB   ALA  68           QB       ALA  68 -11.603   6.176   9.293
  510    H    ASP  69           H        ASP  69 -10.966   8.110  12.421
  511    HA   ASP  69           HA       ASP  69 -13.498   8.047  13.964
  512   1HB   ASP  69          2HB       ASP  69 -11.295   9.036  14.660
  513   2HB   ASP  69          1HB       ASP  69 -11.522  10.291  13.441
  514    QB   ASP  69           QB       ASP  69 -11.408   9.664  14.050

  No H/Q in entry =         514
  Start of MODEL    9
    1    H    THR  24           H        THR  24 -16.323  -2.826   8.710
    2    HA   THR  24           HA       THR  24 -13.583  -2.561   8.423
    3    HB   THR  24           HB       THR  24 -14.809  -5.314   8.384
    4    HG1  THR  24          1HG       THR  24 -15.548  -4.963  10.448
    5   1HG2  THR  24          3HG2      THR  24 -12.303  -4.734   8.759
    6   2HG2  THR  24          2HG2      THR  24 -12.831  -4.170  10.343
    7   3HG2  THR  24          1HG2      THR  24 -13.078  -5.852   9.880
    8    MG   THR  24           QG2      THR  24 -12.737  -4.919   9.661
    9    HA   PRO  25           HA       PRO  25 -13.351  -3.520   4.003
   10   1HB   PRO  25          2HB       PRO  25 -11.153  -1.992   3.497
   11   2HB   PRO  25          1HB       PRO  25 -12.785  -1.305   3.619
   12   1HG   PRO  25          2HG       PRO  25 -10.572  -1.288   5.598
   13   2HG   PRO  25          1HG       PRO  25 -11.792  -0.053   5.253
   14   1HD   PRO  25          2HD       PRO  25 -11.880  -1.812   7.385
   15   2HD   PRO  25          1HD       PRO  25 -13.284  -0.952   6.714
   16    QB   PRO  25           QB       PRO  25 -11.969  -1.648   3.558
   17    QG   PRO  25           QG       PRO  25 -11.182  -0.670   5.426
   18    QD   PRO  25           QD       PRO  25 -12.582  -1.382   7.050
   19    H    VAL  26           H        VAL  26 -12.697  -5.626   5.435
   20    HA   VAL  26           HA       VAL  26  -9.820  -6.168   5.663
   21    HB   VAL  26           HB       VAL  26 -10.623  -8.426   6.094
   22   1HG1  VAL  26          3HG1      VAL  26 -11.552  -6.120   7.399
   23   2HG1  VAL  26          2HG1      VAL  26 -12.976  -7.146   7.222
   24   3HG1  VAL  26          1HG1      VAL  26 -11.542  -7.761   8.045
   25   1HG2  VAL  26          2HG2      VAL  26 -13.122  -7.416   4.710
   26   2HG2  VAL  26          1HG2      VAL  26 -12.106  -8.782   4.245
   27   3HG2  VAL  26          3HG2      VAL  26 -13.104  -8.879   5.696
   28    MG1  VAL  26           QG1      VAL  26 -12.023  -7.009   7.555
   29    MG2  VAL  26           QG2      VAL  26 -12.777  -8.359   4.883
   30    QG   VAL  26           QQG      VAL  26 -12.400  -7.684   6.219
   31    H    LEU  27           H        LEU  27 -12.250  -6.620   3.091
   32    HA   LEU  27           HA       LEU  27 -10.690  -8.371   1.386
   33   1HB   LEU  27          2HB       LEU  27 -13.151  -7.323   1.377
   34   2HB   LEU  27          1HB       LEU  27 -12.395  -6.187   0.260
   35    HG   LEU  27           HG       LEU  27 -13.273  -7.980  -1.073
   36   1HD1  LEU  27          2HD1      LEU  27 -10.849  -7.165  -1.439
   37   2HD1  LEU  27          1HD1      LEU  27 -10.362  -8.704  -0.729
   38   3HD1  LEU  27          3HD1      LEU  27 -11.316  -8.680  -2.212
   39   1HD2  LEU  27          3HD2      LEU  27 -12.246  -9.607   1.185
   40   2HD2  LEU  27          2HD2      LEU  27 -13.667  -9.861   0.171
   41   3HD2  LEU  27          1HD2      LEU  27 -12.071 -10.331  -0.413
   42    MD1  LEU  27           QD1      LEU  27 -10.842  -8.183  -1.460
   43    MD2  LEU  27           QD2      LEU  27 -12.661  -9.933   0.314
   44    QB   LEU  27           QB       LEU  27 -12.773  -6.755   0.818
   45    QD   LEU  27           QQD      LEU  27 -11.752  -9.058  -0.573
   46    H    VAL  28           H        VAL  28 -10.656  -4.839   1.849
   47    HA   VAL  28           HA       VAL  28  -9.104  -4.129  -0.479
   48    HB   VAL  28           HB       VAL  28  -9.287  -3.036   2.341
   49   1HG1  VAL  28          3HG1      VAL  28  -8.086  -1.803  -0.154
   50   2HG1  VAL  28          2HG1      VAL  28  -8.455  -0.905   1.319
   51   3HG1  VAL  28          1HG1      VAL  28  -7.239  -2.182   1.345
   52   1HG2  VAL  28          3HG2      VAL  28 -11.316  -3.206   0.723
   53   2HG2  VAL  28          2HG2      VAL  28 -11.004  -1.653   1.499
   54   3HG2  VAL  28          1HG2      VAL  28 -10.516  -1.918  -0.176
   55    MG1  VAL  28           QG1      VAL  28  -7.927  -1.630   0.836
   56    MG2  VAL  28           QG2      VAL  28 -10.945  -2.259   0.682
   57    QG   VAL  28           QQG      VAL  28  -9.436  -1.945   0.759
   58    H    ILE  29           H        ILE  29  -8.068  -5.214   2.788
   59    HA   ILE  29           HA       ILE  29  -5.212  -4.830   2.315
   60    HB   ILE  29           HB       ILE  29  -6.778  -6.756   4.062
   61   1HG1  ILE  29          2HG1      ILE  29  -5.562  -4.051   4.700
   62   2HG1  ILE  29          1HG1      ILE  29  -7.271  -4.308   4.345
   63   1HG2  ILE  29          3HG2      ILE  29  -3.888  -5.845   4.144
   64   2HG2  ILE  29          2HG2      ILE  29  -4.692  -6.689   5.469
   65   3HG2  ILE  29          1HG2      ILE  29  -4.474  -7.492   3.913
   66   1HD1  ILE  29          1HD1      ILE  29  -6.854  -6.214   6.251
   67   2HD1  ILE  29          3HD1      ILE  29  -5.733  -4.963   6.786
   68   3HD1  ILE  29          2HD1      ILE  29  -7.446  -4.591   6.600
   69    MG   ILE  29           QG2      ILE  29  -4.351  -6.675   4.509
   70    MD   ILE  29           QD1      ILE  29  -6.678  -5.256   6.546
   71    QG   ILE  29           QG1      ILE  29  -6.417  -4.180   4.523
   72    H    LEU  30           H        LEU  30  -7.438  -7.569   1.715
   73    HA   LEU  30           HA       LEU  30  -5.421  -9.536   1.042
   74   1HB   LEU  30          2HB       LEU  30  -7.848  -9.897   1.454
   75   2HB   LEU  30          1HB       LEU  30  -8.210  -9.096  -0.075
   76    HG   LEU  30           HG       LEU  30  -6.705 -10.825  -1.190
   77   1HD1  LEU  30          1HD1      LEU  30  -6.050 -11.434   1.430
   78   2HD1  LEU  30          3HD1      LEU  30  -7.165 -12.729   0.995
   79   3HD1  LEU  30          2HD1      LEU  30  -5.714 -12.456   0.031
   80   1HD2  LEU  30          2HD2      LEU  30  -9.344 -11.369   0.126
   81   2HD2  LEU  30          1HD2      LEU  30  -8.959 -11.228  -1.590
   82   3HD2  LEU  30          3HD2      LEU  30  -8.530 -12.694  -0.707
   83    MD1  LEU  30           QD1      LEU  30  -6.310 -12.206   0.819
   84    MD2  LEU  30           QD2      LEU  30  -8.944 -11.764  -0.724
   85    QB   LEU  30           QB       LEU  30  -8.029  -9.497   0.690
   86    QD   LEU  30           QQD      LEU  30  -7.627 -11.985   0.048
   87    H    LEU  31           H        LEU  31  -7.150  -7.136  -1.013
   88    HA   LEU  31           HA       LEU  31  -5.928  -7.971  -3.518
   89   1HB   LEU  31          2HB       LEU  31  -7.918  -6.512  -3.199
   90   2HB   LEU  31          1HB       LEU  31  -6.865  -5.245  -2.569
   91    HG   LEU  31           HG       LEU  31  -5.573  -5.403  -4.760
   92   1HD1  LEU  31          2HD1      LEU  31  -7.729  -7.384  -5.199
   93   2HD1  LEU  31          1HD1      LEU  31  -7.434  -6.280  -6.543
   94   3HD1  LEU  31          3HD1      LEU  31  -6.125  -7.287  -5.924
   95   1HD2  LEU  31          2HD2      LEU  31  -8.069  -4.127  -4.125
   96   2HD2  LEU  31          1HD2      LEU  31  -6.769  -3.537  -5.160
   97   3HD2  LEU  31          3HD2      LEU  31  -8.055  -4.532  -5.841
   98    MD1  LEU  31           QD1      LEU  31  -7.096  -6.984  -5.889
   99    MD2  LEU  31           QD2      LEU  31  -7.631  -4.065  -5.042
  100    QB   LEU  31           QB       LEU  31  -7.391  -5.878  -2.884
  101    QD   LEU  31           QQD      LEU  31  -7.364  -5.524  -5.466
  102    H    GLY  32           H        GLY  32  -4.942  -5.533  -1.062
  103   1HA   GLY  32          1HA       GLY  32  -2.844  -4.438  -0.844
  104   2HA   GLY  32          2HA       GLY  32  -2.634  -4.599  -2.588
  105    QA   GLY  32           QA       GLY  32  -2.739  -4.519  -1.716
  106    H    VAL  33           H        VAL  33  -3.100  -7.225  -0.213
  107    HA   VAL  33           HA       VAL  33  -0.324  -7.927   0.153
  108    HB   VAL  33           HB       VAL  33  -2.894  -9.536   0.059
  109   1HG1  VAL  33          2HG1      VAL  33  -0.084 -10.295   0.838
  110   2HG1  VAL  33          1HG1      VAL  33  -1.469 -11.079   1.599
  111   3HG1  VAL  33          3HG1      VAL  33  -1.239 -11.194  -0.145
  112   1HG2  VAL  33          2HG2      VAL  33  -2.057  -7.567   1.810
  113   2HG2  VAL  33          1HG2      VAL  33  -3.228  -8.829   2.191
  114   3HG2  VAL  33          3HG2      VAL  33  -1.530  -9.045   2.617
  115    MG1  VAL  33           QG1      VAL  33  -0.931 -10.856   0.764
  116    MG2  VAL  33           QG2      VAL  33  -2.271  -8.481   2.206
  117    QG   VAL  33           QQG      VAL  33  -1.601  -9.668   1.485
  118    H    VAL  34           H        VAL  34  -2.704  -9.054  -2.298
  119    HA   VAL  34           HA       VAL  34  -0.953 -10.912  -3.650
  120    HB   VAL  34           HB       VAL  34  -3.224  -9.127  -4.566
  121   1HG1  VAL  34          3HG1      VAL  34  -1.912 -11.490  -5.942
  122   2HG1  VAL  34          2HG1      VAL  34  -3.446 -10.778  -6.439
  123   3HG1  VAL  34          1HG1      VAL  34  -1.963  -9.828  -6.528
  124   1HG2  VAL  34          3HG2      VAL  34  -3.305 -11.114  -2.744
  125   2HG2  VAL  34          2HG2      VAL  34  -4.633 -10.802  -3.862
  126   3HG2  VAL  34          1HG2      VAL  34  -3.466 -12.076  -4.215
  127    MG1  VAL  34           QG1      VAL  34  -2.440 -10.699  -6.303
  128    MG2  VAL  34           QG2      VAL  34  -3.801 -11.331  -3.607
  129    QG   VAL  34           QQG      VAL  34  -3.121 -11.015  -4.955
  130    H    GLY  35           H        GLY  35  -1.444  -7.380  -4.133
  131   1HA   GLY  35          1HA       GLY  35  -0.067  -5.867  -5.337
  132   2HA   GLY  35          2HA       GLY  35   0.216  -7.170  -6.491
  133    QA   GLY  35           QA       GLY  35   0.074  -6.518  -5.914
  134    H    LEU  36           H        LEU  36   1.057  -7.098  -3.006
  135    HA   LEU  36           HA       LEU  36   3.842  -6.375  -3.339
  136   1HB   LEU  36          2HB       LEU  36   2.428  -8.180  -1.351
  137   2HB   LEU  36          1HB       LEU  36   4.029  -7.482  -1.108
  138    HG   LEU  36           HG       LEU  36   1.444  -5.943  -1.487
  139   1HD1  LEU  36          3HD1      LEU  36   2.981  -6.890   0.837
  140   2HD1  LEU  36          2HD1      LEU  36   2.605  -5.167   0.887
  141   3HD1  LEU  36          1HD1      LEU  36   1.304  -6.351   0.742
  142   1HD2  LEU  36          3HD2      LEU  36   4.321  -5.180  -1.584
  143   2HD2  LEU  36          2HD2      LEU  36   2.934  -4.440  -2.384
  144   3HD2  LEU  36          1HD2      LEU  36   3.251  -4.107  -0.682
  145    MD1  LEU  36           QD1      LEU  36   2.297  -6.136   0.822
  146    MD2  LEU  36           QD2      LEU  36   3.502  -4.576  -1.550
  147    QB   LEU  36           QB       LEU  36   3.229  -7.831  -1.229
  148    QD   LEU  36           QQD      LEU  36   2.899  -5.356  -0.364
  149    H    SER  37           H        SER  37   2.181  -9.545  -3.514
  150    HA   SER  37           HA       SER  37   4.524 -11.221  -3.575
  151   1HB   SER  37          2HB       SER  37   2.983 -12.837  -4.361
  152   2HB   SER  37          1HB       SER  37   1.973 -11.688  -3.489
  153    HG   SER  37           HG       SER  37   1.235 -10.896  -5.363
  154    QB   SER  37           QB       SER  37   2.478 -12.262  -3.925
  155    H    ALA  38           H        ALA  38   2.745  -9.691  -6.326
  156    HA   ALA  38           HA       ALA  38   4.413 -10.673  -8.442
  157   1HB   ALA  38          2HB       ALA  38   2.620  -8.398  -7.874
  158   2HB   ALA  38          1HB       ALA  38   3.765  -8.108  -9.183
  159   3HB   ALA  38          3HB       ALA  38   2.654  -9.476  -9.270
  160    MB   ALA  38           QB       ALA  38   3.013  -8.661  -8.776
  161    H    LEU  39           H        LEU  39   4.977  -8.031  -6.118
  162    HA   LEU  39           HA       LEU  39   7.632  -7.482  -7.510
  163   1HB   LEU  39          2HB       LEU  39   5.641  -5.973  -5.881
  164   2HB   LEU  39          1HB       LEU  39   7.332  -5.496  -5.723
  165    HG   LEU  39           HG       LEU  39   5.986  -4.311  -7.555
  166   1HD1  LEU  39          3HD1      LEU  39   8.657  -5.228  -7.450
  167   2HD1  LEU  39          2HD1      LEU  39   8.118  -5.490  -9.108
  168   3HD1  LEU  39          1HD1      LEU  39   8.029  -3.879  -8.396
  169   1HD2  LEU  39          1HD2      LEU  39   4.905  -6.528  -8.260
  170   2HD2  LEU  39          3HD2      LEU  39   5.511  -5.509  -9.566
  171   3HD2  LEU  39          2HD2      LEU  39   6.442  -6.909  -9.037
  172    MD1  LEU  39           QD1      LEU  39   8.268  -4.866  -8.318
  173    MD2  LEU  39           QD2      LEU  39   5.619  -6.316  -8.954
  174    QB   LEU  39           QB       LEU  39   6.486  -5.734  -5.802
  175    QD   LEU  39           QQD      LEU  39   6.944  -5.591  -8.636
  176    H    THR  40           H        THR  40   9.209  -8.806  -6.644
  177    HA   THR  40           HA       THR  40   9.536  -8.651  -3.635
  178    HB   THR  40           HB       THR  40   9.818 -11.176  -3.668
  179    HG1  THR  40          1HG       THR  40   9.612 -12.166  -5.501
  180   1HG2  THR  40          3HG2      THR  40   7.729  -9.984  -2.934
  181   2HG2  THR  40          2HG2      THR  40   7.100 -10.190  -4.567
  182   3HG2  THR  40          1HG2      THR  40   7.440 -11.602  -3.569
  183    MG   THR  40           QG2      THR  40   7.423 -10.592  -3.690
  184    H    GLY  41           H        GLY  41  11.052  -7.419  -5.814
  185   1HA   GLY  41          1HA       GLY  41  13.204  -7.888  -6.976
  186   2HA   GLY  41          2HA       GLY  41  13.536  -9.173  -5.813
  187    QA   GLY  41           QA       GLY  41  13.370  -8.530  -6.395
  188    H    TYR  42           H        TYR  42  15.113  -6.703  -6.601
  189    HA   TYR  42           HA       TYR  42  15.175  -5.396  -3.839
  190   1HB   TYR  42          2HB       TYR  42  17.479  -6.388  -5.551
  191   2HB   TYR  42          1HB       TYR  42  17.640  -5.577  -3.992
  192    HD1  TYR  42          1HD       TYR  42  16.684  -6.658  -1.923
  193    HD2  TYR  42          2HD       TYR  42  16.941  -8.710  -5.688
  194    HE1  TYR  42          1HE       TYR  42  16.385  -8.828  -0.761
  195    HE2  TYR  42          2HE       TYR  42  16.642 -10.880  -4.526
  196    HH   TYR  42           HH       TYR  42  15.556 -11.635  -2.294
  197    QB   TYR  42           QB       TYR  42  17.560  -5.983  -4.771
  198    QD   TYR  42           QD       TYR  42  16.812  -7.684  -3.806
  199    QE   TYR  42           QE       TYR  42  16.513  -9.854  -2.643
  200    QR   TYR  42           QR       TYR  42  16.663  -8.769  -3.224
  201    H    LEU  43           H        LEU  43  15.489  -3.178  -3.843
  202    HA   LEU  43           HA       LEU  43  16.729  -1.752  -6.088
  203   1HB   LEU  43          2HB       LEU  43  14.658  -2.597  -7.181
  204   2HB   LEU  43          1HB       LEU  43  13.695  -1.775  -5.953
  205    HG   LEU  43           HG       LEU  43  14.871   0.376  -6.655
  206   1HD1  LEU  43          3HD1      LEU  43  16.449  -1.396  -8.108
  207   2HD1  LEU  43          2HD1      LEU  43  15.405  -0.672  -9.333
  208   3HD1  LEU  43          1HD1      LEU  43  16.410   0.356  -8.312
  209   1HD2  LEU  43          2HD2      LEU  43  13.171  -1.080  -8.705
  210   2HD2  LEU  43          1HD2      LEU  43  12.560  -0.159  -7.331
  211   3HD2  LEU  43          3HD2      LEU  43  13.412   0.666  -8.636
  212    MD1  LEU  43           QD1      LEU  43  16.088  -0.571  -8.584
  213    MD2  LEU  43           QD2      LEU  43  13.048  -0.191  -8.224
  214    QB   LEU  43           QB       LEU  43  14.176  -2.186  -6.567
  215    QD   LEU  43           QQD      LEU  43  14.568  -0.381  -8.404
  216    H    ASP  44           H        ASP  44  17.123   0.400  -5.489
  217    HA   ASP  44           HA       ASP  44  15.892   1.212  -2.824
  218   1HB   ASP  44          2HB       ASP  44  18.343   2.071  -4.391
  219   2HB   ASP  44          1HB       ASP  44  17.854   2.799  -2.861
  220    QB   ASP  44           QB       ASP  44  18.099   2.435  -3.626
  221    H    TYR  45           H        TYR  45  15.386   3.584  -2.574
  222    HA   TYR  45           HA       TYR  45  13.512   4.459  -4.585
  223   1HB   TYR  45          2HB       TYR  45  15.136   6.039  -2.563
  224   2HB   TYR  45          1HB       TYR  45  13.628   6.574  -3.304
  225    HD1  TYR  45          1HD       TYR  45  11.574   4.978  -3.048
  226    HD2  TYR  45          2HD       TYR  45  15.077   4.810  -0.567
  227    HE1  TYR  45          1HE       TYR  45  10.288   3.758  -1.316
  228    HE2  TYR  45          2HE       TYR  45  13.789   3.589   1.167
  229    HH   TYR  45           HH       TYR  45  11.802   2.814   1.773
  230    QB   TYR  45           QB       TYR  45  14.382   6.307  -2.933
  231    QD   TYR  45           QD       TYR  45  13.325   4.894  -1.808
  232    QE   TYR  45           QE       TYR  45  12.039   3.673  -0.075
  233    QR   TYR  45           QR       TYR  45  12.682   4.284  -0.941
  234    H    VAL  46           H        VAL  46  13.656   5.778  -6.403
  235    HA   VAL  46           HA       VAL  46  16.507   6.426  -7.260
  236    HB   VAL  46           HB       VAL  46  15.497   6.428  -9.506
  237   1HG1  VAL  46          1HG1      VAL  46  15.916   4.245  -7.944
  238   2HG1  VAL  46          3HG1      VAL  46  14.212   4.022  -8.343
  239   3HG1  VAL  46          2HG1      VAL  46  15.412   4.146  -9.630
  240   1HG2  VAL  46          3HG2      VAL  46  13.101   6.856  -7.966
  241   2HG2  VAL  46          2HG2      VAL  46  13.317   6.955  -9.713
  242   3HG2  VAL  46          1HG2      VAL  46  12.900   5.416  -8.962
  243    MG1  VAL  46           QG1      VAL  46  15.180   4.138  -8.639
  244    MG2  VAL  46           QG2      VAL  46  13.106   6.409  -8.881
  245    QG   VAL  46           QQG      VAL  46  14.143   5.273  -8.760
  246    H    LEU  47           H        LEU  47  14.963   8.181  -9.353
  247    HA   LEU  47           HA       LEU  47  15.521  10.740  -8.120
  248   1HB   LEU  47          2HB       LEU  47  15.287  10.197 -10.548
  249   2HB   LEU  47          1HB       LEU  47  13.548  10.017 -10.312
  250    HG   LEU  47           HG       LEU  47  13.555  12.391  -9.389
  251   1HD1  LEU  47          1HD1      LEU  47  16.372  11.987  -9.774
  252   2HD1  LEU  47          3HD1      LEU  47  15.840  13.306 -10.816
  253   3HD1  LEU  47          2HD1      LEU  47  15.550  13.384  -9.079
  254   1HD2  LEU  47          2HD2      LEU  47  12.879  11.692 -11.741
  255   2HD2  LEU  47          1HD2      LEU  47  13.414  13.366 -11.584
  256   3HD2  LEU  47          3HD2      LEU  47  14.501  12.152 -12.258
  257    MD1  LEU  47           QD1      LEU  47  15.921  12.892  -9.890
  258    MD2  LEU  47           QD2      LEU  47  13.598  12.403 -11.861
  259    QB   LEU  47           QB       LEU  47  14.417  10.107 -10.430
  260    QD   LEU  47           QQD      LEU  47  14.759  12.648 -10.875
  261    H    LEU  48           H        LEU  48  12.558   8.747  -8.220
  262    HA   LEU  48           HA       LEU  48  11.411  10.589  -6.096
  263   1HB   LEU  48          2HB       LEU  48  10.707  11.214  -8.471
  264   2HB   LEU  48          1HB       LEU  48   9.875   9.660  -8.535
  265    HG   LEU  48           HG       LEU  48   8.747  10.395  -6.326
  266   1HD1  LEU  48          2HD1      LEU  48  10.458  12.622  -6.807
  267   2HD1  LEU  48          1HD1      LEU  48   8.797  13.181  -7.009
  268   3HD1  LEU  48          3HD1      LEU  48   9.294  12.415  -5.499
  269   1HD2  LEU  48          2HD2      LEU  48   7.925  10.475  -8.882
  270   2HD2  LEU  48          1HD2      LEU  48   6.929  11.090  -7.563
  271   3HD2  LEU  48          3HD2      LEU  48   7.887  12.204  -8.538
  272    MD1  LEU  48           QD1      LEU  48   9.517  12.739  -6.438
  273    MD2  LEU  48           QD2      LEU  48   7.580  11.256  -8.328
  274    QB   LEU  48           QB       LEU  48  10.291  10.437  -8.503
  275    QD   LEU  48           QQD      LEU  48   8.548  11.998  -7.383
  276    HA   PRO  49           HA       PRO  49  10.435   6.550  -4.548
  277   1HB   PRO  49          2HB       PRO  49   9.129   7.342  -2.290
  278   2HB   PRO  49          1HB       PRO  49  10.894   7.452  -2.455
  279   1HG   PRO  49          2HG       PRO  49   8.833   9.582  -2.719
  280   2HG   PRO  49          1HG       PRO  49  10.450   9.658  -2.001
  281   1HD   PRO  49          2HD       PRO  49   9.835  10.579  -4.512
  282   2HD   PRO  49          1HD       PRO  49  11.459  10.060  -4.007
  283    QB   PRO  49           QB       PRO  49  10.011   7.397  -2.373
  284    QG   PRO  49           QG       PRO  49   9.642   9.620  -2.360
  285    QD   PRO  49           QD       PRO  49  10.647  10.320  -4.260
  286    H    ALA  50           H        ALA  50   8.861   7.143  -6.697
  287    HA   ALA  50           HA       ALA  50   6.086   7.687  -6.272
  288   1HB   ALA  50          2HB       ALA  50   7.805   6.210  -8.180
  289   2HB   ALA  50          1HB       ALA  50   6.098   5.765  -8.219
  290   3HB   ALA  50          3HB       ALA  50   6.579   7.440  -8.493
  291    MB   ALA  50           QB       ALA  50   6.827   6.472  -8.297
  292    H    LEU  51           H        LEU  51   7.849   4.566  -5.966
  293    HA   LEU  51           HA       LEU  51   5.458   2.992  -5.336
  294   1HB   LEU  51          2HB       LEU  51   7.750   2.236  -6.114
  295   2HB   LEU  51          1HB       LEU  51   8.336   2.555  -4.482
  296    HG   LEU  51           HG       LEU  51   5.905   0.833  -4.842
  297   1HD1  LEU  51          3HD1      LEU  51   8.785  -0.017  -5.252
  298   2HD1  LEU  51          2HD1      LEU  51   7.475  -1.147  -4.912
  299   3HD1  LEU  51          1HD1      LEU  51   7.449  -0.188  -6.391
  300   1HD2  LEU  51          3HD2      LEU  51   8.074   1.282  -2.818
  301   2HD2  LEU  51          2HD2      LEU  51   6.329   1.190  -2.581
  302   3HD2  LEU  51          1HD2      LEU  51   7.260  -0.282  -2.858
  303    MD1  LEU  51           QD1      LEU  51   7.903  -0.451  -5.518
  304    MD2  LEU  51           QD2      LEU  51   7.221   0.730  -2.752
  305    QB   LEU  51           QB       LEU  51   8.043   2.396  -5.298
  306    QD   LEU  51           QQD      LEU  51   7.562   0.140  -4.135
  307    H    ALA  52           H        ALA  52   8.020   4.441  -3.244
  308    HA   ALA  52           HA       ALA  52   6.931   3.632  -0.715
  309   1HB   ALA  52          2HB       ALA  52   8.978   5.201  -1.727
  310   2HB   ALA  52          1HB       ALA  52   8.000   6.364  -0.833
  311   3HB   ALA  52          3HB       ALA  52   8.649   4.943  -0.014
  312    MB   ALA  52           QB       ALA  52   8.542   5.503  -0.858
  313    H    ILE  53           H        ILE  53   6.208   6.569  -2.673
  314    HA   ILE  53           HA       ILE  53   4.289   7.684  -0.779
  315    HB   ILE  53           HB       ILE  53   4.585   7.869  -3.795
  316   1HG1  ILE  53          2HG1      ILE  53   6.585   8.543  -2.511
  317   2HG1  ILE  53          1HG1      ILE  53   5.817   9.946  -3.255
  318   1HG2  ILE  53          2HG2      ILE  53   2.845   9.302  -1.818
  319   2HG2  ILE  53          1HG2      ILE  53   3.494  10.203  -3.187
  320   3HG2  ILE  53          3HG2      ILE  53   2.477   8.790  -3.465
  321   1HD1  ILE  53          1HD1      ILE  53   4.551   9.636  -0.759
  322   2HD1  ILE  53          3HD1      ILE  53   6.271   9.397  -0.448
  323   3HD1  ILE  53          2HD1      ILE  53   5.711  10.886  -1.211
  324    MG   ILE  53           QG2      ILE  53   2.939   9.432  -2.823
  325    MD   ILE  53           QD1      ILE  53   5.511   9.973  -0.806
  326    QG   ILE  53           QG1      ILE  53   6.201   9.245  -2.883
  327    H    PHE  54           H        PHE  54   3.899   5.530  -3.638
  328    HA   PHE  54           HA       PHE  54   1.030   5.390  -3.637
  329   1HB   PHE  54          2HB       PHE  54   2.657   4.464  -5.296
  330   2HB   PHE  54          1HB       PHE  54   3.060   3.190  -4.145
  331    HD1  PHE  54          1HD       PHE  54   0.362   4.606  -6.259
  332    HD2  PHE  54          2HD       PHE  54   1.584   1.332  -3.762
  333    HE1  PHE  54          1HE       PHE  54  -1.582   3.281  -7.045
  334    HE2  PHE  54          2HE       PHE  54  -0.359   0.007  -4.547
  335    HZ   PHE  54           HZ       PHE  54  -1.943   0.981  -6.189
  336    QB   PHE  54           QB       PHE  54   2.858   3.827  -4.720
  337    QD   PHE  54           QD       PHE  54   0.973   2.969  -5.010
  338    QE   PHE  54           QE       PHE  54  -0.971   1.644  -5.796
  339    QR   PHE  54           QR       PHE  54  -0.388   2.041  -5.560
  340    H    ILE  55           H        ILE  55   3.397   3.356  -1.819
  341    HA   ILE  55           HA       ILE  55   1.378   1.729  -0.490
  342    HB   ILE  55           HB       ILE  55   4.154   2.625   0.351
  343   1HG1  ILE  55          2HG1      ILE  55   4.175   1.563  -1.842
  344   2HG1  ILE  55          1HG1      ILE  55   4.811   0.421  -0.656
  345   1HG2  ILE  55          2HG2      ILE  55   2.325   0.414   1.303
  346   2HG2  ILE  55          1HG2      ILE  55   4.070   0.362   1.555
  347   3HG2  ILE  55          3HG2      ILE  55   3.115   1.663   2.266
  348   1HD1  ILE  55          2HD1      ILE  55   2.231  -0.264  -0.493
  349   2HD1  ILE  55          1HD1      ILE  55   2.221   0.368  -2.140
  350   3HD1  ILE  55          3HD1      ILE  55   3.297  -0.962  -1.714
  351    MG   ILE  55           QG2      ILE  55   3.170   0.813   1.708
  352    MD   ILE  55           QD1      ILE  55   2.583  -0.286  -1.449
  353    QG   ILE  55           QG1      ILE  55   4.493   0.992  -1.249
  354    H    GLY  56           H        GLY  56   3.047   4.763   0.500
  355   1HA   GLY  56          1HA       GLY  56   2.328   6.363   2.099
  356   2HA   GLY  56          2HA       GLY  56   1.881   4.986   3.106
  357    QA   GLY  56           QA       GLY  56   2.105   5.675   2.603
  358    H    LEU  57           H        LEU  57   0.604   6.297  -0.010
  359    HA   LEU  57           HA       LEU  57  -1.909   7.221   1.136
  360   1HB   LEU  57          2HB       LEU  57  -0.856   7.753  -1.096
  361   2HB   LEU  57          1HB       LEU  57  -1.344   6.150  -1.644
  362    HG   LEU  57           HG       LEU  57  -3.396   7.957  -0.410
  363   1HD1  LEU  57          1HD1      LEU  57  -2.013   9.146  -2.264
  364   2HD1  LEU  57          3HD1      LEU  57  -2.803   8.017  -3.365
  365   3HD1  LEU  57          2HD1      LEU  57  -3.771   9.142  -2.412
  366   1HD2  LEU  57          3HD2      LEU  57  -3.289   5.430  -1.796
  367   2HD2  LEU  57          2HD2      LEU  57  -4.672   6.202  -1.022
  368   3HD2  LEU  57          1HD2      LEU  57  -4.293   6.557  -2.708
  369    MD1  LEU  57           QD1      LEU  57  -2.863   8.768  -2.681
  370    MD2  LEU  57           QD2      LEU  57  -4.085   6.063  -1.842
  371    QB   LEU  57           QB       LEU  57  -1.100   6.952  -1.370
  372    QD   LEU  57           QQD      LEU  57  -3.474   7.416  -2.261
  373    H    THR  58           H        THR  58  -0.898   4.076  -0.255
  374    HA   THR  58           HA       THR  58  -3.547   2.860  -0.219
  375    HB   THR  58           HB       THR  58  -0.775   1.668   0.122
  376    HG1  THR  58          1HG       THR  58  -0.608   1.832  -1.997
  377   1HG2  THR  58          1HG2      THR  58  -3.456   0.519  -0.122
  378   2HG2  THR  58          3HG2      THR  58  -2.344  -0.069  -1.358
  379   3HG2  THR  58          2HG2      THR  58  -1.941  -0.252   0.349
  380    MG   THR  58           QG2      THR  58  -2.580   0.066  -0.377
  381    H    ILE  59           H        ILE  59  -0.822   2.648   2.140
  382    HA   ILE  59           HA       ILE  59  -2.378   1.149   4.113
  383    HB   ILE  59           HB       ILE  59   0.034   2.974   4.355
  384   1HG1  ILE  59          2HG1      ILE  59   0.381   1.206   2.709
  385   2HG1  ILE  59          1HG1      ILE  59   1.274   0.799   4.175
  386   1HG2  ILE  59          3HG2      ILE  59  -1.396   1.186   6.246
  387   2HG2  ILE  59          2HG2      ILE  59   0.361   1.040   6.229
  388   3HG2  ILE  59          1HG2      ILE  59  -0.391   2.598   6.575
  389   1HD1  ILE  59          1HD1      ILE  59  -0.815  -0.527   4.878
  390   2HD1  ILE  59          3HD1      ILE  59  -1.344  -0.354   3.205
  391   3HD1  ILE  59          2HD1      ILE  59   0.155  -1.208   3.572
  392    MG   ILE  59           QG2      ILE  59  -0.475   1.608   6.350
  393    MD   ILE  59           QD1      ILE  59  -0.668  -0.697   3.885
  394    QG   ILE  59           QG1      ILE  59   0.827   1.003   3.442
  395    H    TYR  60           H        TYR  60  -1.672   4.674   3.747
  396    HA   TYR  60           HA       TYR  60  -2.981   5.513   6.190
  397   1HB   TYR  60          2HB       TYR  60  -1.564   6.883   4.648
  398   2HB   TYR  60          1HB       TYR  60  -2.872   6.865   3.469
  399    HD1  TYR  60          1HD       TYR  60  -1.856   8.041   6.831
  400    HD2  TYR  60          2HD       TYR  60  -4.818   8.261   3.727
  401    HE1  TYR  60          1HE       TYR  60  -2.884   9.999   7.951
  402    HE2  TYR  60          2HE       TYR  60  -5.847  10.220   4.851
  403    HH   TYR  60           HH       TYR  60  -5.283  11.944   6.418
  404    QB   TYR  60           QB       TYR  60  -2.218   6.874   4.058
  405    QD   TYR  60           QD       TYR  60  -3.337   8.151   5.279
  406    QE   TYR  60           QE       TYR  60  -4.366  10.110   6.401
  407    QR   TYR  60           QR       TYR  60  -3.852   9.130   5.840
  408    H    ALA  61           H        ALA  61  -4.291   5.204   2.845
  409    HA   ALA  61           HA       ALA  61  -7.014   5.920   3.497
  410   1HB   ALA  61          3HB       ALA  61  -6.078   3.876   1.470
  411   2HB   ALA  61          2HB       ALA  61  -7.473   4.948   1.350
  412   3HB   ALA  61          1HB       ALA  61  -5.843   5.614   1.259
  413    MB   ALA  61           QB       ALA  61  -6.465   4.813   1.359
  414    H    ILE  62           H        ILE  62  -5.344   2.741   3.589
  415    HA   ILE  62           HA       ILE  62  -7.737   1.185   4.159
  416    HB   ILE  62           HB       ILE  62  -4.789   0.874   4.761
  417   1HG1  ILE  62          2HG1      ILE  62  -6.492  -0.612   2.757
  418   2HG1  ILE  62          1HG1      ILE  62  -5.761   0.946   2.365
  419   1HG2  ILE  62          1HG2      ILE  62  -7.129  -0.905   5.359
  420   2HG2  ILE  62          3HG2      ILE  62  -5.609  -1.645   4.854
  421   3HG2  ILE  62          2HG2      ILE  62  -5.661  -0.636   6.300
  422   1HD1  ILE  62          3HD1      ILE  62  -3.717  -0.571   3.575
  423   2HD1  ILE  62          2HD1      ILE  62  -4.524  -1.665   2.450
  424   3HD1  ILE  62          1HD1      ILE  62  -3.856  -0.139   1.870
  425    MG   ILE  62           QG2      ILE  62  -6.133  -1.062   5.504
  426    MD   ILE  62           QD1      ILE  62  -4.033  -0.792   2.632
  427    QG   ILE  62           QG1      ILE  62  -6.126   0.167   2.561
  428    H    GLN  63           H        GLN  63  -5.291   2.671   6.361
  429    HA   GLN  63           HA       GLN  63  -6.525   1.712   8.814
  430   1HB   GLN  63          2HB       GLN  63  -4.922   4.201   8.148
  431   2HB   GLN  63          1HB       GLN  63  -5.211   3.610   9.785
  432   1HG   GLN  63          2HG       GLN  63  -3.823   2.062   7.577
  433   2HG   GLN  63          1HG       GLN  63  -3.023   2.836   8.945
  434   1HE2  GLN  63          1HE2      GLN  63  -3.745  -0.165   7.949
  435   2HE2  GLN  63          2HE2      GLN  63  -4.211  -0.921   9.515
  436    QB   GLN  63           QB       GLN  63  -5.067   3.905   8.967
  437    QG   GLN  63           QG       GLN  63  -3.423   2.449   8.261
  438    QE   GLN  63           QE2      GLN  63  -3.978  -0.543   8.732
  439    H    ARG  64           H        ARG  64  -7.060   4.676   6.860
  440    HA   ARG  64           HA       ARG  64  -8.904   5.920   8.754
  441   1HB   ARG  64          2HB       ARG  64  -7.718   6.981   6.828
  442   2HB   ARG  64          1HB       ARG  64  -8.756   6.076   5.726
  443   1HG   ARG  64          2HG       ARG  64 -10.744   7.155   6.686
  444   2HG   ARG  64          1HG       ARG  64  -9.725   8.043   7.820
  445   1HD   ARG  64          2HD       ARG  64 -10.225   9.515   5.942
  446   2HD   ARG  64          1HD       ARG  64  -8.521   9.032   5.812
  447    HE   ARG  64           HE       ARG  64 -10.595   7.332   4.406
  448   1HH1  ARG  64          1HH1      ARG  64  -7.372   7.781   4.293
  449   2HH1  ARG  64          2HH1      ARG  64  -7.253   8.356   2.664
  450   1HH2  ARG  64          1HH2      ARG  64 -10.659   8.907   2.329
  451   2HH2  ARG  64          2HH2      ARG  64  -9.115   8.993   1.552
  452    QB   ARG  64           QB       ARG  64  -8.237   6.528   6.277
  453    QG   ARG  64           QG       ARG  64 -10.235   7.599   7.253
  454    QD   ARG  64           QD       ARG  64  -9.373   9.274   5.877
  455    QH1  ARG  64           QH1      ARG  64  -7.312   8.068   3.478
  456    QH2  ARG  64           QH2      ARG  64  -9.887   8.950   1.941
  457    H    LYS  65           H        LYS  65  -9.521   4.005   5.751
  458    HA   LYS  65           HA       LYS  65 -12.386   3.871   6.046
  459   1HB   LYS  65          2HB       LYS  65 -10.326   1.945   4.926
  460   2HB   LYS  65          1HB       LYS  65 -12.061   1.804   4.632
  461   1HG   LYS  65          2HG       LYS  65 -12.062   4.096   3.670
  462   2HG   LYS  65          1HG       LYS  65 -10.315   4.174   3.901
  463   1HD   LYS  65          2HD       LYS  65 -10.075   2.153   2.452
  464   2HD   LYS  65          1HD       LYS  65 -11.813   2.206   2.147
  465   1HE   LYS  65          2HE       LYS  65 -11.626   3.969   0.702
  466   2HE   LYS  65          1HE       LYS  65 -10.393   4.771   1.695
  467   1HZ   LYS  65          2HZ       LYS  65  -8.802   3.065   0.999
  468   2HZ   LYS  65          1HZ       LYS  65  -9.978   2.370  -0.010
  469   3HZ   LYS  65          3HZ       LYS  65  -9.400   3.932  -0.334
  470    QB   LYS  65           QB       LYS  65 -11.193   1.875   4.779
  471    QD   LYS  65           QD       LYS  65 -10.944   2.180   2.299
  472    QG   LYS  65           QG       LYS  65 -11.188   4.135   3.786
  473    QE   LYS  65           QE       LYS  65 -11.009   4.370   1.199
  474    QZ   LYS  65           QZ       LYS  65  -9.393   3.123   0.218
  475    H    ARG  66           H        ARG  66  -9.848   1.587   7.222
  476    HA   ARG  66           HA       ARG  66 -11.668  -0.228   8.559
  477   1HB   ARG  66          2HB       ARG  66  -8.816   0.664   9.079
  478   2HB   ARG  66          1HB       ARG  66  -9.563  -0.703   9.908
  479   1HG   ARG  66          2HG       ARG  66  -9.945  -1.841   7.789
  480   2HG   ARG  66          1HG       ARG  66  -9.345  -0.444   6.894
  481   1HD   ARG  66          2HD       ARG  66  -7.531  -2.047   7.010
  482   2HD   ARG  66          1HD       ARG  66  -7.136  -0.746   8.150
  483    HE   ARG  66           HE       ARG  66  -8.328  -2.257   9.948
  484   1HH1  ARG  66          1HH1      ARG  66  -9.055  -4.680   8.932
  485   2HH1  ARG  66          2HH1      ARG  66  -7.640  -5.664   8.775
  486   1HH2  ARG  66          1HH2      ARG  66  -5.439  -2.988   8.896
  487   2HH2  ARG  66          2HH2      ARG  66  -5.592  -4.707   8.756
  488    QB   ARG  66           QB       ARG  66  -9.189  -0.019   9.494
  489    QG   ARG  66           QG       ARG  66  -9.645  -1.143   7.342
  490    QD   ARG  66           QD       ARG  66  -7.333  -1.396   7.580
  491    QH1  ARG  66           QH1      ARG  66  -8.348  -5.172   8.853
  492    QH2  ARG  66           QH2      ARG  66  -5.516  -3.847   8.826
  493    H    GLN  67           H        GLN  67 -10.126   2.825   9.628
  494    HA   GLN  67           HA       GLN  67 -12.220   3.054  11.778
  495   1HB   GLN  67          2HB       GLN  67  -9.250   2.695  12.275
  496   2HB   GLN  67          1HB       GLN  67 -10.355   3.336  13.492
  497   1HG   GLN  67          2HG       GLN  67 -11.761   1.241  13.151
  498   2HG   GLN  67          1HG       GLN  67 -10.419   0.599  12.203
  499   1HE2  GLN  67          1HE2      GLN  67  -9.696  -1.054  13.640
  500   2HE2  GLN  67          2HE2      GLN  67  -9.067  -0.668  15.282
  501    QB   GLN  67           QB       GLN  67  -9.803   3.016  12.883
  502    QG   GLN  67           QG       GLN  67 -11.090   0.920  12.677
  503    QE   GLN  67           QE2      GLN  67  -9.382  -0.861  14.461
  504    H    ALA  68           H        ALA  68 -12.470   5.228  12.504
  505    HA   ALA  68           HA       ALA  68 -11.424   7.257  10.627
  506   1HB   ALA  68          1HB       ALA  68 -12.581   7.968  13.281
  507   2HB   ALA  68          2HB       ALA  68 -13.584   6.985  12.214
  508   3HB   ALA  68          3HB       ALA  68 -13.008   8.563  11.677
  509    MB   ALA  68           QB       ALA  68 -13.057   7.839  12.390
  510    H    ASP  69           H        ASP  69 -10.837   9.452  12.243
  511    HA   ASP  69           HA       ASP  69  -8.797   8.804  14.270
  512   1HB   ASP  69          2HB       ASP  69  -7.730   7.966  12.164
  513   2HB   ASP  69          1HB       ASP  69  -7.832   9.599  11.502
  514    QB   ASP  69           QB       ASP  69  -7.781   8.782  11.833

  No H/Q in entry =         514
  Start of MODEL   10
    1    H    THR  24           H        THR  24 -18.480  -4.618   5.076
    2    HA   THR  24           HA       THR  24 -16.651  -6.222   5.364
    3    HB   THR  24           HB       THR  24 -17.782  -6.784   3.322
    4    HG1  THR  24          1HG       THR  24 -16.090  -8.001   3.080
    5   1HG2  THR  24          3HG2      THR  24 -16.189  -4.503   2.133
    6   2HG2  THR  24          2HG2      THR  24 -17.086  -5.668   1.160
    7   3HG2  THR  24          1HG2      THR  24 -17.941  -4.618   2.289
    8    MG   THR  24           QG2      THR  24 -17.072  -4.930   1.861
    9    HA   PRO  25           HA       PRO  25 -13.198  -3.127   5.119
   10   1HB   PRO  25          2HB       PRO  25 -12.251  -3.662   7.640
   11   2HB   PRO  25          1HB       PRO  25 -13.504  -2.451   7.305
   12   1HG   PRO  25          2HG       PRO  25 -13.788  -5.237   8.317
   13   2HG   PRO  25          1HG       PRO  25 -14.661  -3.771   8.790
   14   1HD   PRO  25          2HD       PRO  25 -15.723  -5.651   7.149
   15   2HD   PRO  25          1HD       PRO  25 -16.140  -3.927   7.040
   16    QB   PRO  25           QB       PRO  25 -12.877  -3.057   7.472
   17    QG   PRO  25           QG       PRO  25 -14.224  -4.504   8.553
   18    QD   PRO  25           QD       PRO  25 -15.932  -4.789   7.094
   19    H    VAL  26           H        VAL  26 -13.502  -6.511   6.073
   20    HA   VAL  26           HA       VAL  26 -10.689  -7.219   6.079
   21    HB   VAL  26           HB       VAL  26 -12.760  -8.517   6.805
   22   1HG1  VAL  26          3HG1      VAL  26 -13.975  -8.127   4.635
   23   2HG1  VAL  26          2HG1      VAL  26 -12.843  -9.236   3.861
   24   3HG1  VAL  26          1HG1      VAL  26 -13.925  -9.821   5.124
   25   1HG2  VAL  26          2HG2      VAL  26 -10.431  -9.480   6.552
   26   2HG2  VAL  26          1HG2      VAL  26 -11.731 -10.657   6.361
   27   3HG2  VAL  26          3HG2      VAL  26 -10.900 -10.020   4.940
   28    MG1  VAL  26           QG1      VAL  26 -13.581  -9.061   4.540
   29    MG2  VAL  26           QG2      VAL  26 -11.021 -10.052   5.951
   30    QG   VAL  26           QQG      VAL  26 -12.301  -9.557   5.246
   31    H    LEU  27           H        LEU  27 -13.049  -6.812   3.433
   32    HA   LEU  27           HA       LEU  27 -11.531  -8.069   1.322
   33   1HB   LEU  27          2HB       LEU  27 -13.914  -6.895   1.561
   34   2HB   LEU  27          1HB       LEU  27 -13.044  -5.524   0.875
   35    HG   LEU  27           HG       LEU  27 -13.989  -6.782  -0.958
   36   1HD1  LEU  27          3HD1      LEU  27 -11.550  -5.956  -1.047
   37   2HD1  LEU  27          2HD1      LEU  27 -11.096  -7.646  -0.823
   38   3HD1  LEU  27          1HD1      LEU  27 -12.027  -7.163  -2.242
   39   1HD2  LEU  27          1HD2      LEU  27 -13.439  -8.996   0.764
   40   2HD2  LEU  27          3HD2      LEU  27 -14.324  -9.001  -0.762
   41   3HD2  LEU  27          2HD2      LEU  27 -12.580  -9.267  -0.753
   42    MD1  LEU  27           QD1      LEU  27 -11.558  -6.922  -1.370
   43    MD2  LEU  27           QD2      LEU  27 -13.448  -9.088  -0.250
   44    QB   LEU  27           QB       LEU  27 -13.479  -6.209   1.218
   45    QD   LEU  27           QQD      LEU  27 -12.503  -8.005  -0.810
   46    H    VAL  28           H        VAL  28 -11.322  -4.802   2.749
   47    HA   VAL  28           HA       VAL  28  -9.543  -3.644   0.779
   48    HB   VAL  28           HB       VAL  28  -9.817  -3.242   3.774
   49   1HG1  VAL  28          1HG1      VAL  28  -7.755  -2.237   2.664
   50   2HG1  VAL  28          3HG1      VAL  28  -8.860  -1.253   1.704
   51   3HG1  VAL  28          2HG1      VAL  28  -8.827  -1.084   3.458
   52   1HG2  VAL  28          2HG2      VAL  28 -11.615  -2.811   1.605
   53   2HG2  VAL  28          1HG2      VAL  28 -11.820  -2.334   3.291
   54   3HG2  VAL  28          3HG2      VAL  28 -11.058  -1.228   2.149
   55    MG1  VAL  28           QG1      VAL  28  -8.481  -1.525   2.609
   56    MG2  VAL  28           QG2      VAL  28 -11.498  -2.124   2.348
   57    QG   VAL  28           QQG      VAL  28  -9.989  -1.824   2.478
   58    H    ILE  29           H        ILE  29  -8.844  -5.470   3.805
   59    HA   ILE  29           HA       ILE  29  -5.940  -5.238   3.578
   60    HB   ILE  29           HB       ILE  29  -7.749  -7.335   4.821
   61   1HG1  ILE  29          2HG1      ILE  29  -6.427  -4.897   6.050
   62   2HG1  ILE  29          1HG1      ILE  29  -8.115  -4.954   5.543
   63   1HG2  ILE  29          1HG2      ILE  29  -4.892  -7.196   4.578
   64   2HG2  ILE  29          3HG2      ILE  29  -5.331  -6.948   6.267
   65   3HG2  ILE  29          2HG2      ILE  29  -5.864  -8.401   5.423
   66   1HD1  ILE  29          2HD1      ILE  29  -8.019  -7.196   7.054
   67   2HD1  ILE  29          1HD1      ILE  29  -6.799  -6.227   7.880
   68   3HD1  ILE  29          3HD1      ILE  29  -8.444  -5.615   7.710
   69    MG   ILE  29           QG2      ILE  29  -5.362  -7.515   5.423
   70    MD   ILE  29           QD1      ILE  29  -7.754  -6.346   7.548
   71    QG   ILE  29           QG1      ILE  29  -7.271  -4.926   5.796
   72    H    LEU  30           H        LEU  30  -8.307  -7.618   2.332
   73    HA   LEU  30           HA       LEU  30  -6.357  -9.561   1.393
   74   1HB   LEU  30          2HB       LEU  30  -8.857  -9.771   1.680
   75   2HB   LEU  30          1HB       LEU  30  -9.049  -8.811   0.213
   76    HG   LEU  30           HG       LEU  30  -7.274 -11.230   0.159
   77   1HD1  LEU  30          1HD1      LEU  30 -10.287 -11.171   0.203
   78   2HD1  LEU  30          3HD1      LEU  30  -9.425 -12.425  -0.689
   79   3HD1  LEU  30          2HD1      LEU  30  -9.193 -12.263   1.053
   80   1HD2  LEU  30          1HD2      LEU  30  -8.628  -9.393  -1.716
   81   2HD2  LEU  30          3HD2      LEU  30  -7.146 -10.325  -1.928
   82   3HD2  LEU  30          2HD2      LEU  30  -8.714 -11.095  -2.170
   83    MD1  LEU  30           QD1      LEU  30  -9.635 -11.953   0.189
   84    MD2  LEU  30           QD2      LEU  30  -8.163 -10.271  -1.938
   85    QB   LEU  30           QB       LEU  30  -8.953  -9.291   0.947
   86    QD   LEU  30           QQD      LEU  30  -8.899 -11.112  -0.875
   87    H    LEU  31           H        LEU  31  -7.897  -6.741  -0.232
   88    HA   LEU  31           HA       LEU  31  -6.649  -7.176  -2.821
   89   1HB   LEU  31          2HB       LEU  31  -8.563  -5.662  -2.177
   90   2HB   LEU  31          1HB       LEU  31  -7.381  -4.568  -1.458
   91    HG   LEU  31           HG       LEU  31  -6.990  -5.485  -4.288
   92   1HD1  LEU  31          2HD1      LEU  31  -9.391  -4.593  -3.870
   93   2HD1  LEU  31          1HD1      LEU  31  -8.612  -3.032  -3.622
   94   3HD1  LEU  31          3HD1      LEU  31  -8.453  -3.859  -5.172
   95   1HD2  LEU  31          3HD2      LEU  31  -5.869  -3.549  -2.442
   96   2HD2  LEU  31          2HD2      LEU  31  -5.260  -4.063  -4.015
   97   3HD2  LEU  31          1HD2      LEU  31  -6.432  -2.749  -3.909
   98    MD1  LEU  31           QD1      LEU  31  -8.819  -3.828  -4.221
   99    MD2  LEU  31           QD2      LEU  31  -5.854  -3.453  -3.455
  100    QB   LEU  31           QB       LEU  31  -7.972  -5.115  -1.818
  101    QD   LEU  31           QQD      LEU  31  -7.336  -3.641  -3.838
  102    H    GLY  32           H        GLY  32  -5.601  -5.261   0.043
  103   1HA   GLY  32          1HA       GLY  32  -3.447  -4.366   0.498
  104   2HA   GLY  32          2HA       GLY  32  -3.186  -4.244  -1.243
  105    QA   GLY  32           QA       GLY  32  -3.316  -4.305  -0.372
  106    H    VAL  33           H        VAL  33  -3.909  -7.204   0.611
  107    HA   VAL  33           HA       VAL  33  -1.210  -8.149   0.961
  108    HB   VAL  33           HB       VAL  33  -3.861  -9.528   0.442
  109   1HG1  VAL  33          1HG1      VAL  33  -1.211 -10.667   1.377
  110   2HG1  VAL  33          3HG1      VAL  33  -2.753 -11.513   1.524
  111   3HG1  VAL  33          2HG1      VAL  33  -2.110 -11.122  -0.071
  112   1HG2  VAL  33          2HG2      VAL  33  -2.933  -8.025   2.597
  113   2HG2  VAL  33          1HG2      VAL  33  -4.271  -9.172   2.638
  114   3HG2  VAL  33          3HG2      VAL  33  -2.650  -9.693   3.097
  115    MG1  VAL  33           QG1      VAL  33  -2.025 -11.101   0.944
  116    MG2  VAL  33           QG2      VAL  33  -3.285  -8.963   2.778
  117    QG   VAL  33           QQG      VAL  33  -2.655 -10.032   1.861
  118    H    VAL  34           H        VAL  34  -3.492  -8.638  -1.777
  119    HA   VAL  34           HA       VAL  34  -1.767 -10.316  -3.373
  120    HB   VAL  34           HB       VAL  34  -3.868  -8.237  -4.041
  121   1HG1  VAL  34          3HG1      VAL  34  -2.486 -10.298  -5.770
  122   2HG1  VAL  34          2HG1      VAL  34  -4.059  -9.619  -6.186
  123   3HG1  VAL  34          1HG1      VAL  34  -2.649  -8.567  -6.068
  124   1HG2  VAL  34          3HG2      VAL  34  -3.927 -10.874  -2.908
  125   2HG2  VAL  34          2HG2      VAL  34  -5.284  -9.813  -3.278
  126   3HG2  VAL  34          1HG2      VAL  34  -4.680 -10.929  -4.501
  127    MG1  VAL  34           QG1      VAL  34  -3.065  -9.494  -6.008
  128    MG2  VAL  34           QG2      VAL  34  -4.630 -10.539  -3.562
  129    QG   VAL  34           QQG      VAL  34  -3.847 -10.017  -4.785
  130    H    GLY  35           H        GLY  35  -2.007  -6.733  -3.164
  131   1HA   GLY  35          1HA       GLY  35  -0.475  -5.116  -3.983
  132   2HA   GLY  35          2HA       GLY  35  -0.192  -6.193  -5.353
  133    QA   GLY  35           QA       GLY  35  -0.334  -5.654  -4.668
  134    H    LEU  36           H        LEU  36   0.423  -6.819  -1.873
  135    HA   LEU  36           HA       LEU  36   3.261  -6.260  -1.914
  136   1HB   LEU  36          2HB       LEU  36   1.342  -7.948  -0.357
  137   2HB   LEU  36          1HB       LEU  36   3.067  -8.179  -0.069
  138    HG   LEU  36           HG       LEU  36   3.149  -5.584   0.119
  139   1HD1  LEU  36          3HD1      LEU  36   0.837  -5.256  -0.735
  140   2HD1  LEU  36          2HD1      LEU  36   0.212  -6.111   0.675
  141   3HD1  LEU  36          1HD1      LEU  36   1.048  -4.571   0.877
  142   1HD2  LEU  36          3HD2      LEU  36   2.216  -7.631   2.064
  143   2HD2  LEU  36          2HD2      LEU  36   3.608  -6.552   2.149
  144   3HD2  LEU  36          1HD2      LEU  36   1.999  -5.948   2.545
  145    MD1  LEU  36           QD1      LEU  36   0.699  -5.312   0.272
  146    MD2  LEU  36           QD2      LEU  36   2.608  -6.710   2.253
  147    QB   LEU  36           QB       LEU  36   2.205  -8.064  -0.213
  148    QD   LEU  36           QQD      LEU  36   1.653  -6.011   1.263
  149    H    SER  37           H        SER  37   1.431  -9.223  -2.768
  150    HA   SER  37           HA       SER  37   3.689 -10.995  -3.068
  151   1HB   SER  37          2HB       SER  37   1.215 -11.484  -3.092
  152   2HB   SER  37          1HB       SER  37   1.155 -10.838  -4.729
  153    HG   SER  37           HG       SER  37   1.766 -13.278  -3.992
  154    QB   SER  37           QB       SER  37   1.185 -11.161  -3.910
  155    H    ALA  38           H        ALA  38   2.075  -8.917  -5.552
  156    HA   ALA  38           HA       ALA  38   3.812  -9.562  -7.746
  157   1HB   ALA  38          2HB       ALA  38   1.686  -8.073  -7.480
  158   2HB   ALA  38          3HB       ALA  38   2.879  -7.613  -8.695
  159   3HB   ALA  38          1HB       ALA  38   2.831  -6.775  -7.144
  160    MB   ALA  38           QB       ALA  38   2.465  -7.487  -7.773
  161    H    LEU  39           H        LEU  39   4.309  -7.351  -4.989
  162    HA   LEU  39           HA       LEU  39   7.048  -6.670  -6.138
  163   1HB   LEU  39          2HB       LEU  39   5.390  -5.432  -3.918
  164   2HB   LEU  39          1HB       LEU  39   6.885  -4.771  -4.580
  165    HG   LEU  39           HG       LEU  39   4.282  -5.185  -6.076
  166   1HD1  LEU  39          3HD1      LEU  39   5.362  -3.012  -4.536
  167   2HD1  LEU  39          2HD1      LEU  39   5.292  -2.533  -6.231
  168   3HD1  LEU  39          1HD1      LEU  39   3.832  -3.084  -5.410
  169   1HD2  LEU  39          1HD2      LEU  39   7.041  -4.323  -6.976
  170   2HD2  LEU  39          3HD2      LEU  39   6.059  -5.640  -7.617
  171   3HD2  LEU  39          2HD2      LEU  39   5.587  -3.965  -7.907
  172    MD1  LEU  39           QD1      LEU  39   4.828  -2.877  -5.393
  173    MD2  LEU  39           QD2      LEU  39   6.229  -4.643  -7.500
  174    QB   LEU  39           QB       LEU  39   6.137  -5.102  -4.249
  175    QD   LEU  39           QQD      LEU  39   5.529  -3.760  -6.446
  176    H    THR  40           H        THR  40   8.367  -8.401  -5.476
  177    HA   THR  40           HA       THR  40   8.538  -8.725  -2.445
  178    HB   THR  40           HB       THR  40   8.900 -11.168  -2.950
  179    HG1  THR  40          1HG       THR  40   7.713 -10.998  -5.390
  180   1HG2  THR  40          1HG2      THR  40   6.328  -9.815  -3.778
  181   2HG2  THR  40          3HG2      THR  40   6.474 -11.566  -3.633
  182   3HG2  THR  40          2HG2      THR  40   6.718 -10.540  -2.219
  183    MG   THR  40           QG2      THR  40   6.507 -10.640  -3.210
  184    H    GLY  41           H        GLY  41  10.175  -7.043  -4.253
  185   1HA   GLY  41          1HA       GLY  41  12.502  -7.822  -5.327
  186   2HA   GLY  41          2HA       GLY  41  12.806  -8.444  -3.703
  187    QA   GLY  41           QA       GLY  41  12.654  -8.133  -4.515
  188    H    TYR  42           H        TYR  42  14.533  -7.031  -3.221
  189    HA   TYR  42           HA       TYR  42  13.771  -4.433  -2.135
  190   1HB   TYR  42          2HB       TYR  42  16.437  -5.610  -2.987
  191   2HB   TYR  42          1HB       TYR  42  16.247  -4.206  -1.934
  192    HD1  TYR  42          1HD       TYR  42  16.289  -7.811  -2.117
  193    HD2  TYR  42          2HD       TYR  42  14.945  -4.484   0.246
  194    HE1  TYR  42          1HE       TYR  42  16.017  -9.310  -0.160
  195    HE2  TYR  42          2HE       TYR  42  14.674  -5.983   2.202
  196    HH   TYR  42           HH       TYR  42  14.950  -9.451   1.912
  197    QB   TYR  42           QB       TYR  42  16.342  -4.908  -2.460
  198    QD   TYR  42           QD       TYR  42  15.617  -6.147  -0.936
  199    QE   TYR  42           QE       TYR  42  15.346  -7.647   1.021
  200    QR   TYR  42           QR       TYR  42  15.481  -6.897   0.043
  201    H    LEU  43           H        LEU  43  15.071  -2.367  -2.841
  202    HA   LEU  43           HA       LEU  43  15.710  -2.066  -5.692
  203   1HB   LEU  43          2HB       LEU  43  13.617  -0.761  -6.251
  204   2HB   LEU  43          1HB       LEU  43  13.340  -2.482  -5.988
  205    HG   LEU  43           HG       LEU  43  13.176  -1.133  -3.462
  206   1HD1  LEU  43          1HD1      LEU  43  12.659   0.881  -4.806
  207   2HD1  LEU  43          3HD1      LEU  43  11.379  -0.006  -5.634
  208   3HD1  LEU  43          2HD1      LEU  43  11.245   0.331  -3.908
  209   1HD2  LEU  43          3HD2      LEU  43  11.524  -2.856  -5.235
  210   2HD2  LEU  43          2HD2      LEU  43  11.918  -3.051  -3.526
  211   3HD2  LEU  43          1HD2      LEU  43  10.647  -1.929  -4.016
  212    MD1  LEU  43           QD1      LEU  43  11.761   0.402  -4.783
  213    MD2  LEU  43           QD2      LEU  43  11.363  -2.612  -4.259
  214    QB   LEU  43           QB       LEU  43  13.478  -1.621  -6.120
  215    QD   LEU  43           QQD      LEU  43  11.562  -1.105  -4.521
  216    H    ASP  44           H        ASP  44  16.974  -0.239  -5.822
  217    HA   ASP  44           HA       ASP  44  16.998   1.600  -3.455
  218   1HB   ASP  44          2HB       ASP  44  19.014   0.731  -4.659
  219   2HB   ASP  44          1HB       ASP  44  18.510   1.637  -6.086
  220    QB   ASP  44           QB       ASP  44  18.762   1.184  -5.373
  221    H    TYR  45           H        TYR  45  16.140   3.663  -3.369
  222    HA   TYR  45           HA       TYR  45  14.116   4.440  -5.302
  223   1HB   TYR  45          2HB       TYR  45  14.001   6.395  -3.947
  224   2HB   TYR  45          1HB       TYR  45  14.566   5.131  -2.854
  225    HD1  TYR  45          1HD       TYR  45  16.927   5.025  -2.155
  226    HD2  TYR  45          2HD       TYR  45  15.470   8.186  -4.673
  227    HE1  TYR  45          1HE       TYR  45  18.982   6.336  -1.698
  228    HE2  TYR  45          2HE       TYR  45  17.525   9.497  -4.216
  229    HH   TYR  45           HH       TYR  45  19.335   9.350  -1.968
  230    QB   TYR  45           QB       TYR  45  14.283   5.763  -3.401
  231    QD   TYR  45           QD       TYR  45  16.198   6.606  -3.414
  232    QE   TYR  45           QE       TYR  45  18.254   7.917  -2.957
  233    QR   TYR  45           QR       TYR  45  17.226   7.261  -3.185
  234    H    VAL  46           H        VAL  46  14.166   5.715  -7.149
  235    HA   VAL  46           HA       VAL  46  16.955   6.405  -8.136
  236    HB   VAL  46           HB       VAL  46  15.835   6.441 -10.312
  237   1HG1  VAL  46          2HG1      VAL  46  16.438   4.240  -9.243
  238   2HG1  VAL  46          1HG1      VAL  46  14.772   4.117  -8.682
  239   3HG1  VAL  46          3HG1      VAL  46  15.121   4.129 -10.410
  240   1HG2  VAL  46          3HG2      VAL  46  13.520   6.915  -8.631
  241   2HG2  VAL  46          2HG2      VAL  46  13.687   7.134 -10.372
  242   3HG2  VAL  46          1HG2      VAL  46  13.224   5.561  -9.723
  243    MG1  VAL  46           QG1      VAL  46  15.444   4.162  -9.445
  244    MG2  VAL  46           QG2      VAL  46  13.477   6.537  -9.575
  245    QG   VAL  46           QQG      VAL  46  14.460   5.349  -9.510
  246    H    LEU  47           H        LEU  47  15.409   8.247 -10.103
  247    HA   LEU  47           HA       LEU  47  16.001  10.747  -8.715
  248   1HB   LEU  47          2HB       LEU  47  15.944  10.325 -11.177
  249   2HB   LEU  47          1HB       LEU  47  14.190  10.165 -11.082
  250    HG   LEU  47           HG       LEU  47  14.160  12.494 -10.049
  251   1HD1  LEU  47          2HD1      LEU  47  17.054  12.133 -10.635
  252   2HD1  LEU  47          1HD1      LEU  47  16.366  13.710 -11.020
  253   3HD1  LEU  47          3HD1      LEU  47  16.272  13.086  -9.374
  254   1HD2  LEU  47          2HD2      LEU  47  13.713  11.864 -12.506
  255   2HD2  LEU  47          1HD2      LEU  47  14.125  13.548 -12.183
  256   3HD2  LEU  47          3HD2      LEU  47  15.345  12.451 -12.831
  257    MD1  LEU  47           QD1      LEU  47  16.564  12.976 -10.343
  258    MD2  LEU  47           QD2      LEU  47  14.394  12.621 -12.507
  259    QB   LEU  47           QB       LEU  47  15.067  10.245 -11.129
  260    QD   LEU  47           QQD      LEU  47  15.479  12.799 -11.425
  261    H    LEU  48           H        LEU  48  13.005   8.848  -9.162
  262    HA   LEU  48           HA       LEU  48  11.723  10.657  -7.076
  263   1HB   LEU  48          2HB       LEU  48  11.261  11.041  -9.682
  264   2HB   LEU  48          1HB       LEU  48  10.131   9.712  -9.425
  265    HG   LEU  48           HG       LEU  48   9.849  11.524  -7.239
  266   1HD1  LEU  48          2HD1      LEU  48  10.273  12.788  -9.898
  267   2HD1  LEU  48          1HD1      LEU  48   8.895  13.370  -8.963
  268   3HD1  LEU  48          3HD1      LEU  48  10.521  13.453  -8.284
  269   1HD2  LEU  48          3HD2      LEU  48   8.149   9.970  -8.237
  270   2HD2  LEU  48          2HD2      LEU  48   7.547  11.615  -8.032
  271   3HD2  LEU  48          1HD2      LEU  48   8.039  11.049  -9.628
  272    MD1  LEU  48           QD1      LEU  48   9.896  13.204  -9.048
  273    MD2  LEU  48           QD2      LEU  48   7.912  10.878  -8.632
  274    QB   LEU  48           QB       LEU  48  10.696  10.376  -9.554
  275    QD   LEU  48           QQD      LEU  48   8.904  12.041  -8.840
  276    HA   PRO  49           HA       PRO  49  10.992   6.384  -5.817
  277   1HB   PRO  49          2HB       PRO  49  10.313   7.008  -3.239
  278   2HB   PRO  49          1HB       PRO  49  11.996   6.904  -3.794
  279   1HG   PRO  49          2HG       PRO  49  10.286   9.311  -3.384
  280   2HG   PRO  49          1HG       PRO  49  11.997   9.065  -2.998
  281   1HD   PRO  49          2HD       PRO  49  11.161  10.430  -5.190
  282   2HD   PRO  49          1HD       PRO  49  12.684   9.515  -5.142
  283    QB   PRO  49           QB       PRO  49  11.154   6.956  -3.517
  284    QG   PRO  49           QG       PRO  49  11.141   9.188  -3.191
  285    QD   PRO  49           QD       PRO  49  11.922   9.973  -5.166
  286    H    ALA  50           H        ALA  50   9.083   7.205  -7.466
  287    HA   ALA  50           HA       ALA  50   6.550   8.013  -6.292
  288   1HB   ALA  50          1HB       ALA  50   7.070   6.217  -8.682
  289   2HB   ALA  50          3HB       ALA  50   5.678   7.272  -8.434
  290   3HB   ALA  50          2HB       ALA  50   7.274   7.970  -8.711
  291    MB   ALA  50           QB       ALA  50   6.674   7.153  -8.609
  292    H    LEU  51           H        LEU  51   8.179   4.869  -6.549
  293    HA   LEU  51           HA       LEU  51   5.828   3.217  -6.004
  294   1HB   LEU  51          2HB       LEU  51   8.788   2.842  -5.429
  295   2HB   LEU  51          1HB       LEU  51   7.591   1.546  -5.453
  296    HG   LEU  51           HG       LEU  51   8.352   3.331  -7.785
  297   1HD1  LEU  51          2HD1      LEU  51   9.302   0.769  -6.799
  298   2HD1  LEU  51          1HD1      LEU  51   8.625   0.610  -8.421
  299   3HD1  LEU  51          3HD1      LEU  51   9.931   1.757  -8.118
  300   1HD2  LEU  51          3HD2      LEU  51   6.057   1.511  -7.272
  301   2HD2  LEU  51          2HD2      LEU  51   6.169   2.906  -8.348
  302   3HD2  LEU  51          1HD2      LEU  51   6.835   1.351  -8.847
  303    MD1  LEU  51           QD1      LEU  51   9.286   1.045  -7.779
  304    MD2  LEU  51           QD2      LEU  51   6.353   1.923  -8.155
  305    QB   LEU  51           QB       LEU  51   8.189   2.194  -5.441
  306    QD   LEU  51           QQD      LEU  51   7.820   1.484  -7.967
  307    H    ALA  52           H        ALA  52   8.450   4.431  -3.837
  308    HA   ALA  52           HA       ALA  52   7.391   3.392  -1.378
  309   1HB   ALA  52          1HB       ALA  52   9.180   5.533  -2.332
  310   2HB   ALA  52          3HB       ALA  52   8.506   5.823  -0.728
  311   3HB   ALA  52          2HB       ALA  52   9.430   4.354  -1.042
  312    MB   ALA  52           QB       ALA  52   9.039   5.237  -1.367
  313    H    ILE  53           H        ILE  53   6.668   6.495  -3.051
  314    HA   ILE  53           HA       ILE  53   4.836   7.484  -1.006
  315    HB   ILE  53           HB       ILE  53   5.004   7.913  -4.008
  316   1HG1  ILE  53          2HG1      ILE  53   6.166   9.513  -1.706
  317   2HG1  ILE  53          1HG1      ILE  53   7.088   8.383  -2.698
  318   1HG2  ILE  53          3HG2      ILE  53   2.853   8.677  -3.057
  319   2HG2  ILE  53          2HG2      ILE  53   3.726   9.612  -1.844
  320   3HG2  ILE  53          1HG2      ILE  53   3.854  10.043  -3.550
  321   1HD1  ILE  53          3HD1      ILE  53   6.107   9.802  -4.694
  322   2HD1  ILE  53          2HD1      ILE  53   5.909  11.039  -3.451
  323   3HD1  ILE  53          1HD1      ILE  53   7.511  10.389  -3.803
  324    MG   ILE  53           QG2      ILE  53   3.478   9.444  -2.817
  325    MD   ILE  53           QD1      ILE  53   6.509  10.410  -3.982
  326    QG   ILE  53           QG1      ILE  53   6.627   8.948  -2.202
  327    H    PHE  54           H        PHE  54   4.292   5.610  -4.034
  328    HA   PHE  54           HA       PHE  54   1.431   5.497  -3.935
  329   1HB   PHE  54          2HB       PHE  54   2.978   4.681  -5.717
  330   2HB   PHE  54          1HB       PHE  54   3.407   3.318  -4.684
  331    HD1  PHE  54          1HD       PHE  54   1.907   1.459  -4.361
  332    HD2  PHE  54          2HD       PHE  54   0.667   4.908  -6.602
  333    HE1  PHE  54          1HE       PHE  54  -0.085   0.221  -5.167
  334    HE2  PHE  54          2HE       PHE  54  -1.325   3.670  -7.408
  335    HZ   PHE  54           HZ       PHE  54  -1.701   1.325  -6.689
  336    QB   PHE  54           QB       PHE  54   3.193   4.000  -5.201
  337    QD   PHE  54           QD       PHE  54   1.287   3.183  -5.482
  338    QE   PHE  54           QE       PHE  54  -0.705   1.945  -6.287
  339    QR   PHE  54           QR       PHE  54  -0.107   2.316  -6.046
  340    H    ILE  55           H        ILE  55   3.831   3.341  -2.321
  341    HA   ILE  55           HA       ILE  55   1.839   1.607  -1.084
  342    HB   ILE  55           HB       ILE  55   4.631   2.440  -0.232
  343   1HG1  ILE  55          2HG1      ILE  55   4.614   1.556  -2.500
  344   2HG1  ILE  55          1HG1      ILE  55   5.268   0.323  -1.422
  345   1HG2  ILE  55          2HG2      ILE  55   2.688   0.421   0.763
  346   2HG2  ILE  55          1HG2      ILE  55   4.360  -0.115   0.599
  347   3HG2  ILE  55          3HG2      ILE  55   3.974   1.266   1.625
  348   1HD1  ILE  55          2HD1      ILE  55   2.700  -0.386  -1.268
  349   2HD1  ILE  55          1HD1      ILE  55   2.642   0.395  -2.849
  350   3HD1  ILE  55          3HD1      ILE  55   3.734  -0.964  -2.575
  351    MG   ILE  55           QG2      ILE  55   3.674   0.524   0.996
  352    MD   ILE  55           QD1      ILE  55   3.025  -0.318  -2.231
  353    QG   ILE  55           QG1      ILE  55   4.941   0.939  -1.961
  354    H    GLY  56           H        GLY  56   3.534   4.555   0.103
  355   1HA   GLY  56          1HA       GLY  56   2.845   6.032   1.831
  356   2HA   GLY  56          2HA       GLY  56   2.424   4.581   2.741
  357    QA   GLY  56           QA       GLY  56   2.634   5.307   2.286
  358    H    LEU  57           H        LEU  57   1.073   6.108  -0.242
  359    HA   LEU  57           HA       LEU  57  -1.413   6.941   1.032
  360   1HB   LEU  57          2HB       LEU  57  -0.198   7.347  -1.320
  361   2HB   LEU  57          1HB       LEU  57  -1.307   6.072  -1.826
  362    HG   LEU  57           HG       LEU  57  -2.489   8.108  -2.184
  363   1HD1  LEU  57          2HD1      LEU  57  -3.674   6.257  -0.882
  364   2HD1  LEU  57          1HD1      LEU  57  -3.388   7.221   0.566
  365   3HD1  LEU  57          3HD1      LEU  57  -4.381   7.866  -0.740
  366   1HD2  LEU  57          3HD2      LEU  57  -0.992   8.929   0.198
  367   2HD2  LEU  57          2HD2      LEU  57  -1.658   9.919  -1.101
  368   3HD2  LEU  57          1HD2      LEU  57  -2.681   9.435   0.251
  369    MD1  LEU  57           QD1      LEU  57  -3.814   7.115  -0.352
  370    MD2  LEU  57           QD2      LEU  57  -1.777   9.428  -0.217
  371    QB   LEU  57           QB       LEU  57  -0.752   6.710  -1.573
  372    QD   LEU  57           QQD      LEU  57  -2.796   8.271  -0.285
  373    H    THR  58           H        THR  58  -0.421   3.911  -0.602
  374    HA   THR  58           HA       THR  58  -3.062   2.687  -0.640
  375    HB   THR  58           HB       THR  58  -0.282   1.496  -0.380
  376    HG1  THR  58          1HG       THR  58  -1.865   2.209  -2.620
  377   1HG2  THR  58          2HG2      THR  58  -2.980   0.362  -1.027
  378   2HG2  THR  58          1HG2      THR  58  -1.550  -0.330  -1.792
  379   3HG2  THR  58          3HG2      THR  58  -1.693  -0.321  -0.034
  380    MG   THR  58           QG2      THR  58  -2.074  -0.096  -0.951
  381    H    ILE  59           H        ILE  59  -0.341   2.326   1.706
  382    HA   ILE  59           HA       ILE  59  -1.893   0.697   3.574
  383    HB   ILE  59           HB       ILE  59   0.501   2.522   3.952
  384   1HG1  ILE  59          2HG1      ILE  59   0.883   0.893   2.182
  385   2HG1  ILE  59          1HG1      ILE  59   1.762   0.373   3.621
  386   1HG2  ILE  59          2HG2      ILE  59  -0.715   0.314   5.617
  387   2HG2  ILE  59          1HG2      ILE  59   0.985   0.756   5.772
  388   3HG2  ILE  59          3HG2      ILE  59  -0.271   1.944   6.121
  389   1HD1  ILE  59          2HD1      ILE  59  -0.396  -0.975   4.173
  390   2HD1  ILE  59          1HD1      ILE  59  -0.789  -0.742   2.470
  391   3HD1  ILE  59          3HD1      ILE  59   0.684  -1.598   2.926
  392    MG   ILE  59           QG2      ILE  59   0.000   1.005   5.837
  393    MD   ILE  59           QD1      ILE  59  -0.167  -1.105   3.189
  394    QG   ILE  59           QG1      ILE  59   1.323   0.633   2.902
  395    H    TYR  60           H        TYR  60  -1.227   4.244   3.423
  396    HA   TYR  60           HA       TYR  60  -2.534   4.916   5.919
  397   1HB   TYR  60          2HB       TYR  60  -1.132   6.392   4.461
  398   2HB   TYR  60          1HB       TYR  60  -2.447   6.438   3.289
  399    HD1  TYR  60          1HD       TYR  60  -1.411   7.419   6.704
  400    HD2  TYR  60          2HD       TYR  60  -4.414   7.785   3.655
  401    HE1  TYR  60          1HE       TYR  60  -2.449   9.293   7.951
  402    HE2  TYR  60          2HE       TYR  60  -5.454   9.660   4.904
  403    HH   TYR  60           HH       TYR  60  -5.545  10.587   7.087
  404    QB   TYR  60           QB       TYR  60  -1.790   6.415   3.875
  405    QD   TYR  60           QD       TYR  60  -2.913   7.602   5.179
  406    QE   TYR  60           QE       TYR  60  -3.952   9.477   6.428
  407    QR   TYR  60           QR       TYR  60  -3.432   8.539   5.804
  408    H    ALA  61           H        ALA  61  -3.851   4.822   2.563
  409    HA   ALA  61           HA       ALA  61  -6.578   5.468   3.276
  410   1HB   ALA  61          1HB       ALA  61  -5.507   3.653   1.094
  411   2HB   ALA  61          3HB       ALA  61  -7.045   4.518   1.067
  412   3HB   ALA  61          2HB       ALA  61  -5.528   5.415   1.016
  413    MB   ALA  61           QB       ALA  61  -6.026   4.529   1.059
  414    H    ILE  62           H        ILE  62  -4.886   2.301   3.107
  415    HA   ILE  62           HA       ILE  62  -7.267   0.691   3.574
  416    HB   ILE  62           HB       ILE  62  -4.311   0.348   4.123
  417   1HG1  ILE  62          2HG1      ILE  62  -6.034  -0.970   2.018
  418   2HG1  ILE  62          1HG1      ILE  62  -5.294   0.609   1.750
  419   1HG2  ILE  62          1HG2      ILE  62  -6.608  -1.603   4.402
  420   2HG2  ILE  62          3HG2      ILE  62  -4.943  -2.134   4.160
  421   3HG2  ILE  62          2HG2      ILE  62  -5.371  -1.205   5.597
  422   1HD1  ILE  62          1HD1      ILE  62  -3.242  -0.984   2.809
  423   2HD1  ILE  62          3HD1      ILE  62  -4.073  -2.019   1.648
  424   3HD1  ILE  62          2HD1      ILE  62  -3.415  -0.466   1.132
  425    MG   ILE  62           QG2      ILE  62  -5.641  -1.648   4.720
  426    MD   ILE  62           QD1      ILE  62  -3.577  -1.157   1.863
  427    QG   ILE  62           QG1      ILE  62  -5.664  -0.180   1.884
  428    H    GLN  63           H        GLN  63  -4.801   2.001   5.866
  429    HA   GLN  63           HA       GLN  63  -6.017   0.844   8.243
  430   1HB   GLN  63          2HB       GLN  63  -4.391   3.359   7.762
  431   2HB   GLN  63          1HB       GLN  63  -4.683   2.656   9.353
  432   1HG   GLN  63          2HG       GLN  63  -3.599   0.570   8.657
  433   2HG   GLN  63          1HG       GLN  63  -3.345   1.225   7.039
  434   1HE2  GLN  63          1HE2      GLN  63  -1.115   0.353   8.582
  435   2HE2  GLN  63          2HE2      GLN  63  -0.173   1.813   9.060
  436    QB   GLN  63           QB       GLN  63  -4.537   3.008   8.558
  437    QG   GLN  63           QG       GLN  63  -3.472   0.897   7.848
  438    QE   GLN  63           QE2      GLN  63  -0.644   1.083   8.821
  439    H    ARG  64           H        ARG  64  -6.539   3.969   6.552
  440    HA   ARG  64           HA       ARG  64  -8.363   5.052   8.565
  441   1HB   ARG  64          2HB       ARG  64  -7.158   6.273   6.745
  442   2HB   ARG  64          1HB       ARG  64  -8.221   5.500   5.567
  443   1HG   ARG  64          2HG       ARG  64 -10.183   6.507   6.678
  444   2HG   ARG  64          1HG       ARG  64  -9.117   7.295   7.842
  445   1HD   ARG  64          2HD       ARG  64  -9.621   8.924   6.119
  446   2HD   ARG  64          1HD       ARG  64  -7.952   8.388   5.845
  447    HE   ARG  64           HE       ARG  64 -10.283   7.055   4.404
  448   1HH1  ARG  64          1HH1      ARG  64  -7.929   9.493   4.054
  449   2HH1  ARG  64          2HH1      ARG  64  -7.237   8.866   2.596
  450   1HH2  ARG  64          1HH2      ARG  64  -9.010   5.889   2.723
  451   2HH2  ARG  64          2HH2      ARG  64  -7.849   6.825   1.842
  452    QB   ARG  64           QB       ARG  64  -7.690   5.887   6.156
  453    QG   ARG  64           QG       ARG  64  -9.650   6.901   7.260
  454    QD   ARG  64           QD       ARG  64  -8.787   8.656   5.982
  455    QH1  ARG  64           QH1      ARG  64  -7.583   9.180   3.325
  456    QH2  ARG  64           QH2      ARG  64  -8.429   6.357   2.283
  457    H    LYS  65           H        LYS  65  -9.003   3.445   5.393
  458    HA   LYS  65           HA       LYS  65 -11.868   3.322   5.668
  459   1HB   LYS  65          2HB       LYS  65  -9.847   1.451   4.393
  460   2HB   LYS  65          1HB       LYS  65 -11.579   1.410   4.061
  461   1HG   LYS  65          2HG       LYS  65 -11.547   3.618   3.133
  462   2HG   LYS  65          1HG       LYS  65  -9.908   3.907   3.714
  463   1HD   LYS  65          2HD       LYS  65  -9.804   3.405   1.340
  464   2HD   LYS  65          1HD       LYS  65  -9.113   2.049   2.230
  465   1HE   LYS  65          2HE       LYS  65 -11.198   0.786   2.020
  466   2HE   LYS  65          1HE       LYS  65 -11.982   2.168   1.227
  467   1HZ   LYS  65          3HZ       LYS  65  -9.473   0.934   0.234
  468   2HZ   LYS  65          2HZ       LYS  65 -11.011   0.478  -0.328
  469   3HZ   LYS  65          1HZ       LYS  65 -10.454   2.066  -0.562
  470    QB   LYS  65           QB       LYS  65 -10.713   1.430   4.227
  471    QD   LYS  65           QD       LYS  65  -9.459   2.727   1.785
  472    QG   LYS  65           QG       LYS  65 -10.728   3.763   3.423
  473    QE   LYS  65           QE       LYS  65 -11.590   1.477   1.623
  474    QZ   LYS  65           QZ       LYS  65 -10.313   1.159  -0.219
  475    H    ARG  66           H        ARG  66  -9.367   0.905   6.644
  476    HA   ARG  66           HA       ARG  66 -11.195  -1.022   7.776
  477   1HB   ARG  66          2HB       ARG  66  -8.368  -0.148   8.433
  478   2HB   ARG  66          1HB       ARG  66  -9.118  -1.568   9.163
  479   1HG   ARG  66          2HG       ARG  66  -9.427  -2.600   6.994
  480   2HG   ARG  66          1HG       ARG  66  -8.887  -1.135   6.172
  481   1HD   ARG  66          2HD       ARG  66  -7.023  -2.704   6.211
  482   2HD   ARG  66          1HD       ARG  66  -6.657  -1.408   7.366
  483    HE   ARG  66           HE       ARG  66  -8.146  -3.790   8.456
  484   1HH1  ARG  66          1HH1      ARG  66  -6.836  -2.128  10.425
  485   2HH1  ARG  66          2HH1      ARG  66  -5.280  -2.850  10.667
  486   1HH2  ARG  66          1HH2      ARG  66  -5.360  -4.648   7.702
  487   2HH2  ARG  66          2HH2      ARG  66  -4.444  -4.275   9.125
  488    QB   ARG  66           QB       ARG  66  -8.743  -0.858   8.798
  489    QG   ARG  66           QG       ARG  66  -9.157  -1.868   6.583
  490    QD   ARG  66           QD       ARG  66  -6.840  -2.056   6.789
  491    QH1  ARG  66           QH1      ARG  66  -6.058  -2.489  10.546
  492    QH2  ARG  66           QH2      ARG  66  -4.902  -4.462   8.414
  493    H    GLN  67           H        GLN  67  -9.676   1.901   9.203
  494    HA   GLN  67           HA       GLN  67 -11.883   2.009  11.230
  495   1HB   GLN  67          2HB       GLN  67 -10.382   1.763  13.137
  496   2HB   GLN  67          1HB       GLN  67 -10.192   0.355  12.091
  497   1HG   GLN  67          2HG       GLN  67  -8.244   1.547  10.997
  498   2HG   GLN  67          1HG       GLN  67  -8.369   2.767  12.265
  499   1HE2  GLN  67          1HE2      GLN  67  -6.498   2.356  13.512
  500   2HE2  GLN  67          2HE2      GLN  67  -6.183   0.753  14.270
  501    QB   GLN  67           QB       GLN  67 -10.287   1.059  12.614
  502    QG   GLN  67           QG       GLN  67  -8.307   2.157  11.631
  503    QE   GLN  67           QE2      GLN  67  -6.340   1.554  13.891
  504    H    ALA  68           H        ALA  68 -11.852   4.057  12.437
  505    HA   ALA  68           HA       ALA  68 -10.588   6.220  10.798
  506   1HB   ALA  68          3HB       ALA  68 -11.989   6.683  13.394
  507   2HB   ALA  68          1HB       ALA  68 -12.921   5.952  12.088
  508   3HB   ALA  68          2HB       ALA  68 -12.169   7.530  11.859
  509    MB   ALA  68           QB       ALA  68 -12.360   6.722  12.447
  510    H    ASP  69           H        ASP  69 -10.158   8.134  12.878
  511    HA   ASP  69           HA       ASP  69  -8.147   6.946  14.753
  512   1HB   ASP  69          2HB       ASP  69  -7.017   7.061  12.517
  513   2HB   ASP  69          1HB       ASP  69  -7.302   8.802  12.503
  514    QB   ASP  69           QB       ASP  69  -7.159   7.931  12.510

  No H/Q in entry =         514
  Start of MODEL   11
    1    H    THR  24           H        THR  24 -18.412  -4.143   4.740
    2    HA   THR  24           HA       THR  24 -16.899  -5.887   4.117
    3    HB   THR  24           HB       THR  24 -16.164  -4.414   1.628
    4    HG1  THR  24          1HG       THR  24 -18.794  -5.153   2.366
    5   1HG2  THR  24          3HG2      THR  24 -15.915  -6.971   2.369
    6   2HG2  THR  24          2HG2      THR  24 -17.550  -7.052   1.712
    7   3HG2  THR  24          1HG2      THR  24 -16.216  -6.516   0.691
    8    MG   THR  24           QG2      THR  24 -16.560  -6.846   1.590
    9    HA   PRO  25           HA       PRO  25 -13.320  -3.147   5.279
   10   1HB   PRO  25          2HB       PRO  25 -12.854  -4.298   7.716
   11   2HB   PRO  25          1HB       PRO  25 -13.987  -2.953   7.484
   12   1HG   PRO  25          2HG       PRO  25 -14.537  -5.859   7.786
   13   2HG   PRO  25          1HG       PRO  25 -15.438  -4.469   8.408
   14   1HD   PRO  25          2HD       PRO  25 -16.191  -5.910   6.208
   15   2HD   PRO  25          1HD       PRO  25 -16.619  -4.204   6.470
   16    QB   PRO  25           QB       PRO  25 -13.421  -3.626   7.600
   17    QG   PRO  25           QG       PRO  25 -14.988  -5.164   8.097
   18    QD   PRO  25           QD       PRO  25 -16.405  -5.057   6.339
   19    H    VAL  26           H        VAL  26 -13.894  -6.650   5.756
   20    HA   VAL  26           HA       VAL  26 -11.115  -7.473   5.771
   21    HB   VAL  26           HB       VAL  26 -12.100  -9.651   5.199
   22   1HG1  VAL  26          3HG1      VAL  26 -12.722  -8.121   7.390
   23   2HG1  VAL  26          2HG1      VAL  26 -14.326  -8.546   6.792
   24   3HG1  VAL  26          1HG1      VAL  26 -13.172  -9.816   7.200
   25   1HG2  VAL  26          2HG2      VAL  26 -14.409  -7.908   4.324
   26   2HG2  VAL  26          1HG2      VAL  26 -13.562  -9.145   3.396
   27   3HG2  VAL  26          3HG2      VAL  26 -14.635  -9.613   4.715
   28    MG1  VAL  26           QG1      VAL  26 -13.407  -8.828   7.127
   29    MG2  VAL  26           QG2      VAL  26 -14.202  -8.888   4.145
   30    QG   VAL  26           QQG      VAL  26 -13.804  -8.858   5.636
   31    H    LEU  27           H        LEU  27 -13.368  -6.728   3.104
   32    HA   LEU  27           HA       LEU  27 -11.838  -7.848   0.930
   33   1HB   LEU  27          2HB       LEU  27 -14.169  -6.578   1.213
   34   2HB   LEU  27          1HB       LEU  27 -13.209  -5.199   0.675
   35    HG   LEU  27           HG       LEU  27 -14.162  -6.243  -1.285
   36   1HD1  LEU  27          2HD1      LEU  27 -11.638  -5.574  -1.165
   37   2HD1  LEU  27          1HD1      LEU  27 -11.347  -7.312  -1.229
   38   3HD1  LEU  27          3HD1      LEU  27 -12.201  -6.511  -2.548
   39   1HD2  LEU  27          3HD2      LEU  27 -13.933  -8.590   0.229
   40   2HD2  LEU  27          2HD2      LEU  27 -14.508  -8.471  -1.434
   41   3HD2  LEU  27          1HD2      LEU  27 -12.809  -8.817  -1.111
   42    MD1  LEU  27           QD1      LEU  27 -11.729  -6.466  -1.647
   43    MD2  LEU  27           QD2      LEU  27 -13.750  -8.626  -0.772
   44    QB   LEU  27           QB       LEU  27 -13.689  -5.888   0.944
   45    QD   LEU  27           QQD      LEU  27 -12.739  -7.546  -1.210
   46    H    VAL  28           H        VAL  28 -11.538  -4.726   2.645
   47    HA   VAL  28           HA       VAL  28  -9.621  -3.504   0.848
   48    HB   VAL  28           HB       VAL  28 -10.112  -3.333   3.835
   49   1HG1  VAL  28          3HG1      VAL  28  -8.105  -2.043   2.127
   50   2HG1  VAL  28          2HG1      VAL  28  -9.113  -0.891   3.002
   51   3HG1  VAL  28          1HG1      VAL  28  -8.203  -2.116   3.886
   52   1HG2  VAL  28          3HG2      VAL  28 -11.120  -1.834   1.408
   53   2HG2  VAL  28          2HG2      VAL  28 -12.067  -2.695   2.622
   54   3HG2  VAL  28          1HG2      VAL  28 -11.262  -1.182   3.039
   55    MG1  VAL  28           QG1      VAL  28  -8.474  -1.683   3.005
   56    MG2  VAL  28           QG2      VAL  28 -11.483  -1.904   2.356
   57    QG   VAL  28           QQG      VAL  28  -9.978  -1.794   2.681
   58    H    ILE  29           H        ILE  29  -9.144  -5.590   3.746
   59    HA   ILE  29           HA       ILE  29  -6.227  -5.479   3.664
   60    HB   ILE  29           HB       ILE  29  -8.186  -7.572   4.663
   61   1HG1  ILE  29          2HG1      ILE  29  -6.800  -5.310   6.136
   62   2HG1  ILE  29          1HG1      ILE  29  -8.463  -5.234   5.553
   63   1HG2  ILE  29          1HG2      ILE  29  -5.251  -7.372   4.720
   64   2HG2  ILE  29          3HG2      ILE  29  -5.977  -7.622   6.307
   65   3HG2  ILE  29          2HG2      ILE  29  -6.289  -8.769   5.004
   66   1HD1  ILE  29          3HD1      ILE  29  -7.488  -7.443   7.373
   67   2HD1  ILE  29          2HD1      ILE  29  -8.165  -5.937   7.994
   68   3HD1  ILE  29          1HD1      ILE  29  -9.154  -7.003   6.997
   69    MG   ILE  29           QG2      ILE  29  -5.839  -7.921   5.344
   70    MD   ILE  29           QD1      ILE  29  -8.269  -6.794   7.455
   71    QG   ILE  29           QG1      ILE  29  -7.631  -5.272   5.844
   72    H    LEU  30           H        LEU  30  -8.637  -7.635   2.129
   73    HA   LEU  30           HA       LEU  30  -6.773  -9.625   1.151
   74   1HB   LEU  30          2HB       LEU  30  -9.260  -9.732   1.214
   75   2HB   LEU  30          1HB       LEU  30  -9.325  -8.536  -0.080
   76    HG   LEU  30           HG       LEU  30  -7.874 -10.133  -1.445
   77   1HD1  LEU  30          3HD1      LEU  30  -8.708 -11.972   0.818
   78   2HD1  LEU  30          2HD1      LEU  30  -8.037 -12.527  -0.716
   79   3HD1  LEU  30          1HD1      LEU  30  -7.059 -11.537   0.368
   80   1HD2  LEU  30          3HD2      LEU  30 -10.636  -9.974  -1.064
   81   2HD2  LEU  30          2HD2      LEU  30  -9.818 -10.763  -2.413
   82   3HD2  LEU  30          1HD2      LEU  30 -10.294 -11.703  -0.998
   83    MD1  LEU  30           QD1      LEU  30  -7.935 -12.012   0.157
   84    MD2  LEU  30           QD2      LEU  30 -10.250 -10.813  -1.492
   85    QB   LEU  30           QB       LEU  30  -9.293  -9.134   0.567
   86    QD   LEU  30           QQD      LEU  30  -9.092 -11.412  -0.667
   87    H    LEU  31           H        LEU  31  -7.921  -6.545  -0.312
   88    HA   LEU  31           HA       LEU  31  -6.416  -6.914  -2.807
   89   1HB   LEU  31          2HB       LEU  31  -8.376  -5.427  -2.430
   90   2HB   LEU  31          1HB       LEU  31  -7.384  -4.417  -1.379
   91    HG   LEU  31           HG       LEU  31  -5.782  -4.160  -3.342
   92   1HD1  LEU  31          2HD1      LEU  31  -8.144  -5.437  -4.745
   93   2HD1  LEU  31          1HD1      LEU  31  -6.875  -4.546  -5.587
   94   3HD1  LEU  31          3HD1      LEU  31  -6.481  -6.024  -4.708
   95   1HD2  LEU  31          3HD2      LEU  31  -8.184  -2.823  -2.696
   96   2HD2  LEU  31          2HD2      LEU  31  -6.826  -2.181  -3.620
   97   3HD2  LEU  31          1HD2      LEU  31  -8.169  -2.962  -4.454
   98    MD1  LEU  31           QD1      LEU  31  -7.167  -5.336  -5.013
   99    MD2  LEU  31           QD2      LEU  31  -7.726  -2.655  -3.590
  100    QB   LEU  31           QB       LEU  31  -7.880  -4.922  -1.905
  101    QD   LEU  31           QQD      LEU  31  -7.447  -3.996  -4.302
  102    H    GLY  32           H        GLY  32  -5.742  -5.120   0.246
  103   1HA   GLY  32          1HA       GLY  32  -3.686  -4.177   0.971
  104   2HA   GLY  32          2HA       GLY  32  -3.244  -3.977  -0.727
  105    QA   GLY  32           QA       GLY  32  -3.465  -4.077   0.122
  106    H    VAL  33           H        VAL  33  -3.944  -6.922   1.215
  107    HA   VAL  33           HA       VAL  33  -1.191  -7.711   1.606
  108    HB   VAL  33           HB       VAL  33  -2.248  -9.934   1.984
  109   1HG1  VAL  33          2HG1      VAL  33  -3.246  -7.386   3.095
  110   2HG1  VAL  33          1HG1      VAL  33  -4.306  -8.770   3.365
  111   3HG1  VAL  33          3HG1      VAL  33  -2.635  -8.815   3.928
  112   1HG2  VAL  33          1HG2      VAL  33  -4.552  -8.563   0.586
  113   2HG2  VAL  33          3HG2      VAL  33  -3.805 -10.112   0.195
  114   3HG2  VAL  33          2HG2      VAL  33  -4.801  -9.954   1.642
  115    MG1  VAL  33           QG1      VAL  33  -3.396  -8.324   3.463
  116    MG2  VAL  33           QG2      VAL  33  -4.386  -9.543   0.808
  117    QG   VAL  33           QQG      VAL  33  -3.891  -8.934   2.135
  118    H    VAL  34           H        VAL  34  -3.508  -8.491  -1.027
  119    HA   VAL  34           HA       VAL  34  -1.758 -10.271  -2.499
  120    HB   VAL  34           HB       VAL  34  -3.981  -8.360  -3.259
  121   1HG1  VAL  34          2HG1      VAL  34  -2.270 -10.129  -4.925
  122   2HG1  VAL  34          1HG1      VAL  34  -4.005 -10.214  -5.230
  123   3HG1  VAL  34          3HG1      VAL  34  -3.159  -8.673  -5.374
  124   1HG2  VAL  34          3HG2      VAL  34  -4.235 -10.466  -1.704
  125   2HG2  VAL  34          2HG2      VAL  34  -5.407 -10.194  -2.993
  126   3HG2  VAL  34          1HG2      VAL  34  -4.106 -11.365  -3.216
  127    MG1  VAL  34           QG1      VAL  34  -3.145  -9.672  -5.176
  128    MG2  VAL  34           QG2      VAL  34  -4.583 -10.675  -2.638
  129    QG   VAL  34           QQG      VAL  34  -3.864 -10.173  -3.907
  130    H    GLY  35           H        GLY  35  -2.137  -6.696  -2.607
  131   1HA   GLY  35          1HA       GLY  35  -0.688  -5.103  -3.607
  132   2HA   GLY  35          2HA       GLY  35  -0.425  -6.278  -4.897
  133    QA   GLY  35           QA       GLY  35  -0.556  -5.691  -4.252
  134    H    LEU  36           H        LEU  36   0.350  -6.661  -1.421
  135    HA   LEU  36           HA       LEU  36   3.152  -5.977  -1.590
  136   1HB   LEU  36          2HB       LEU  36   1.653  -8.023   0.077
  137   2HB   LEU  36          1HB       LEU  36   3.267  -7.418   0.451
  138    HG   LEU  36           HG       LEU  36   0.741  -5.750   0.251
  139   1HD1  LEU  36          3HD1      LEU  36   1.957  -7.239   2.396
  140   2HD1  LEU  36          2HD1      LEU  36   2.048  -5.515   2.756
  141   3HD1  LEU  36          1HD1      LEU  36   0.487  -6.265   2.426
  142   1HD2  LEU  36          1HD2      LEU  36   3.659  -5.080   0.560
  143   2HD2  LEU  36          3HD2      LEU  36   2.439  -4.291  -0.441
  144   3HD2  LEU  36          2HD2      LEU  36   2.440  -4.045   1.305
  145    MD1  LEU  36           QD1      LEU  36   1.497  -6.340   2.526
  146    MD2  LEU  36           QD2      LEU  36   2.846  -4.472   0.475
  147    QB   LEU  36           QB       LEU  36   2.460  -7.720   0.264
  148    QD   LEU  36           QQD      LEU  36   2.172  -5.406   1.500
  149    H    SER  37           H        SER  37   1.442  -9.056  -2.256
  150    HA   SER  37           HA       SER  37   3.757 -10.747  -2.531
  151   1HB   SER  37          2HB       SER  37   2.207 -12.194  -3.593
  152   2HB   SER  37          1HB       SER  37   1.208 -11.187  -2.549
  153    HG   SER  37           HG       SER  37   0.335 -10.308  -4.255
  154    QB   SER  37           QB       SER  37   1.707 -11.691  -3.071
  155    H    ALA  38           H        ALA  38   2.043  -8.815  -5.064
  156    HA   ALA  38           HA       ALA  38   3.768  -9.488  -7.261
  157   1HB   ALA  38          2HB       ALA  38   1.608  -7.952  -6.864
  158   2HB   ALA  38          3HB       ALA  38   2.640  -7.740  -8.279
  159   3HB   ALA  38          1HB       ALA  38   2.824  -6.677  -6.882
  160    MB   ALA  38           QB       ALA  38   2.358  -7.456  -7.342
  161    H    LEU  39           H        LEU  39   4.231  -7.152  -4.601
  162    HA   LEU  39           HA       LEU  39   6.937  -6.446  -5.811
  163   1HB   LEU  39          2HB       LEU  39   5.266  -5.144  -3.637
  164   2HB   LEU  39          1HB       LEU  39   6.732  -4.475  -4.356
  165    HG   LEU  39           HG       LEU  39   4.120  -5.040  -5.784
  166   1HD1  LEU  39          3HD1      LEU  39   5.573  -2.540  -4.919
  167   2HD1  LEU  39          2HD1      LEU  39   4.378  -2.510  -6.216
  168   3HD1  LEU  39          1HD1      LEU  39   3.903  -3.003  -4.590
  169   1HD2  LEU  39          1HD2      LEU  39   6.889  -4.416  -6.743
  170   2HD2  LEU  39          3HD2      LEU  39   5.668  -5.466  -7.462
  171   3HD2  LEU  39          2HD2      LEU  39   5.524  -3.715  -7.610
  172    MD1  LEU  39           QD1      LEU  39   4.618  -2.684  -5.242
  173    MD2  LEU  39           QD2      LEU  39   6.027  -4.532  -7.271
  174    QB   LEU  39           QB       LEU  39   5.999  -4.810  -3.996
  175    QD   LEU  39           QQD      LEU  39   5.323  -3.608  -6.257
  176    H    THR  40           H        THR  40   8.399  -7.989  -5.063
  177    HA   THR  40           HA       THR  40   8.607  -8.166  -2.032
  178    HB   THR  40           HB       THR  40   8.937 -10.652  -2.374
  179    HG1  THR  40          1HG       THR  40   8.711 -11.471  -4.321
  180   1HG2  THR  40          2HG2      THR  40   6.783  -9.707  -1.620
  181   2HG2  THR  40          1HG2      THR  40   6.290  -9.503  -3.301
  182   3HG2  THR  40          3HG2      THR  40   6.537 -11.121  -2.646
  183    MG   THR  40           QG2      THR  40   6.536 -10.111  -2.522
  184    H    GLY  41           H        GLY  41  10.205  -6.632  -3.964
  185   1HA   GLY  41          1HA       GLY  41  12.476  -7.498  -5.086
  186   2HA   GLY  41          2HA       GLY  41  12.829  -8.061  -3.451
  187    QA   GLY  41           QA       GLY  41  12.652  -7.780  -4.269
  188    H    TYR  42           H        TYR  42  14.596  -6.666  -3.083
  189    HA   TYR  42           HA       TYR  42  13.913  -4.006  -2.089
  190   1HB   TYR  42          2HB       TYR  42  16.526  -5.300  -2.935
  191   2HB   TYR  42          1HB       TYR  42  16.405  -3.828  -1.969
  192    HD1  TYR  42          1HD       TYR  42  16.237  -7.451  -1.947
  193    HD2  TYR  42          2HD       TYR  42  15.248  -3.912   0.277
  194    HE1  TYR  42          1HE       TYR  42  15.971  -8.816   0.107
  195    HE2  TYR  42          2HE       TYR  42  14.981  -5.277   2.330
  196    HH   TYR  42           HH       TYR  42  15.296  -8.818   2.236
  197    QB   TYR  42           QB       TYR  42  16.465  -4.564  -2.452
  198    QD   TYR  42           QD       TYR  42  15.743  -5.682  -0.835
  199    QE   TYR  42           QE       TYR  42  15.476  -7.046   1.219
  200    QR   TYR  42           QR       TYR  42  15.609  -6.364   0.192
  201    H    LEU  43           H        LEU  43  15.149  -1.980  -2.908
  202    HA   LEU  43           HA       LEU  43  15.791  -1.831  -5.778
  203   1HB   LEU  43          2HB       LEU  43  13.327  -2.260  -5.830
  204   2HB   LEU  43          1HB       LEU  43  13.081  -0.794  -4.880
  205    HG   LEU  43           HG       LEU  43  14.339   0.455  -6.710
  206   1HD1  LEU  43          1HD1      LEU  43  14.348  -2.303  -7.770
  207   2HD1  LEU  43          3HD1      LEU  43  13.867  -1.068  -8.934
  208   3HD1  LEU  43          2HD1      LEU  43  15.430  -0.957  -8.126
  209   1HD2  LEU  43          1HD2      LEU  43  11.631  -0.729  -6.816
  210   2HD2  LEU  43          3HD2      LEU  43  12.128   0.957  -6.957
  211   3HD2  LEU  43          2HD2      LEU  43  12.230  -0.112  -8.356
  212    MD1  LEU  43           QD1      LEU  43  14.548  -1.443  -8.277
  213    MD2  LEU  43           QD2      LEU  43  11.996   0.039  -7.376
  214    QB   LEU  43           QB       LEU  43  13.204  -1.527  -5.355
  215    QD   LEU  43           QQD      LEU  43  13.272  -0.702  -7.827
  216    H    ASP  44           H        ASP  44  17.158  -0.089  -5.928
  217    HA   ASP  44           HA       ASP  44  17.425   1.798  -3.698
  218   1HB   ASP  44          2HB       ASP  44  18.352   1.788  -6.587
  219   2HB   ASP  44          1HB       ASP  44  18.942   2.918  -5.369
  220    QB   ASP  44           QB       ASP  44  18.647   2.353  -5.978
  221    H    TYR  45           H        TYR  45  17.538   4.319  -4.498
  222    HA   TYR  45           HA       TYR  45  14.692   4.866  -5.453
  223   1HB   TYR  45          2HB       TYR  45  14.817   6.791  -4.050
  224   2HB   TYR  45          1HB       TYR  45  15.596   5.508  -3.126
  225    HD1  TYR  45          1HD       TYR  45  16.102   8.621  -5.001
  226    HD2  TYR  45          2HD       TYR  45  18.045   5.428  -2.887
  227    HE1  TYR  45          1HE       TYR  45  18.189   9.956  -4.906
  228    HE2  TYR  45          2HE       TYR  45  20.134   6.762  -2.791
  229    HH   TYR  45           HH       TYR  45  20.299  10.018  -4.245
  230    QB   TYR  45           QB       TYR  45  15.206   6.149  -3.588
  231    QD   TYR  45           QD       TYR  45  17.073   7.024  -3.944
  232    QE   TYR  45           QE       TYR  45  19.162   8.359  -3.848
  233    QR   TYR  45           QR       TYR  45  18.118   7.691  -3.896
  234    H    VAL  46           H        VAL  46  14.397   5.938  -7.370
  235    HA   VAL  46           HA       VAL  46  16.911   6.936  -8.746
  236    HB   VAL  46           HB       VAL  46  14.201   6.864 -10.006
  237   1HG1  VAL  46          1HG1      VAL  46  16.972   6.892 -10.789
  238   2HG1  VAL  46          3HG1      VAL  46  16.197   5.449 -11.443
  239   3HG1  VAL  46          2HG1      VAL  46  15.539   7.045 -11.806
  240   1HG2  VAL  46          1HG2      VAL  46  15.683   4.495  -8.898
  241   2HG2  VAL  46          3HG2      VAL  46  13.949   4.812  -8.912
  242   3HG2  VAL  46          2HG2      VAL  46  14.768   4.324 -10.396
  243    MG1  VAL  46           QG1      VAL  46  16.236   6.462 -11.346
  244    MG2  VAL  46           QG2      VAL  46  14.800   4.543  -9.402
  245    QG   VAL  46           QQG      VAL  46  15.518   5.503 -10.374
  246    H    LEU  47           H        LEU  47  15.140   8.612 -10.531
  247    HA   LEU  47           HA       LEU  47  15.557  11.162  -9.252
  248   1HB   LEU  47          2HB       LEU  47  15.184  10.675 -11.672
  249   2HB   LEU  47          1HB       LEU  47  13.489  10.340 -11.318
  250    HG   LEU  47           HG       LEU  47  13.375  12.682 -10.311
  251   1HD1  LEU  47          1HD1      LEU  47  16.178  12.528 -10.982
  252   2HD1  LEU  47          3HD1      LEU  47  15.428  13.860 -11.860
  253   3HD1  LEU  47          2HD1      LEU  47  15.321  13.794 -10.101
  254   1HD2  LEU  47          3HD2      LEU  47  13.992  12.316 -13.261
  255   2HD2  LEU  47          2HD2      LEU  47  12.406  12.213 -12.495
  256   3HD2  LEU  47          1HD2      LEU  47  13.246  13.761 -12.576
  257    MD1  LEU  47           QD1      LEU  47  15.642  13.394 -10.981
  258    MD2  LEU  47           QD2      LEU  47  13.214  12.764 -12.777
  259    QB   LEU  47           QB       LEU  47  14.337  10.507 -11.495
  260    QD   LEU  47           QQD      LEU  47  14.428  13.079 -11.879
  261    H    LEU  48           H        LEU  48  12.719   8.980  -9.261
  262    HA   LEU  48           HA       LEU  48  11.629  10.594  -6.937
  263   1HB   LEU  48          2HB       LEU  48  10.786  10.874  -9.605
  264   2HB   LEU  48          1HB       LEU  48   9.551   9.874  -8.839
  265    HG   LEU  48           HG       LEU  48   8.988  12.248  -8.578
  266   1HD1  LEU  48          2HD1      LEU  48   9.309  10.355  -6.467
  267   2HD1  LEU  48          1HD1      LEU  48   9.709  11.948  -5.824
  268   3HD1  LEU  48          3HD1      LEU  48   8.139  11.669  -6.578
  269   1HD2  LEU  48          1HD2      LEU  48  11.543  12.843  -8.611
  270   2HD2  LEU  48          3HD2      LEU  48  10.445  13.834  -7.648
  271   3HD2  LEU  48          2HD2      LEU  48  11.439  12.604  -6.867
  272    MD1  LEU  48           QD1      LEU  48   9.052  11.324  -6.290
  273    MD2  LEU  48           QD2      LEU  48  11.143  13.094  -7.709
  274    QB   LEU  48           QB       LEU  48  10.169  10.374  -9.222
  275    QD   LEU  48           QQD      LEU  48  10.097  12.209  -6.999
  276    HA   PRO  49           HA       PRO  49  11.060   6.287  -5.846
  277   1HB   PRO  49          2HB       PRO  49  10.254   6.771  -3.275
  278   2HB   PRO  49          1HB       PRO  49  11.956   6.825  -3.777
  279   1HG   PRO  49          2HG       PRO  49  10.039   9.067  -3.354
  280   2HG   PRO  49          1HG       PRO  49  11.752   8.951  -2.916
  281   1HD   PRO  49          2HD       PRO  49  10.874  10.313  -5.095
  282   2HD   PRO  49          1HD       PRO  49  12.465   9.524  -5.023
  283    QB   PRO  49           QB       PRO  49  11.105   6.798  -3.526
  284    QG   PRO  49           QG       PRO  49  10.895   9.009  -3.135
  285    QD   PRO  49           QD       PRO  49  11.669   9.919  -5.059
  286    H    ALA  50           H        ALA  50   9.154   6.886  -7.531
  287    HA   ALA  50           HA       ALA  50   6.531   7.564  -6.523
  288   1HB   ALA  50          3HB       ALA  50   7.067   5.536  -8.692
  289   2HB   ALA  50          2HB       ALA  50   5.835   6.799  -8.648
  290   3HB   ALA  50          1HB       ALA  50   7.528   7.225  -8.910
  291    MB   ALA  50           QB       ALA  50   6.810   6.520  -8.750
  292    H    LEU  51           H        LEU  51   8.340   4.497  -6.516
  293    HA   LEU  51           HA       LEU  51   6.062   2.785  -5.839
  294   1HB   LEU  51          2HB       LEU  51   9.051   2.719  -5.750
  295   2HB   LEU  51          1HB       LEU  51   8.181   1.474  -4.852
  296    HG   LEU  51           HG       LEU  51   8.767   0.933  -7.297
  297   1HD1  LEU  51          3HD1      LEU  51   6.801   0.037  -5.709
  298   2HD1  LEU  51          2HD1      LEU  51   5.807   0.779  -6.963
  299   3HD1  LEU  51          1HD1      LEU  51   6.956  -0.489  -7.386
  300   1HD2  LEU  51          2HD2      LEU  51   8.033   3.259  -8.060
  301   2HD2  LEU  51          1HD2      LEU  51   7.414   1.911  -9.015
  302   3HD2  LEU  51          3HD2      LEU  51   6.372   2.706  -7.834
  303    MD1  LEU  51           QD1      LEU  51   6.521   0.109  -6.686
  304    MD2  LEU  51           QD2      LEU  51   7.273   2.625  -8.303
  305    QB   LEU  51           QB       LEU  51   8.616   2.096  -5.301
  306    QD   LEU  51           QQD      LEU  51   6.897   1.367  -7.495
  307    H    ALA  52           H        ALA  52   8.628   4.301  -3.802
  308    HA   ALA  52           HA       ALA  52   7.658   3.369  -1.260
  309   1HB   ALA  52          1HB       ALA  52   9.719   4.815  -2.135
  310   2HB   ALA  52          3HB       ALA  52   8.702   6.154  -1.607
  311   3HB   ALA  52          2HB       ALA  52   9.194   4.914  -0.455
  312    MB   ALA  52           QB       ALA  52   9.205   5.294  -1.399
  313    H    ILE  53           H        ILE  53   6.783   6.345  -3.094
  314    HA   ILE  53           HA       ILE  53   4.892   7.323  -1.092
  315    HB   ILE  53           HB       ILE  53   5.014   7.670  -4.107
  316   1HG1  ILE  53          2HG1      ILE  53   7.149   8.246  -3.142
  317   2HG1  ILE  53          1HG1      ILE  53   6.294   9.758  -3.450
  318   1HG2  ILE  53          3HG2      ILE  53   2.895   8.445  -3.049
  319   2HG2  ILE  53          2HG2      ILE  53   3.838   9.461  -1.959
  320   3HG2  ILE  53          1HG2      ILE  53   3.849   9.781  -3.694
  321   1HD1  ILE  53          2HD1      ILE  53   5.418   9.371  -0.972
  322   2HD1  ILE  53          1HD1      ILE  53   6.894   8.416  -0.843
  323   3HD1  ILE  53          3HD1      ILE  53   6.983  10.126  -1.269
  324    MG   ILE  53           QG2      ILE  53   3.527   9.229  -2.901
  325    MD   ILE  53           QD1      ILE  53   6.432   9.304  -1.028
  326    QG   ILE  53           QG1      ILE  53   6.722   9.002  -3.296
  327    H    PHE  54           H        PHE  54   4.481   5.313  -4.050
  328    HA   PHE  54           HA       PHE  54   1.623   5.091  -3.994
  329   1HB   PHE  54          2HB       PHE  54   3.236   4.277  -5.721
  330   2HB   PHE  54          1HB       PHE  54   3.693   2.965  -4.633
  331    HD1  PHE  54          1HD       PHE  54   2.267   1.056  -4.297
  332    HD2  PHE  54          2HD       PHE  54   0.924   4.399  -6.636
  333    HE1  PHE  54          1HE       PHE  54   0.337  -0.279  -5.097
  334    HE2  PHE  54          2HE       PHE  54  -1.007   3.063  -7.436
  335    HZ   PHE  54           HZ       PHE  54  -1.300   0.724  -6.666
  336    QB   PHE  54           QB       PHE  54   3.464   3.621  -5.177
  337    QD   PHE  54           QD       PHE  54   1.595   2.728  -5.467
  338    QE   PHE  54           QE       PHE  54  -0.335   1.392  -6.266
  339    QR   PHE  54           QR       PHE  54   0.244   1.793  -6.026
  340    H    ILE  55           H        ILE  55   4.076   3.060  -2.295
  341    HA   ILE  55           HA       ILE  55   2.135   1.308  -1.012
  342    HB   ILE  55           HB       ILE  55   4.889   2.278  -0.182
  343   1HG1  ILE  55          2HG1      ILE  55   4.871   1.257  -2.406
  344   2HG1  ILE  55          1HG1      ILE  55   5.617   0.144  -1.258
  345   1HG2  ILE  55          1HG2      ILE  55   3.103   0.058   0.799
  346   2HG2  ILE  55          3HG2      ILE  55   4.856  -0.077   0.924
  347   3HG2  ILE  55          2HG2      ILE  55   4.012   1.238   1.741
  348   1HD1  ILE  55          2HD1      ILE  55   3.305  -0.909  -0.987
  349   2HD1  ILE  55          1HD1      ILE  55   2.817   0.032  -2.397
  350   3HD1  ILE  55          3HD1      ILE  55   4.094  -1.175  -2.541
  351    MG   ILE  55           QG2      ILE  55   3.990   0.406   1.155
  352    MD   ILE  55           QD1      ILE  55   3.405  -0.684  -1.975
  353    QG   ILE  55           QG1      ILE  55   5.244   0.701  -1.832
  354    H    GLY  56           H        GLY  56   3.698   4.363   0.085
  355   1HA   GLY  56          1HA       GLY  56   2.948   5.862   1.764
  356   2HA   GLY  56          2HA       GLY  56   2.549   4.427   2.711
  357    QA   GLY  56           QA       GLY  56   2.748   5.144   2.238
  358    H    LEU  57           H        LEU  57   1.216   5.858  -0.330
  359    HA   LEU  57           HA       LEU  57  -1.312   6.657   0.865
  360   1HB   LEU  57          2HB       LEU  57  -0.343   7.349  -1.332
  361   2HB   LEU  57          1HB       LEU  57  -0.672   5.732  -1.955
  362    HG   LEU  57           HG       LEU  57  -3.104   6.108  -1.302
  363   1HD1  LEU  57          3HD1      LEU  57  -1.932   8.836  -0.789
  364   2HD1  LEU  57          2HD1      LEU  57  -3.621   8.660  -1.265
  365   3HD1  LEU  57          1HD1      LEU  57  -3.040   7.904   0.218
  366   1HD2  LEU  57          1HD2      LEU  57  -1.692   7.743  -3.414
  367   2HD2  LEU  57          3HD2      LEU  57  -2.603   6.247  -3.616
  368   3HD2  LEU  57          2HD2      LEU  57  -3.449   7.754  -3.267
  369    MD1  LEU  57           QD1      LEU  57  -2.864   8.467  -0.612
  370    MD2  LEU  57           QD2      LEU  57  -2.581   7.248  -3.432
  371    QB   LEU  57           QB       LEU  57  -0.508   6.541  -1.644
  372    QD   LEU  57           QQD      LEU  57  -2.723   7.858  -2.022
  373    H    THR  58           H        THR  58  -0.217   3.589  -0.626
  374    HA   THR  58           HA       THR  58  -2.833   2.305  -0.660
  375    HB   THR  58           HB       THR  58  -0.029   1.188  -0.328
  376    HG1  THR  58          1HG       THR  58   0.193   1.844  -2.290
  377   1HG2  THR  58          1HG2      THR  58  -2.687  -0.036  -0.704
  378   2HG2  THR  58          3HG2      THR  58  -1.446  -0.613  -1.815
  379   3HG2  THR  58          2HG2      THR  58  -1.199  -0.743  -0.073
  380    MG   THR  58           QG2      THR  58  -1.777  -0.464  -0.864
  381    H    ILE  59           H        ILE  59  -0.135   2.097   1.730
  382    HA   ILE  59           HA       ILE  59  -1.648   0.474   3.628
  383    HB   ILE  59           HB       ILE  59   0.664   2.409   3.966
  384   1HG1  ILE  59          2HG1      ILE  59   1.114   0.693   2.283
  385   2HG1  ILE  59          1HG1      ILE  59   2.016   0.312   3.751
  386   1HG2  ILE  59          2HG2      ILE  59  -0.434   0.194   5.714
  387   2HG2  ILE  59          1HG2      ILE  59   1.196   0.839   5.902
  388   3HG2  ILE  59          3HG2      ILE  59  -0.201   1.889   6.143
  389   1HD1  ILE  59          3HD1      ILE  59  -0.006  -1.136   4.413
  390   2HD1  ILE  59          2HD1      ILE  59  -0.526  -0.968   2.736
  391   3HD1  ILE  59          1HD1      ILE  59   1.012  -1.745   3.108
  392    MG   ILE  59           QG2      ILE  59   0.187   0.974   5.920
  393    MD   ILE  59           QD1      ILE  59   0.160  -1.283   3.419
  394    QG   ILE  59           QG1      ILE  59   1.565   0.502   3.017
  395    H    TYR  60           H        TYR  60  -1.135   4.041   3.373
  396    HA   TYR  60           HA       TYR  60  -2.523   4.729   5.823
  397   1HB   TYR  60          2HB       TYR  60  -1.944   6.015   3.168
  398   2HB   TYR  60          1HB       TYR  60  -3.013   6.847   4.295
  399    HD1  TYR  60          1HD       TYR  60  -1.890   8.532   5.430
  400    HD2  TYR  60          2HD       TYR  60   0.114   4.801   4.709
  401    HE1  TYR  60          1HE       TYR  60   0.068   9.332   6.723
  402    HE2  TYR  60          2HE       TYR  60   2.074   5.604   6.002
  403    HH   TYR  60           HH       TYR  60   2.636   8.742   6.725
  404    QB   TYR  60           QB       TYR  60  -2.478   6.431   3.731
  405    QD   TYR  60           QD       TYR  60  -0.888   6.666   5.070
  406    QE   TYR  60           QE       TYR  60   1.071   7.468   6.362
  407    QR   TYR  60           QR       TYR  60   0.091   7.067   5.716
  408    H    ALA  61           H        ALA  61  -3.753   4.485   2.442
  409    HA   ALA  61           HA       ALA  61  -6.519   5.037   3.051
  410   1HB   ALA  61          2HB       ALA  61  -6.784   3.557   0.927
  411   2HB   ALA  61          1HB       ALA  61  -5.804   5.018   0.805
  412   3HB   ALA  61          3HB       ALA  61  -5.025   3.443   0.974
  413    MB   ALA  61           QB       ALA  61  -5.871   4.006   0.902
  414    H    ILE  62           H        ILE  62  -4.721   1.921   3.050
  415    HA   ILE  62           HA       ILE  62  -7.048   0.259   3.576
  416    HB   ILE  62           HB       ILE  62  -4.094   0.037   4.193
  417   1HG1  ILE  62          2HG1      ILE  62  -5.739  -1.384   2.091
  418   2HG1  ILE  62          1HG1      ILE  62  -4.991   0.185   1.791
  419   1HG2  ILE  62          2HG2      ILE  62  -6.367  -1.887   4.617
  420   2HG2  ILE  62          1HG2      ILE  62  -4.765  -2.498   4.207
  421   3HG2  ILE  62          3HG2      ILE  62  -4.997  -1.542   5.670
  422   1HD1  ILE  62          2HD1      ILE  62  -2.808  -0.909   2.629
  423   2HD1  ILE  62          1HD1      ILE  62  -3.647  -2.444   2.402
  424   3HD1  ILE  62          3HD1      ILE  62  -3.384  -1.371   1.027
  425    MG   ILE  62           QG2      ILE  62  -5.376  -1.976   4.832
  426    MD   ILE  62           QD1      ILE  62  -3.279  -1.575   2.019
  427    QG   ILE  62           QG1      ILE  62  -5.365  -0.599   1.941
  428    H    GLN  63           H        GLN  63  -4.669   1.782   5.825
  429    HA   GLN  63           HA       GLN  63  -5.845   0.695   8.249
  430   1HB   GLN  63          2HB       GLN  63  -4.362   3.268   7.630
  431   2HB   GLN  63          1HB       GLN  63  -4.647   2.663   9.263
  432   1HG   GLN  63          2HG       GLN  63  -3.432   0.601   8.742
  433   2HG   GLN  63          1HG       GLN  63  -3.189   1.144   7.081
  434   1HE2  GLN  63          1HE2      GLN  63  -0.930   0.525   8.685
  435   2HE2  GLN  63          2HE2      GLN  63  -0.083   2.066   9.073
  436    QB   GLN  63           QB       GLN  63  -4.505   2.965   8.446
  437    QG   GLN  63           QG       GLN  63  -3.311   0.872   7.912
  438    QE   GLN  63           QE2      GLN  63  -0.507   1.296   8.879
  439    H    ARG  64           H        ARG  64  -6.540   3.688   6.390
  440    HA   ARG  64           HA       ARG  64  -8.453   4.767   8.313
  441   1HB   ARG  64          2HB       ARG  64  -7.327   5.940   6.413
  442   2HB   ARG  64          1HB       ARG  64  -8.328   5.018   5.291
  443   1HG   ARG  64          2HG       ARG  64 -10.360   5.958   6.349
  444   2HG   ARG  64          1HG       ARG  64  -9.345   6.910   7.430
  445   1HD   ARG  64          2HD       ARG  64  -8.316   8.019   5.438
  446   2HD   ARG  64          1HD       ARG  64  -9.450   7.130   4.401
  447    HE   ARG  64           HE       ARG  64 -10.289   9.113   6.562
  448   1HH1  ARG  64          1HH1      ARG  64 -12.018   6.759   5.209
  449   2HH1  ARG  64          2HH1      ARG  64 -12.992   7.716   4.144
  450   1HH2  ARG  64          1HH2      ARG  64 -11.015  10.548   4.451
  451   2HH2  ARG  64          2HH2      ARG  64 -12.424   9.861   3.714
  452    QB   ARG  64           QB       ARG  64  -7.827   5.479   5.852
  453    QG   ARG  64           QG       ARG  64  -9.853   6.434   6.890
  454    QD   ARG  64           QD       ARG  64  -8.883   7.574   4.919
  455    QH1  ARG  64           QH1      ARG  64 -12.505   7.238   4.677
  456    QH2  ARG  64           QH2      ARG  64 -11.720  10.205   4.082
  457    H    LYS  65           H        LYS  65  -8.959   2.899   5.261
  458    HA   LYS  65           HA       LYS  65 -11.812   2.607   5.535
  459   1HB   LYS  65          2HB       LYS  65  -9.667   0.781   4.401
  460   2HB   LYS  65          1HB       LYS  65 -11.391   0.617   4.060
  461   1HG   LYS  65          2HG       LYS  65  -9.767   3.119   3.509
  462   2HG   LYS  65          1HG       LYS  65 -10.174   1.906   2.295
  463   1HD   LYS  65          2HD       LYS  65 -12.609   2.283   2.868
  464   2HD   LYS  65          1HD       LYS  65 -12.095   3.648   3.860
  465   1HE   LYS  65          2HE       LYS  65 -11.694   3.321   0.866
  466   2HE   LYS  65          1HE       LYS  65 -12.669   4.554   1.693
  467   1HZ   LYS  65          2HZ       LYS  65 -10.494   5.044   2.944
  468   2HZ   LYS  65          1HZ       LYS  65  -9.734   4.239   1.656
  469   3HZ   LYS  65          3HZ       LYS  65 -10.656   5.630   1.358
  470    QB   LYS  65           QB       LYS  65 -10.529   0.699   4.231
  471    QD   LYS  65           QD       LYS  65 -12.352   2.965   3.364
  472    QG   LYS  65           QG       LYS  65  -9.970   2.512   2.902
  473    QE   LYS  65           QE       LYS  65 -12.181   3.937   1.279
  474    QZ   LYS  65           QZ       LYS  65 -10.295   4.971   1.986
  475    H    ARG  66           H        ARG  66  -9.170   0.416   6.666
  476    HA   ARG  66           HA       ARG  66 -10.918  -1.497   7.970
  477   1HB   ARG  66          2HB       ARG  66  -8.094  -0.522   8.494
  478   2HB   ARG  66          1HB       ARG  66  -8.788  -1.940   9.282
  479   1HG   ARG  66          2HG       ARG  66  -9.177  -2.995   7.102
  480   2HG   ARG  66          1HG       ARG  66  -8.551  -1.564   6.282
  481   1HD   ARG  66          2HD       ARG  66  -6.757  -3.207   6.379
  482   2HD   ARG  66          1HD       ARG  66  -6.366  -1.924   7.541
  483    HE   ARG  66           HE       ARG  66  -8.028  -4.103   8.707
  484   1HH1  ARG  66          1HH1      ARG  66  -6.259  -2.782  10.546
  485   2HH1  ARG  66          2HH1      ARG  66  -4.840  -3.774  10.619
  486   1HH2  ARG  66          1HH2      ARG  66  -5.519  -5.429   7.649
  487   2HH2  ARG  66          2HH2      ARG  66  -4.421  -5.271   8.981
  488    QB   ARG  66           QB       ARG  66  -8.441  -1.231   8.888
  489    QG   ARG  66           QG       ARG  66  -8.864  -2.279   6.692
  490    QD   ARG  66           QD       ARG  66  -6.562  -2.566   6.960
  491    QH1  ARG  66           QH1      ARG  66  -5.550  -3.278  10.583
  492    QH2  ARG  66           QH2      ARG  66  -4.970  -5.350   8.315
  493    H    GLN  67           H        GLN  67  -9.535   1.617   9.050
  494    HA   GLN  67           HA       GLN  67 -11.593   1.714  11.236
  495   1HB   GLN  67          2HB       GLN  67  -9.691   0.344  12.120
  496   2HB   GLN  67          1HB       GLN  67  -8.613   1.707  11.824
  497   1HG   GLN  67          2HG       GLN  67  -9.946   3.109  13.350
  498   2HG   GLN  67          1HG       GLN  67 -11.043   1.758  13.640
  499   1HE2  GLN  67          1HE2      GLN  67  -9.825   2.800  15.896
  500   2HE2  GLN  67          2HE2      GLN  67  -8.529   1.678  16.451
  501    QB   GLN  67           QB       GLN  67  -9.152   1.026  11.972
  502    QG   GLN  67           QG       GLN  67 -10.494   2.434  13.495
  503    QE   GLN  67           QE2      GLN  67  -9.177   2.239  16.173
  504    H    ALA  68           H        ALA  68 -12.069   3.854  11.797
  505    HA   ALA  68           HA       ALA  68 -10.465   5.925  10.251
  506   1HB   ALA  68          1HB       ALA  68 -13.156   6.113  11.638
  507   2HB   ALA  68          2HB       ALA  68 -12.953   5.601   9.963
  508   3HB   ALA  68          3HB       ALA  68 -12.496   7.234  10.447
  509    MB   ALA  68           QB       ALA  68 -12.868   6.316  10.683
  510    H    ASP  69           H        ASP  69  -9.379   7.589  11.296
  511    HA   ASP  69           HA       ASP  69  -8.823   7.252  14.169
  512   1HB   ASP  69          2HB       ASP  69  -8.341   9.471  12.154
  513   2HB   ASP  69          1HB       ASP  69  -7.617   9.427  13.763
  514    QB   ASP  69           QB       ASP  69  -7.979   9.449  12.959

  No H/Q in entry =         514
  Start of MODEL   12
    1    H    THR  24           H        THR  24 -18.604  -4.482   4.765
    2    HA   THR  24           HA       THR  24 -16.762  -5.939   5.501
    3    HB   THR  24           HB       THR  24 -17.695  -6.909   3.533
    4    HG1  THR  24          1HG       THR  24 -15.438  -7.478   4.113
    5   1HG2  THR  24          1HG2      THR  24 -16.211  -4.713   2.081
    6   2HG2  THR  24          3HG2      THR  24 -16.903  -6.105   1.248
    7   3HG2  THR  24          2HG2      THR  24 -17.951  -4.992   2.130
    8    MG   THR  24           QG2      THR  24 -17.022  -5.270   1.820
    9    HA   PRO  25           HA       PRO  25 -13.341  -2.861   5.114
   10   1HB   PRO  25          2HB       PRO  25 -12.435  -3.273   7.678
   11   2HB   PRO  25          1HB       PRO  25 -13.697  -2.097   7.260
   12   1HG   PRO  25          2HG       PRO  25 -13.965  -4.842   8.385
   13   2HG   PRO  25          1HG       PRO  25 -14.867  -3.369   8.777
   14   1HD   PRO  25          2HD       PRO  25 -15.878  -5.325   7.204
   15   2HD   PRO  25          1HD       PRO  25 -16.299  -3.610   6.993
   16    QB   PRO  25           QB       PRO  25 -13.066  -2.685   7.469
   17    QG   PRO  25           QG       PRO  25 -14.416  -4.105   8.581
   18    QD   PRO  25           QD       PRO  25 -16.089  -4.467   7.098
   19    H    VAL  26           H        VAL  26 -13.595  -6.214   6.164
   20    HA   VAL  26           HA       VAL  26 -10.741  -6.824   6.240
   21    HB   VAL  26           HB       VAL  26 -13.224  -8.449   5.609
   22   1HG1  VAL  26          1HG1      VAL  26 -10.370  -9.154   5.662
   23   2HG1  VAL  26          3HG1      VAL  26 -11.361 -10.157   6.721
   24   3HG1  VAL  26          2HG1      VAL  26 -11.736 -10.051   5.000
   25   1HG2  VAL  26          3HG2      VAL  26 -12.045  -7.335   8.029
   26   2HG2  VAL  26          2HG2      VAL  26 -13.613  -8.111   7.810
   27   3HG2  VAL  26          1HG2      VAL  26 -12.182  -9.091   8.129
   28    MG1  VAL  26           QG1      VAL  26 -11.156  -9.787   5.794
   29    MG2  VAL  26           QG2      VAL  26 -12.613  -8.179   7.989
   30    QG   VAL  26           QQG      VAL  26 -11.884  -8.983   6.892
   31    H    LEU  27           H        LEU  27 -13.146  -6.707   3.604
   32    HA   LEU  27           HA       LEU  27 -11.589  -8.054   1.575
   33   1HB   LEU  27          2HB       LEU  27 -14.028  -6.999   1.754
   34   2HB   LEU  27          1HB       LEU  27 -13.244  -5.633   0.959
   35    HG   LEU  27           HG       LEU  27 -14.145  -7.088  -0.756
   36   1HD1  LEU  27          2HD1      LEU  27 -11.727  -6.110  -0.888
   37   2HD1  LEU  27          1HD1      LEU  27 -11.215  -7.786  -0.686
   38   3HD1  LEU  27          3HD1      LEU  27 -12.210  -7.328  -2.068
   39   1HD2  LEU  27          3HD2      LEU  27 -13.496  -9.118   1.100
   40   2HD2  LEU  27          2HD2      LEU  27 -14.253  -9.324  -0.480
   41   3HD2  LEU  27          1HD2      LEU  27 -12.500  -9.429  -0.321
   42    MD1  LEU  27           QD1      LEU  27 -11.718  -7.075  -1.214
   43    MD2  LEU  27           QD2      LEU  27 -13.416  -9.290   0.100
   44    QB   LEU  27           QB       LEU  27 -13.636  -6.316   1.357
   45    QD   LEU  27           QQD      LEU  27 -12.567  -8.183  -0.557
   46    H    VAL  28           H        VAL  28 -11.551  -4.670   2.724
   47    HA   VAL  28           HA       VAL  28  -9.866  -3.575   0.647
   48    HB   VAL  28           HB       VAL  28 -10.151  -2.981   3.608
   49   1HG1  VAL  28          1HG1      VAL  28  -8.692  -1.599   1.392
   50   2HG1  VAL  28          3HG1      VAL  28  -9.532  -0.604   2.581
   51   3HG1  VAL  28          2HG1      VAL  28  -8.274  -1.726   3.101
   52   1HG2  VAL  28          3HG2      VAL  28 -12.054  -2.884   1.645
   53   2HG2  VAL  28          2HG2      VAL  28 -12.055  -1.845   3.071
   54   3HG2  VAL  28          1HG2      VAL  28 -11.385  -1.255   1.549
   55    MG1  VAL  28           QG1      VAL  28  -8.833  -1.310   2.358
   56    MG2  VAL  28           QG2      VAL  28 -11.831  -1.994   2.088
   57    QG   VAL  28           QQG      VAL  28 -10.332  -1.652   2.223
   58    H    ILE  29           H        ILE  29  -9.011  -5.144   3.776
   59    HA   ILE  29           HA       ILE  29  -6.129  -4.777   3.467
   60    HB   ILE  29           HB       ILE  29  -7.797  -6.874   4.894
   61   1HG1  ILE  29          2HG1      ILE  29  -8.211  -4.402   5.400
   62   2HG1  ILE  29          1HG1      ILE  29  -7.745  -5.398   6.779
   63   1HG2  ILE  29          2HG2      ILE  29  -4.883  -6.133   4.984
   64   2HG2  ILE  29          1HG2      ILE  29  -5.677  -6.770   6.424
   65   3HG2  ILE  29          3HG2      ILE  29  -5.618  -7.736   4.950
   66   1HD1  ILE  29          2HD1      ILE  29  -5.549  -4.117   5.221
   67   2HD1  ILE  29          1HD1      ILE  29  -6.530  -3.068   6.243
   68   3HD1  ILE  29          3HD1      ILE  29  -5.663  -4.430   6.952
   69    MG   ILE  29           QG2      ILE  29  -5.393  -6.880   5.453
   70    MD   ILE  29           QD1      ILE  29  -5.914  -3.872   6.138
   71    QG   ILE  29           QG1      ILE  29  -7.978  -4.900   6.089
   72    H    LEU  30           H        LEU  30  -8.389  -7.361   2.447
   73    HA   LEU  30           HA       LEU  30  -6.391  -9.281   1.606
   74   1HB   LEU  30          2HB       LEU  30  -8.841  -9.621   1.879
   75   2HB   LEU  30          1HB       LEU  30  -9.120  -8.630   0.447
   76    HG   LEU  30           HG       LEU  30  -7.614 -10.248  -0.817
   77   1HD1  LEU  30          3HD1      LEU  30  -7.526 -11.378   1.885
   78   2HD1  LEU  30          2HD1      LEU  30  -7.974 -12.567   0.663
   79   3HD1  LEU  30          1HD1      LEU  30  -6.462 -11.675   0.511
   80   1HD2  LEU  30          1HD2      LEU  30 -10.356 -10.586   0.135
   81   2HD2  LEU  30          3HD2      LEU  30  -9.696 -10.829  -1.483
   82   3HD2  LEU  30          2HD2      LEU  30  -9.608 -12.127  -0.291
   83    MD1  LEU  30           QD1      LEU  30  -7.321 -11.873   1.019
   84    MD2  LEU  30           QD2      LEU  30  -9.887 -11.181  -0.546
   85    QB   LEU  30           QB       LEU  30  -8.980  -9.126   1.163
   86    QD   LEU  30           QQD      LEU  30  -8.604 -11.527   0.237
   87    H    LEU  31           H        LEU  31  -7.977  -6.593  -0.191
   88    HA   LEU  31           HA       LEU  31  -6.679  -7.141  -2.736
   89   1HB   LEU  31          2HB       LEU  31  -8.640  -5.670  -2.298
   90   2HB   LEU  31          1HB       LEU  31  -7.573  -4.525  -1.483
   91    HG   LEU  31           HG       LEU  31  -6.208  -4.477  -3.645
   92   1HD1  LEU  31          3HD1      LEU  31  -8.486  -6.230  -4.401
   93   2HD1  LEU  31          2HD1      LEU  31  -8.002  -5.019  -5.587
   94   3HD1  LEU  31          1HD1      LEU  31  -6.833  -6.207  -5.013
   95   1HD2  LEU  31          1HD2      LEU  31  -9.074  -3.481  -3.622
   96   2HD2  LEU  31          3HD2      LEU  31  -7.658  -2.619  -3.021
   97   3HD2  LEU  31          2HD2      LEU  31  -7.837  -2.923  -4.749
   98    MD1  LEU  31           QD1      LEU  31  -7.774  -5.818  -5.000
   99    MD2  LEU  31           QD2      LEU  31  -8.189  -3.008  -3.797
  100    QB   LEU  31           QB       LEU  31  -8.107  -5.097  -1.891
  101    QD   LEU  31           QQD      LEU  31  -7.982  -4.413  -4.399
  102    H    GLY  32           H        GLY  32  -5.721  -5.075   0.050
  103   1HA   GLY  32          1HA       GLY  32  -3.602  -4.094   0.486
  104   2HA   GLY  32          2HA       GLY  32  -3.338  -4.015  -1.257
  105    QA   GLY  32           QA       GLY  32  -3.470  -4.054  -0.385
  106    H    VAL  33           H        VAL  33  -3.954  -6.934   0.705
  107    HA   VAL  33           HA       VAL  33  -1.217  -7.766   1.063
  108    HB   VAL  33           HB       VAL  33  -3.824  -9.259   0.642
  109   1HG1  VAL  33          1HG1      VAL  33  -1.062 -10.230   1.029
  110   2HG1  VAL  33          3HG1      VAL  33  -2.244 -10.914   2.144
  111   3HG1  VAL  33          2HG1      VAL  33  -2.476 -11.077   0.404
  112   1HG2  VAL  33          3HG2      VAL  33  -3.191  -7.593   2.652
  113   2HG2  VAL  33          2HG2      VAL  33  -4.134  -9.059   2.918
  114   3HG2  VAL  33          1HG2      VAL  33  -2.403  -9.049   3.257
  115    MG1  VAL  33           QG1      VAL  33  -1.927 -10.740   1.192
  116    MG2  VAL  33           QG2      VAL  33  -3.243  -8.567   2.942
  117    QG   VAL  33           QQG      VAL  33  -2.585  -9.654   2.067
  118    H    VAL  34           H        VAL  34  -3.517  -8.448  -1.617
  119    HA   VAL  34           HA       VAL  34  -1.761 -10.142  -3.162
  120    HB   VAL  34           HB       VAL  34  -3.937  -8.163  -3.891
  121   1HG1  VAL  34          2HG1      VAL  34  -2.663 -10.357  -5.555
  122   2HG1  VAL  34          1HG1      VAL  34  -4.119  -9.470  -6.003
  123   3HG1  VAL  34          3HG1      VAL  34  -2.577  -8.625  -5.873
  124   1HG2  VAL  34          1HG2      VAL  34  -4.593 -10.012  -2.384
  125   2HG2  VAL  34          3HG2      VAL  34  -5.328 -10.202  -3.976
  126   3HG2  VAL  34          2HG2      VAL  34  -3.928 -11.178  -3.529
  127    MG1  VAL  34           QG1      VAL  34  -3.120  -9.484  -5.810
  128    MG2  VAL  34           QG2      VAL  34  -4.616 -10.464  -3.296
  129    QG   VAL  34           QQG      VAL  34  -3.868  -9.974  -4.553
  130    H    GLY  35           H        GLY  35  -2.126  -6.562  -3.128
  131   1HA   GLY  35          1HA       GLY  35  -0.654  -4.935  -4.035
  132   2HA   GLY  35          2HA       GLY  35  -0.359  -6.062  -5.360
  133    QA   GLY  35           QA       GLY  35  -0.506  -5.498  -4.698
  134    H    LEU  36           H        LEU  36   0.331  -6.534  -1.872
  135    HA   LEU  36           HA       LEU  36   3.148  -5.878  -1.982
  136   1HB   LEU  36          2HB       LEU  36   1.591  -7.912  -0.353
  137   2HB   LEU  36          1HB       LEU  36   3.201  -7.322   0.057
  138    HG   LEU  36           HG       LEU  36   0.686  -5.644  -0.178
  139   1HD1  LEU  36          3HD1      LEU  36   1.607  -7.210   1.929
  140   2HD1  LEU  36          2HD1      LEU  36   2.201  -5.596   2.321
  141   3HD1  LEU  36          1HD1      LEU  36   0.477  -5.863   2.062
  142   1HD2  LEU  36          2HD2      LEU  36   3.601  -4.976   0.109
  143   2HD2  LEU  36          1HD2      LEU  36   2.363  -4.167  -0.850
  144   3HD2  LEU  36          3HD2      LEU  36   2.404  -3.950   0.899
  145    MD1  LEU  36           QD1      LEU  36   1.428  -6.223   2.104
  146    MD2  LEU  36           QD2      LEU  36   2.789  -4.364   0.053
  147    QB   LEU  36           QB       LEU  36   2.396  -7.617  -0.148
  148    QD   LEU  36           QQD      LEU  36   2.109  -5.294   1.078
  149    H    SER  37           H        SER  37   1.401  -8.919  -2.712
  150    HA   SER  37           HA       SER  37   3.685 -10.656  -2.944
  151   1HB   SER  37          2HB       SER  37   1.223 -11.186  -2.992
  152   2HB   SER  37          1HB       SER  37   1.175 -10.582  -4.646
  153    HG   SER  37           HG       SER  37   2.703 -12.749  -3.624
  154    QB   SER  37           QB       SER  37   1.199 -10.884  -3.819
  155    H    ALA  38           H        ALA  38   2.097  -8.642  -5.493
  156    HA   ALA  38           HA       ALA  38   3.840  -9.336  -7.661
  157   1HB   ALA  38          1HB       ALA  38   1.826  -7.974  -7.853
  158   2HB   ALA  38          2HB       ALA  38   3.195  -7.048  -8.470
  159   3HB   ALA  38          3HB       ALA  38   2.552  -6.706  -6.864
  160    MB   ALA  38           QB       ALA  38   2.524  -7.243  -7.729
  161    H    LEU  39           H        LEU  39   4.363  -7.110  -4.925
  162    HA   LEU  39           HA       LEU  39   7.114  -6.478  -6.077
  163   1HB   LEU  39          2HB       LEU  39   5.464  -5.174  -3.889
  164   2HB   LEU  39          1HB       LEU  39   6.970  -4.546  -4.562
  165    HG   LEU  39           HG       LEU  39   4.362  -4.956  -6.053
  166   1HD1  LEU  39          2HD1      LEU  39   5.805  -2.614  -4.881
  167   2HD1  LEU  39          1HD1      LEU  39   4.947  -2.378  -6.404
  168   3HD1  LEU  39          3HD1      LEU  39   4.073  -2.932  -4.975
  169   1HD2  LEU  39          3HD2      LEU  39   7.158  -4.660  -6.943
  170   2HD2  LEU  39          2HD2      LEU  39   5.752  -5.246  -7.832
  171   3HD2  LEU  39          1HD2      LEU  39   6.044  -3.513  -7.687
  172    MD1  LEU  39           QD1      LEU  39   4.941  -2.641  -5.420
  173    MD2  LEU  39           QD2      LEU  39   6.318  -4.473  -7.487
  174    QB   LEU  39           QB       LEU  39   6.217  -4.860  -4.226
  175    QD   LEU  39           QQD      LEU  39   5.630  -3.557  -6.454
  176    H    THR  40           H        THR  40   8.557  -8.025  -5.343
  177    HA   THR  40           HA       THR  40   8.690  -8.333  -2.323
  178    HB   THR  40           HB       THR  40   7.323 -10.170  -3.137
  179    HG1  THR  40          1HG       THR  40   8.441 -11.450  -1.931
  180   1HG2  THR  40          3HG2      THR  40   8.003 -10.030  -5.505
  181   2HG2  THR  40          2HG2      THR  40   9.586 -10.684  -5.086
  182   3HG2  THR  40          1HG2      THR  40   8.143 -11.681  -4.901
  183    MG   THR  40           QG2      THR  40   8.577 -10.798  -5.164
  184    H    GLY  41           H        GLY  41  10.376  -6.808  -4.185
  185   1HA   GLY  41          1HA       GLY  41  12.618  -7.727  -5.316
  186   2HA   GLY  41          2HA       GLY  41  12.931  -8.370  -3.702
  187    QA   GLY  41           QA       GLY  41  12.774  -8.049  -4.509
  188    H    TYR  42           H        TYR  42  14.755  -7.070  -3.267
  189    HA   TYR  42           HA       TYR  42  14.192  -4.433  -2.159
  190   1HB   TYR  42          2HB       TYR  42  16.748  -5.777  -3.097
  191   2HB   TYR  42          1HB       TYR  42  16.688  -4.358  -2.052
  192    HD1  TYR  42          1HD       TYR  42  16.427  -7.965  -2.218
  193    HD2  TYR  42          2HD       TYR  42  15.510  -4.528   0.190
  194    HE1  TYR  42          1HE       TYR  42  16.129  -9.430  -0.238
  195    HE2  TYR  42          2HE       TYR  42  15.210  -5.993   2.168
  196    HH   TYR  42           HH       TYR  42  14.604  -8.468   2.546
  197    QB   TYR  42           QB       TYR  42  16.718  -5.068  -2.574
  198    QD   TYR  42           QD       TYR  42  15.968  -6.246  -1.014
  199    QE   TYR  42           QE       TYR  42  15.669  -7.711   0.965
  200    QR   TYR  42           QR       TYR  42  15.819  -6.979  -0.024
  201    H    LEU  43           H        LEU  43  15.401  -2.394  -2.889
  202    HA   LEU  43           HA       LEU  43  16.110  -2.109  -5.728
  203   1HB   LEU  43          2HB       LEU  43  13.666  -2.590  -5.892
  204   2HB   LEU  43          1HB       LEU  43  13.346  -1.184  -4.877
  205    HG   LEU  43           HG       LEU  43  14.634   0.190  -6.596
  206   1HD1  LEU  43          2HD1      LEU  43  14.649  -2.510  -7.849
  207   2HD1  LEU  43          1HD1      LEU  43  14.329  -1.146  -8.921
  208   3HD1  LEU  43          3HD1      LEU  43  15.822  -1.200  -7.986
  209   1HD2  LEU  43          2HD2      LEU  43  11.946  -0.898  -6.675
  210   2HD2  LEU  43          1HD2      LEU  43  12.498   0.726  -7.087
  211   3HD2  LEU  43          3HD2      LEU  43  12.522  -0.550  -8.305
  212    MD1  LEU  43           QD1      LEU  43  14.934  -1.618  -8.252
  213    MD2  LEU  43           QD2      LEU  43  12.322  -0.241  -7.356
  214    QB   LEU  43           QB       LEU  43  13.506  -1.887  -5.385
  215    QD   LEU  43           QQD      LEU  43  13.628  -0.930  -7.804
  216    H    ASP  44           H        ASP  44  17.369  -0.278  -5.837
  217    HA   ASP  44           HA       ASP  44  17.593   1.488  -3.503
  218   1HB   ASP  44          2HB       ASP  44  19.082   2.732  -5.065
  219   2HB   ASP  44          1HB       ASP  44  19.394   0.996  -5.104
  220    QB   ASP  44           QB       ASP  44  19.238   1.864  -5.084
  221    H    TYR  45           H        TYR  45  17.599   4.055  -4.174
  222    HA   TYR  45           HA       TYR  45  14.702   4.543  -4.968
  223   1HB   TYR  45          2HB       TYR  45  14.886   6.459  -3.574
  224   2HB   TYR  45          1HB       TYR  45  15.807   5.217  -2.727
  225    HD1  TYR  45          1HD       TYR  45  18.275   5.233  -2.752
  226    HD2  TYR  45          2HD       TYR  45  15.985   8.347  -4.628
  227    HE1  TYR  45          1HE       TYR  45  20.304   6.654  -2.870
  228    HE2  TYR  45          2HE       TYR  45  18.014   9.768  -4.745
  229    HH   TYR  45           HH       TYR  45  20.182   9.913  -4.319
  230    QB   TYR  45           QB       TYR  45  15.346   5.838  -3.151
  231    QD   TYR  45           QD       TYR  45  17.130   6.790  -3.690
  232    QE   TYR  45           QE       TYR  45  19.159   8.211  -3.807
  233    QR   TYR  45           QR       TYR  45  18.145   7.500  -3.749
  234    H    VAL  46           H        VAL  46  14.255   5.509  -6.905
  235    HA   VAL  46           HA       VAL  46  16.600   6.539  -8.502
  236    HB   VAL  46           HB       VAL  46  14.594   4.974  -9.184
  237   1HG1  VAL  46          1HG1      VAL  46  13.093   7.063  -8.371
  238   2HG1  VAL  46          3HG1      VAL  46  13.293   7.500 -10.068
  239   3HG1  VAL  46          2HG1      VAL  46  12.567   5.951  -9.636
  240   1HG2  VAL  46          3HG2      VAL  46  16.260   6.848 -10.587
  241   2HG2  VAL  46          2HG2      VAL  46  15.614   5.312 -11.165
  242   3HG2  VAL  46          1HG2      VAL  46  14.681   6.795 -11.372
  243    MG1  VAL  46           QG1      VAL  46  12.984   6.838  -9.358
  244    MG2  VAL  46           QG2      VAL  46  15.518   6.318 -11.041
  245    QG   VAL  46           QQG      VAL  46  14.251   6.578 -10.200
  246    H    LEU  47           H        LEU  47  15.023   8.381 -10.100
  247    HA   LEU  47           HA       LEU  47  15.494  10.823  -8.606
  248   1HB   LEU  47          2HB       LEU  47  15.361  10.528 -11.078
  249   2HB   LEU  47          1HB       LEU  47  13.623  10.262 -10.931
  250    HG   LEU  47           HG       LEU  47  13.502  12.532  -9.777
  251   1HD1  LEU  47          1HD1      LEU  47  16.378  12.308 -10.315
  252   2HD1  LEU  47          3HD1      LEU  47  15.681  13.822 -10.890
  253   3HD1  LEU  47          2HD1      LEU  47  15.525  13.368  -9.193
  254   1HD2  LEU  47          2HD2      LEU  47  13.535  11.815 -12.495
  255   2HD2  LEU  47          1HD2      LEU  47  12.850  13.285 -11.804
  256   3HD2  LEU  47          3HD2      LEU  47  14.511  13.280 -12.398
  257    MD1  LEU  47           QD1      LEU  47  15.861  13.166 -10.133
  258    MD2  LEU  47           QD2      LEU  47  13.632  12.793 -12.232
  259    QB   LEU  47           QB       LEU  47  14.492  10.395 -11.005
  260    QD   LEU  47           QQD      LEU  47  14.746  12.980 -11.183
  261    H    LEU  48           H        LEU  48  12.464   8.987  -9.254
  262    HA   LEU  48           HA       LEU  48  11.218  10.582  -6.965
  263   1HB   LEU  48          2HB       LEU  48  10.621  11.024  -9.511
  264   2HB   LEU  48          1HB       LEU  48   9.633   9.577  -9.304
  265    HG   LEU  48           HG       LEU  48   8.688  10.706  -7.207
  266   1HD1  LEU  48          1HD1      LEU  48  10.662  12.623  -7.952
  267   2HD1  LEU  48          3HD1      LEU  48   9.082  13.379  -8.158
  268   3HD1  LEU  48          2HD1      LEU  48   9.536  12.697  -6.597
  269   1HD2  LEU  48          2HD2      LEU  48   7.754  10.621  -9.699
  270   2HD2  LEU  48          1HD2      LEU  48   6.946  11.588  -8.464
  271   3HD2  LEU  48          3HD2      LEU  48   8.033  12.360  -9.618
  272    MD1  LEU  48           QD1      LEU  48   9.760  12.900  -7.569
  273    MD2  LEU  48           QD2      LEU  48   7.578  11.523  -9.260
  274    QB   LEU  48           QB       LEU  48  10.127  10.301  -9.408
  275    QD   LEU  48           QQD      LEU  48   8.669  12.211  -8.415
  276    HA   PRO  49           HA       PRO  49  10.766   6.277  -5.707
  277   1HB   PRO  49          2HB       PRO  49  10.008   6.862  -3.141
  278   2HB   PRO  49          1HB       PRO  49  11.702   6.872  -3.673
  279   1HG   PRO  49          2HG       PRO  49   9.822   9.157  -3.305
  280   2HG   PRO  49          1HG       PRO  49  11.539   9.032  -2.885
  281   1HD   PRO  49          2HD       PRO  49  10.663  10.332  -5.096
  282   2HD   PRO  49          1HD       PRO  49  12.236   9.504  -5.024
  283    QB   PRO  49           QB       PRO  49  10.855   6.867  -3.407
  284    QG   PRO  49           QG       PRO  49  10.681   9.095  -3.095
  285    QD   PRO  49           QD       PRO  49  11.449   9.918  -5.060
  286    H    ALA  50           H        ALA  50   8.837   6.810  -7.377
  287    HA   ALA  50           HA       ALA  50   6.235   7.534  -6.291
  288   1HB   ALA  50          2HB       ALA  50   7.409   6.206  -8.676
  289   2HB   ALA  50          3HB       ALA  50   6.264   7.545  -8.586
  290   3HB   ALA  50          1HB       ALA  50   5.697   5.887  -8.387
  291    MB   ALA  50           QB       ALA  50   6.457   6.546  -8.549
  292    H    LEU  51           H        LEU  51   8.042   4.468  -6.390
  293    HA   LEU  51           HA       LEU  51   5.784   2.730  -5.731
  294   1HB   LEU  51          2HB       LEU  51   8.009   2.065  -6.640
  295   2HB   LEU  51          1HB       LEU  51   8.746   2.498  -5.098
  296    HG   LEU  51           HG       LEU  51   7.149   0.852  -4.000
  297   1HD1  LEU  51          3HD1      LEU  51   6.003   0.851  -6.553
  298   2HD1  LEU  51          2HD1      LEU  51   6.820  -0.707  -6.436
  299   3HD1  LEU  51          1HD1      LEU  51   5.614  -0.252  -5.233
  300   1HD2  LEU  51          3HD2      LEU  51   9.321   0.075  -5.934
  301   2HD2  LEU  51          2HD2      LEU  51   9.349   0.060  -4.172
  302   3HD2  LEU  51          1HD2      LEU  51   8.447  -1.175  -5.049
  303    MD1  LEU  51           QD1      LEU  51   6.146  -0.036  -6.074
  304    MD2  LEU  51           QD2      LEU  51   9.039  -0.347  -5.052
  305    QB   LEU  51           QB       LEU  51   8.377   2.282  -5.869
  306    QD   LEU  51           QQD      LEU  51   7.592  -0.191  -5.563
  307    H    ALA  52           H        ALA  52   8.353   4.198  -3.659
  308    HA   ALA  52           HA       ALA  52   7.348   3.227  -1.140
  309   1HB   ALA  52          2HB       ALA  52   8.603   5.223  -0.277
  310   2HB   ALA  52          3HB       ALA  52   8.721   5.814  -1.935
  311   3HB   ALA  52          1HB       ALA  52   9.510   4.305  -1.479
  312    MB   ALA  52           QB       ALA  52   8.945   5.114  -1.230
  313    H    ILE  53           H        ILE  53   6.566   6.263  -2.917
  314    HA   ILE  53           HA       ILE  53   4.675   7.241  -0.914
  315    HB   ILE  53           HB       ILE  53   4.903   7.653  -3.914
  316   1HG1  ILE  53          2HG1      ILE  53   5.991   9.294  -1.605
  317   2HG1  ILE  53          1HG1      ILE  53   6.951   8.162  -2.557
  318   1HG2  ILE  53          1HG2      ILE  53   3.012   8.643  -1.950
  319   2HG2  ILE  53          3HG2      ILE  53   3.944   9.971  -2.642
  320   3HG2  ILE  53          2HG2      ILE  53   3.032   8.891  -3.697
  321   1HD1  ILE  53          1HD1      ILE  53   5.459  10.550  -3.684
  322   2HD1  ILE  53          3HD1      ILE  53   7.195  10.494  -3.375
  323   3HD1  ILE  53          2HD1      ILE  53   6.482   9.439  -4.596
  324    MG   ILE  53           QG2      ILE  53   3.329   9.168  -2.763
  325    MD   ILE  53           QD1      ILE  53   6.378  10.161  -3.885
  326    QG   ILE  53           QG1      ILE  53   6.471   8.728  -2.081
  327    H    PHE  54           H        PHE  54   4.241   5.338  -3.941
  328    HA   PHE  54           HA       PHE  54   1.378   5.179  -3.904
  329   1HB   PHE  54          2HB       PHE  54   2.975   4.398  -5.658
  330   2HB   PHE  54          1HB       PHE  54   3.409   3.040  -4.621
  331    HD1  PHE  54          1HD       PHE  54   0.666   4.592  -6.575
  332    HD2  PHE  54          2HD       PHE  54   1.948   1.148  -4.349
  333    HE1  PHE  54          1HE       PHE  54  -1.282   3.315  -7.427
  334    HE2  PHE  54          2HE       PHE  54   0.000  -0.128  -5.202
  335    HZ   PHE  54           HZ       PHE  54  -1.614   0.955  -6.741
  336    QB   PHE  54           QB       PHE  54   3.192   3.719  -5.139
  337    QD   PHE  54           QD       PHE  54   1.307   2.870  -5.462
  338    QE   PHE  54           QE       PHE  54  -0.641   1.593  -6.314
  339    QR   PHE  54           QR       PHE  54  -0.056   1.976  -6.059
  340    H    ILE  55           H        ILE  55   3.782   3.039  -2.270
  341    HA   ILE  55           HA       ILE  55   1.803   1.268  -1.076
  342    HB   ILE  55           HB       ILE  55   4.568   2.160  -0.195
  343   1HG1  ILE  55          2HG1      ILE  55   3.687  -0.285  -1.762
  344   2HG1  ILE  55          1HG1      ILE  55   4.367   1.168  -2.497
  345   1HG2  ILE  55          2HG2      ILE  55   2.622   0.260   0.930
  346   2HG2  ILE  55          1HG2      ILE  55   4.215  -0.440   0.642
  347   3HG2  ILE  55          3HG2      ILE  55   4.051   0.981   1.674
  348   1HD1  ILE  55          2HD1      ILE  55   6.348   0.844  -0.878
  349   2HD1  ILE  55          1HD1      ILE  55   5.709  -0.781  -0.622
  350   3HD1  ILE  55          3HD1      ILE  55   6.225  -0.280  -2.231
  351    MG   ILE  55           QG2      ILE  55   3.630   0.267   1.082
  352    MD   ILE  55           QD1      ILE  55   6.094  -0.072  -1.244
  353    QG   ILE  55           QG1      ILE  55   4.027   0.442  -2.129
  354    H    GLY  56           H        GLY  56   3.419   4.235   0.177
  355   1HA   GLY  56          1HA       GLY  56   2.674   5.678   1.908
  356   2HA   GLY  56          2HA       GLY  56   2.210   4.217   2.780
  357    QA   GLY  56           QA       GLY  56   2.442   4.947   2.344
  358    H    LEU  57           H        LEU  57   0.996   5.816  -0.226
  359    HA   LEU  57           HA       LEU  57  -1.538   6.635   0.948
  360   1HB   LEU  57          2HB       LEU  57  -0.743   5.872  -1.881
  361   2HB   LEU  57          1HB       LEU  57  -2.185   6.794  -1.454
  362    HG   LEU  57           HG       LEU  57   0.686   7.616  -0.933
  363   1HD1  LEU  57          2HD1      LEU  57  -1.437   8.439  -2.906
  364   2HD1  LEU  57          1HD1      LEU  57  -0.173   9.571  -2.427
  365   3HD1  LEU  57          3HD1      LEU  57   0.256   8.047  -3.205
  366   1HD2  LEU  57          1HD2      LEU  57  -1.924   8.539   0.128
  367   2HD2  LEU  57          3HD2      LEU  57  -0.308   8.707   0.815
  368   3HD2  LEU  57          2HD2      LEU  57  -0.849   9.815  -0.445
  369    MD1  LEU  57           QD1      LEU  57  -0.451   8.686  -2.846
  370    MD2  LEU  57           QD2      LEU  57  -1.027   9.020   0.166
  371    QB   LEU  57           QB       LEU  57  -1.464   6.333  -1.667
  372    QD   LEU  57           QQD      LEU  57  -0.739   8.853  -1.340
  373    H    THR  58           H        THR  58  -0.496   3.617  -0.676
  374    HA   THR  58           HA       THR  58  -3.146   2.412  -0.828
  375    HB   THR  58           HB       THR  58  -0.371   1.222  -0.520
  376    HG1  THR  58          1HG       THR  58  -0.134   1.778  -2.516
  377   1HG2  THR  58          3HG2      THR  58  -2.983   0.011  -0.693
  378   2HG2  THR  58          2HG2      THR  58  -2.036  -0.394  -2.125
  379   3HG2  THR  58          1HG2      THR  58  -1.411  -0.769  -0.519
  380    MG   THR  58           QG2      THR  58  -2.143  -0.384  -1.112
  381    H    ILE  59           H        ILE  59  -0.503   2.004   1.597
  382    HA   ILE  59           HA       ILE  59  -2.105   0.335   3.382
  383    HB   ILE  59           HB       ILE  59   0.271   2.165   3.842
  384   1HG1  ILE  59          2HG1      ILE  59   0.128  -0.817   3.286
  385   2HG1  ILE  59          1HG1      ILE  59   0.536   0.402   2.079
  386   1HG2  ILE  59          3HG2      ILE  59  -1.279   0.434   5.620
  387   2HG2  ILE  59          2HG2      ILE  59   0.427  -0.010   5.568
  388   3HG2  ILE  59          1HG2      ILE  59  -0.044   1.628   6.019
  389   1HD1  ILE  59          3HD1      ILE  59   2.045   0.158   4.686
  390   2HD1  ILE  59          2HD1      ILE  59   2.512  -0.745   3.244
  391   3HD1  ILE  59          1HD1      ILE  59   2.532   1.019   3.227
  392    MG   ILE  59           QG2      ILE  59  -0.299   0.684   5.736
  393    MD   ILE  59           QD1      ILE  59   2.363   0.144   3.719
  394    QG   ILE  59           QG1      ILE  59   0.332  -0.208   2.683
  395    H    TYR  60           H        TYR  60  -1.453   3.889   3.337
  396    HA   TYR  60           HA       TYR  60  -2.878   4.489   5.791
  397   1HB   TYR  60          2HB       TYR  60  -2.171   5.901   3.233
  398   2HB   TYR  60          1HB       TYR  60  -3.245   6.711   4.372
  399    HD1  TYR  60          1HD       TYR  60  -0.208   4.532   4.734
  400    HD2  TYR  60          2HD       TYR  60  -2.098   8.276   5.663
  401    HE1  TYR  60          1HE       TYR  60   1.756   5.184   6.098
  402    HE2  TYR  60          2HE       TYR  60  -0.132   8.928   7.031
  403    HH   TYR  60           HH       TYR  60   2.745   7.694   6.812
  404    QB   TYR  60           QB       TYR  60  -2.708   6.306   3.803
  405    QD   TYR  60           QD       TYR  60  -1.153   6.404   5.199
  406    QE   TYR  60           QE       TYR  60   0.812   7.056   6.564
  407    QR   TYR  60           QR       TYR  60  -0.170   6.730   5.882
  408    H    ALA  61           H        ALA  61  -4.024   4.492   2.370
  409    HA   ALA  61           HA       ALA  61  -6.782   5.126   2.952
  410   1HB   ALA  61          1HB       ALA  61  -7.009   3.722   0.729
  411   2HB   ALA  61          3HB       ALA  61  -6.100   5.235   0.721
  412   3HB   ALA  61          2HB       ALA  61  -5.248   3.694   0.808
  413    MB   ALA  61           QB       ALA  61  -6.119   4.217   0.752
  414    H    ILE  62           H        ILE  62  -5.108   1.947   2.787
  415    HA   ILE  62           HA       ILE  62  -7.511   0.346   3.126
  416    HB   ILE  62           HB       ILE  62  -4.583  -0.014   3.792
  417   1HG1  ILE  62          2HG1      ILE  62  -6.260  -1.285   1.617
  418   2HG1  ILE  62          1HG1      ILE  62  -5.433   0.258   1.390
  419   1HG2  ILE  62          2HG2      ILE  62  -6.885  -1.675   4.496
  420   2HG2  ILE  62          1HG2      ILE  62  -5.717  -2.540   3.497
  421   3HG2  ILE  62          3HG2      ILE  62  -5.207  -1.810   5.020
  422   1HD1  ILE  62          1HD1      ILE  62  -3.283  -0.811   1.955
  423   2HD1  ILE  62          3HD1      ILE  62  -4.107  -2.354   2.170
  424   3HD1  ILE  62          2HD1      ILE  62  -4.042  -1.605   0.574
  425    MG   ILE  62           QG2      ILE  62  -5.936  -2.008   4.338
  426    MD   ILE  62           QD1      ILE  62  -3.811  -1.590   1.566
  427    QG   ILE  62           QG1      ILE  62  -5.847  -0.513   1.503
  428    H    GLN  63           H        GLN  63  -5.156   1.617   5.551
  429    HA   GLN  63           HA       GLN  63  -6.483   0.423   7.851
  430   1HB   GLN  63          2HB       GLN  63  -4.826   2.935   7.471
  431   2HB   GLN  63          1HB       GLN  63  -5.211   2.237   9.046
  432   1HG   GLN  63          2HG       GLN  63  -4.145   0.106   8.334
  433   2HG   GLN  63          1HG       GLN  63  -3.693   0.866   6.808
  434   1HE2  GLN  63          1HE2      GLN  63  -1.839   2.205   6.735
  435   2HE2  GLN  63          2HE2      GLN  63  -0.867   2.578   8.206
  436    QB   GLN  63           QB       GLN  63  -5.018   2.586   8.258
  437    QG   GLN  63           QG       GLN  63  -3.919   0.486   7.571
  438    QE   GLN  63           QE2      GLN  63  -1.353   2.391   7.470
  439    H    ARG  64           H        ARG  64  -6.888   3.612   6.238
  440    HA   ARG  64           HA       ARG  64  -8.836   4.624   8.166
  441   1HB   ARG  64          2HB       ARG  64  -7.509   5.909   6.480
  442   2HB   ARG  64          1HB       ARG  64  -8.495   5.193   5.204
  443   1HG   ARG  64          2HG       ARG  64 -10.528   6.149   6.292
  444   2HG   ARG  64          1HG       ARG  64  -9.485   6.948   7.470
  445   1HD   ARG  64          2HD       ARG  64  -9.370   7.371   4.460
  446   2HD   ARG  64          1HD       ARG  64 -10.054   8.508   5.638
  447    HE   ARG  64           HE       ARG  64  -7.124   7.749   5.416
  448   1HH1  ARG  64          1HH1      ARG  64  -8.890  10.483   5.347
  449   2HH1  ARG  64          2HH1      ARG  64  -8.250  11.234   6.770
  450   1HH2  ARG  64          1HH2      ARG  64  -6.710   8.349   7.922
  451   2HH2  ARG  64          2HH2      ARG  64  -7.016  10.026   8.229
  452    QB   ARG  64           QB       ARG  64  -8.002   5.551   5.842
  453    QG   ARG  64           QG       ARG  64 -10.007   6.549   6.881
  454    QD   ARG  64           QD       ARG  64  -9.712   7.939   5.049
  455    QH1  ARG  64           QH1      ARG  64  -8.570  10.858   6.059
  456    QH2  ARG  64           QH2      ARG  64  -6.863   9.188   8.075
  457    H    LYS  65           H        LYS  65  -9.269   3.140   4.901
  458    HA   LYS  65           HA       LYS  65 -12.150   3.043   4.979
  459   1HB   LYS  65          2HB       LYS  65 -10.061   1.212   3.754
  460   2HB   LYS  65          1HB       LYS  65 -11.768   1.196   3.312
  461   1HG   LYS  65          2HG       LYS  65  -9.997   3.649   3.143
  462   2HG   LYS  65          1HG       LYS  65 -10.357   2.594   1.776
  463   1HD   LYS  65          2HD       LYS  65 -12.809   3.019   2.199
  464   2HD   LYS  65          1HD       LYS  65 -12.332   4.231   3.389
  465   1HE   LYS  65          2HE       LYS  65 -12.373   5.664   1.601
  466   2HE   LYS  65          1HE       LYS  65 -10.796   4.947   1.211
  467   1HZ   LYS  65          1HZ       LYS  65 -12.056   3.145   0.054
  468   2HZ   LYS  65          3HZ       LYS  65 -13.463   4.073   0.241
  469   3HZ   LYS  65          2HZ       LYS  65 -12.172   4.668  -0.690
  470    QB   LYS  65           QB       LYS  65 -10.915   1.204   3.533
  471    QD   LYS  65           QD       LYS  65 -12.570   3.625   2.794
  472    QG   LYS  65           QG       LYS  65 -10.177   3.122   2.459
  473    QE   LYS  65           QE       LYS  65 -11.585   5.306   1.406
  474    QZ   LYS  65           QZ       LYS  65 -12.563   3.962  -0.132
  475    H    ARG  66           H        ARG  66  -9.747   0.535   5.975
  476    HA   ARG  66           HA       ARG  66 -11.646  -1.413   6.918
  477   1HB   ARG  66          2HB       ARG  66  -9.169  -1.640   6.648
  478   2HB   ARG  66          1HB       ARG  66  -8.950  -0.633   8.080
  479   1HG   ARG  66          2HG       ARG  66 -10.177  -2.264   9.443
  480   2HG   ARG  66          1HG       ARG  66 -10.461  -3.262   8.018
  481   1HD   ARG  66          2HD       ARG  66  -8.559  -4.205   9.194
  482   2HD   ARG  66          1HD       ARG  66  -7.924  -3.394   7.749
  483    HE   ARG  66           HE       ARG  66  -8.130  -1.567  10.078
  484   1HH1  ARG  66          1HH1      ARG  66  -5.990  -0.480   9.561
  485   2HH1  ARG  66          2HH1      ARG  66  -4.590  -1.489   9.713
  486   1HH2  ARG  66          1HH2      ARG  66  -6.399  -4.447   9.755
  487   2HH2  ARG  66          2HH2      ARG  66  -4.822  -3.735   9.823
  488    QB   ARG  66           QB       ARG  66  -9.059  -1.137   7.364
  489    QG   ARG  66           QG       ARG  66 -10.319  -2.763   8.731
  490    QD   ARG  66           QD       ARG  66  -8.241  -3.800   8.471
  491    QH1  ARG  66           QH1      ARG  66  -5.290  -0.985   9.637
  492    QH2  ARG  66           QH2      ARG  66  -5.611  -4.091   9.789
  493    H    GLN  67           H        GLN  67 -10.242   1.455   8.556
  494    HA   GLN  67           HA       GLN  67 -12.593   1.482  10.421
  495   1HB   GLN  67          2HB       GLN  67 -11.235   1.178  12.420
  496   2HB   GLN  67          1HB       GLN  67 -10.939  -0.186  11.340
  497   1HG   GLN  67          2HG       GLN  67  -8.939   1.088  10.442
  498   2HG   GLN  67          1HG       GLN  67  -9.179   2.243  11.752
  499   1HE2  GLN  67          1HE2      GLN  67  -7.334   1.779  13.046
  500   2HE2  GLN  67          2HE2      GLN  67  -7.074   0.154  13.778
  501    QB   GLN  67           QB       GLN  67 -11.087   0.496  11.880
  502    QG   GLN  67           QG       GLN  67  -9.059   1.665  11.097
  503    QE   GLN  67           QE2      GLN  67  -7.204   0.967  13.412
  504    H    ALA  68           H        ALA  68 -12.785   3.521  11.536
  505    HA   ALA  68           HA       ALA  68 -10.791   5.596  10.499
  506   1HB   ALA  68          3HB       ALA  68 -13.530   6.388  11.308
  507   2HB   ALA  68          1HB       ALA  68 -13.437   5.329   9.901
  508   3HB   ALA  68          2HB       ALA  68 -12.590   6.877   9.899
  509    MB   ALA  68           QB       ALA  68 -13.186   6.198  10.369
  510    H    ASP  69           H        ASP  69 -10.119   7.239  11.959
  511    HA   ASP  69           HA       ASP  69  -9.915   6.491  14.745
  512   1HB   ASP  69          2HB       ASP  69  -8.538   8.124  13.409
  513   2HB   ASP  69          1HB       ASP  69  -9.883   9.262  13.505
  514    QB   ASP  69           QB       ASP  69  -9.210   8.693  13.457

  No H/Q in entry =         514
  Start of MODEL   13
    1    H    THR  24           H        THR  24 -18.151  -3.595   7.678
    2    HA   THR  24           HA       THR  24 -15.647  -2.647   7.670
    3    HB   THR  24           HB       THR  24 -14.813  -4.960   8.245
    4    HG1  THR  24          1HG       THR  24 -17.439  -5.786   7.645
    5   1HG2  THR  24          3HG2      THR  24 -17.075  -3.526   9.377
    6   2HG2  THR  24          2HG2      THR  24 -17.170  -5.254   9.719
    7   3HG2  THR  24          1HG2      THR  24 -15.742  -4.338  10.200
    8    MG   THR  24           QG2      THR  24 -16.662  -4.373   9.765
    9    HA   PRO  25           HA       PRO  25 -14.290  -3.146   3.451
   10   1HB   PRO  25          2HB       PRO  25 -12.112  -1.515   3.639
   11   2HB   PRO  25          1HB       PRO  25 -13.769  -0.890   3.515
   12   1HG   PRO  25          2HG       PRO  25 -12.014  -1.136   5.898
   13   2HG   PRO  25          1HG       PRO  25 -13.188   0.122   5.483
   14   1HD   PRO  25          2HD       PRO  25 -13.646  -1.917   7.281
   15   2HD   PRO  25          1HD       PRO  25 -14.919  -1.014   6.429
   16    QB   PRO  25           QB       PRO  25 -12.940  -1.202   3.577
   17    QG   PRO  25           QG       PRO  25 -12.601  -0.507   5.691
   18    QD   PRO  25           QD       PRO  25 -14.283  -1.466   6.855
   19    H    VAL  26           H        VAL  26 -13.778  -5.334   5.087
   20    HA   VAL  26           HA       VAL  26 -10.898  -5.807   5.445
   21    HB   VAL  26           HB       VAL  26 -13.343  -7.579   5.172
   22   1HG1  VAL  26          2HG1      VAL  26 -10.472  -8.220   5.870
   23   2HG1  VAL  26          1HG1      VAL  26 -11.809  -9.242   6.400
   24   3HG1  VAL  26          3HG1      VAL  26 -11.506  -9.006   4.678
   25   1HG2  VAL  26          3HG2      VAL  26 -11.998  -6.091   7.364
   26   2HG2  VAL  26          2HG2      VAL  26 -13.696  -6.535   7.183
   27   3HG2  VAL  26          1HG2      VAL  26 -12.529  -7.727   7.757
   28    MG1  VAL  26           QG1      VAL  26 -11.262  -8.823   5.649
   29    MG2  VAL  26           QG2      VAL  26 -12.741  -6.785   7.435
   30    QG   VAL  26           QQG      VAL  26 -12.002  -7.804   6.542
   31    H    LEU  27           H        LEU  27 -13.192  -6.247   2.766
   32    HA   LEU  27           HA       LEU  27 -11.654  -8.091   1.165
   33   1HB   LEU  27          2HB       LEU  27 -14.026  -6.893   0.987
   34   2HB   LEU  27          1HB       LEU  27 -13.131  -5.787  -0.056
   35    HG   LEU  27           HG       LEU  27 -14.086  -7.566  -1.420
   36   1HD1  LEU  27          3HD1      LEU  27 -11.641  -6.704  -1.715
   37   2HD1  LEU  27          2HD1      LEU  27 -11.182  -8.304  -1.134
   38   3HD1  LEU  27          1HD1      LEU  27 -12.142  -8.141  -2.605
   39   1HD2  LEU  27          3HD2      LEU  27 -13.818  -9.143   0.779
   40   2HD2  LEU  27          2HD2      LEU  27 -14.057  -9.783  -0.847
   41   3HD2  LEU  27          1HD2      LEU  27 -12.433  -9.688  -0.167
   42    MD1  LEU  27           QD1      LEU  27 -11.655  -7.716  -1.818
   43    MD2  LEU  27           QD2      LEU  27 -13.436  -9.538  -0.078
   44    QB   LEU  27           QB       LEU  27 -13.579  -6.340   0.465
   45    QD   LEU  27           QQD      LEU  27 -12.545  -8.627  -0.948
   46    H    VAL  28           H        VAL  28 -11.358  -4.577   1.638
   47    HA   VAL  28           HA       VAL  28  -9.677  -3.977  -0.625
   48    HB   VAL  28           HB       VAL  28  -9.230  -1.984   0.614
   49   1HG1  VAL  28          3HG1      VAL  28 -11.765  -2.915   0.319
   50   2HG1  VAL  28          2HG1      VAL  28 -11.719  -2.682   2.067
   51   3HG1  VAL  28          1HG1      VAL  28 -11.387  -1.326   0.987
   52   1HG2  VAL  28          1HG2      VAL  28  -9.551  -3.813   2.986
   53   2HG2  VAL  28          3HG2      VAL  28  -8.221  -2.721   2.604
   54   3HG2  VAL  28          2HG2      VAL  28  -9.759  -2.072   3.174
   55    MG1  VAL  28           QG1      VAL  28 -11.624  -2.308   1.124
   56    MG2  VAL  28           QG2      VAL  28  -9.177  -2.869   2.922
   57    QG   VAL  28           QQG      VAL  28 -10.400  -2.588   2.023
   58    H    ILE  29           H        ILE  29  -8.898  -5.404   2.554
   59    HA   ILE  29           HA       ILE  29  -6.005  -5.099   2.355
   60    HB   ILE  29           HB       ILE  29  -7.766  -7.181   3.691
   61   1HG1  ILE  29          2HG1      ILE  29  -8.334  -4.903   4.365
   62   2HG1  ILE  29          1HG1      ILE  29  -7.461  -5.693   5.679
   63   1HG2  ILE  29          2HG2      ILE  29  -4.844  -6.491   3.916
   64   2HG2  ILE  29          1HG2      ILE  29  -5.712  -7.151   5.303
   65   3HG2  ILE  29          3HG2      ILE  29  -5.600  -8.081   3.809
   66   1HD1  ILE  29          3HD1      ILE  29  -5.419  -4.592   4.179
   67   2HD1  ILE  29          2HD1      ILE  29  -6.689  -3.374   4.053
   68   3HD1  ILE  29          1HD1      ILE  29  -6.105  -3.879   5.639
   69    MG   ILE  29           QG2      ILE  29  -5.385  -7.241   4.343
   70    MD   ILE  29           QD1      ILE  29  -6.071  -3.948   4.623
   71    QG   ILE  29           QG1      ILE  29  -7.898  -5.298   5.022
   72    H    LEU  30           H        LEU  30  -8.264  -7.633   1.217
   73    HA   LEU  30           HA       LEU  30  -6.250  -9.566   0.426
   74   1HB   LEU  30          2HB       LEU  30  -8.717  -9.881   0.638
   75   2HB   LEU  30          1HB       LEU  30  -8.939  -8.906  -0.815
   76    HG   LEU  30           HG       LEU  30  -7.405 -10.551  -2.006
   77   1HD1  LEU  30          3HD1      LEU  30  -7.872 -12.025   0.597
   78   2HD1  LEU  30          2HD1      LEU  30  -7.349 -12.830  -0.882
   79   3HD1  LEU  30          1HD1      LEU  30  -6.325 -11.604  -0.136
   80   1HD2  LEU  30          3HD2      LEU  30 -10.056 -10.516  -1.818
   81   2HD2  LEU  30          2HD2      LEU  30  -9.228 -11.851  -2.620
   82   3HD2  LEU  30          1HD2      LEU  30  -9.789 -12.032  -0.957
   83    MD1  LEU  30           QD1      LEU  30  -7.182 -12.153  -0.140
   84    MD2  LEU  30           QD2      LEU  30  -9.691 -11.466  -1.799
   85    QB   LEU  30           QB       LEU  30  -8.828  -9.393  -0.088
   86    QD   LEU  30           QQD      LEU  30  -8.437 -11.809  -0.969
   87    H    LEU  31           H        LEU  31  -7.780  -6.859  -1.388
   88    HA   LEU  31           HA       LEU  31  -6.431  -7.400  -3.908
   89   1HB   LEU  31          2HB       LEU  31  -8.365  -5.767  -3.050
   90   2HB   LEU  31          1HB       LEU  31  -7.027  -4.618  -2.981
   91    HG   LEU  31           HG       LEU  31  -7.986  -4.430  -5.176
   92   1HD1  LEU  31          3HD1      LEU  31  -5.445  -4.606  -4.933
   93   2HD1  LEU  31          2HD1      LEU  31  -5.603  -6.260  -5.523
   94   3HD1  LEU  31          1HD1      LEU  31  -6.091  -4.910  -6.547
   95   1HD2  LEU  31          3HD2      LEU  31  -9.019  -6.823  -4.923
   96   2HD2  LEU  31          2HD2      LEU  31  -8.598  -6.244  -6.535
   97   3HD2  LEU  31          1HD2      LEU  31  -7.525  -7.361  -5.691
   98    MD1  LEU  31           QD1      LEU  31  -5.713  -5.259  -5.668
   99    MD2  LEU  31           QD2      LEU  31  -8.380  -6.809  -5.716
  100    QB   LEU  31           QB       LEU  31  -7.696  -5.193  -3.016
  101    QD   LEU  31           QQD      LEU  31  -7.047  -6.034  -5.692
  102    H    GLY  32           H        GLY  32  -5.527  -5.327  -1.105
  103   1HA   GLY  32          1HA       GLY  32  -3.410  -4.364  -0.620
  104   2HA   GLY  32          2HA       GLY  32  -3.091  -4.312  -2.355
  105    QA   GLY  32           QA       GLY  32  -3.251  -4.338  -1.487
  106    H    VAL  33           H        VAL  33  -3.809  -7.201  -0.385
  107    HA   VAL  33           HA       VAL  33  -1.103  -8.069   0.083
  108    HB   VAL  33           HB       VAL  33  -3.706  -9.533  -0.449
  109   1HG1  VAL  33          2HG1      VAL  33  -1.067 -10.559   0.636
  110   2HG1  VAL  33          1HG1      VAL  33  -2.592 -11.435   0.763
  111   3HG1  VAL  33          3HG1      VAL  33  -1.895 -11.102  -0.823
  112   1HG2  VAL  33          3HG2      VAL  33  -3.105  -7.867   1.592
  113   2HG2  VAL  33          2HG2      VAL  33  -4.135  -9.284   1.794
  114   3HG2  VAL  33          1HG2      VAL  33  -2.429  -9.363   2.233
  115    MG1  VAL  33           QG1      VAL  33  -1.851 -11.032   0.192
  116    MG2  VAL  33           QG2      VAL  33  -3.223  -8.838   1.873
  117    QG   VAL  33           QQG      VAL  33  -2.537  -9.935   1.033
  118    H    VAL  34           H        VAL  34  -3.296  -8.739  -2.690
  119    HA   VAL  34           HA       VAL  34  -1.490 -10.445  -4.159
  120    HB   VAL  34           HB       VAL  34  -3.624  -8.452  -4.971
  121   1HG1  VAL  34          3HG1      VAL  34  -1.812 -10.101  -6.588
  122   2HG1  VAL  34          2HG1      VAL  34  -3.516 -10.405  -6.928
  123   3HG1  VAL  34          1HG1      VAL  34  -2.863  -8.773  -7.080
  124   1HG2  VAL  34          2HG2      VAL  34  -3.540 -11.365  -4.230
  125   2HG2  VAL  34          1HG2      VAL  34  -4.673 -10.119  -3.707
  126   3HG2  VAL  34          3HG2      VAL  34  -4.786 -10.786  -5.335
  127    MG1  VAL  34           QG1      VAL  34  -2.730  -9.760  -6.865
  128    MG2  VAL  34           QG2      VAL  34  -4.333 -10.757  -4.424
  129    QG   VAL  34           QQG      VAL  34  -3.532 -10.258  -5.645
  130    H    GLY  35           H        GLY  35  -1.822  -6.863  -4.129
  131   1HA   GLY  35          1HA       GLY  35  -0.307  -5.247  -4.983
  132   2HA   GLY  35          2HA       GLY  35   0.044  -6.381  -6.289
  133    QA   GLY  35           QA       GLY  35  -0.132  -5.814  -5.636
  134    H    LEU  36           H        LEU  36   0.570  -6.815  -2.766
  135    HA   LEU  36           HA       LEU  36   3.394  -6.188  -2.753
  136   1HB   LEU  36          2HB       LEU  36   1.747  -8.196  -1.181
  137   2HB   LEU  36          1HB       LEU  36   3.343  -7.617  -0.703
  138    HG   LEU  36           HG       LEU  36   0.855  -5.921  -1.062
  139   1HD1  LEU  36          3HD1      LEU  36   1.055  -7.368   1.015
  140   2HD1  LEU  36          2HD1      LEU  36   2.500  -6.444   1.426
  141   3HD1  LEU  36          1HD1      LEU  36   0.935  -5.636   1.323
  142   1HD2  LEU  36          2HD2      LEU  36   3.760  -5.273  -0.664
  143   2HD2  LEU  36          1HD2      LEU  36   2.567  -4.460  -1.676
  144   3HD2  LEU  36          3HD2      LEU  36   2.541  -4.231   0.072
  145    MD1  LEU  36           QD1      LEU  36   1.497  -6.483   1.255
  146    MD2  LEU  36           QD2      LEU  36   2.956  -4.655  -0.756
  147    QB   LEU  36           QB       LEU  36   2.545  -7.906  -0.942
  148    QD   LEU  36           QQD      LEU  36   2.227  -5.569   0.249
  149    H    SER  37           H        SER  37   1.662  -9.237  -3.508
  150    HA   SER  37           HA       SER  37   3.961 -10.970  -3.655
  151   1HB   SER  37          2HB       SER  37   1.496 -11.506  -3.752
  152   2HB   SER  37          1HB       SER  37   1.493 -10.938  -5.418
  153    HG   SER  37           HG       SER  37   2.345 -13.297  -4.378
  154    QB   SER  37           QB       SER  37   1.495 -11.222  -4.585
  155    H    ALA  38           H        ALA  38   2.410  -9.024  -6.281
  156    HA   ALA  38           HA       ALA  38   4.238  -9.728  -8.380
  157   1HB   ALA  38          2HB       ALA  38   2.223  -8.449  -8.737
  158   2HB   ALA  38          3HB       ALA  38   3.575  -7.427  -9.226
  159   3HB   ALA  38          1HB       ALA  38   2.787  -7.164  -7.669
  160    MB   ALA  38           QB       ALA  38   2.862  -7.680  -8.544
  161    H    LEU  39           H        LEU  39   4.594  -7.396  -5.703
  162    HA   LEU  39           HA       LEU  39   7.361  -6.711  -6.777
  163   1HB   LEU  39          2HB       LEU  39   5.686  -4.918  -6.342
  164   2HB   LEU  39          1HB       LEU  39   5.622  -5.419  -4.651
  165    HG   LEU  39           HG       LEU  39   8.158  -5.063  -4.605
  166   1HD1  LEU  39          1HD1      LEU  39   7.476  -4.241  -7.358
  167   2HD1  LEU  39          3HD1      LEU  39   8.504  -3.104  -6.486
  168   3HD1  LEU  39          2HD1      LEU  39   9.019  -4.778  -6.693
  169   1HD2  LEU  39          3HD2      LEU  39   6.410  -3.494  -3.661
  170   2HD2  LEU  39          2HD2      LEU  39   7.910  -2.704  -4.146
  171   3HD2  LEU  39          1HD2      LEU  39   6.484  -2.600  -5.179
  172    MD1  LEU  39           QD1      LEU  39   8.333  -4.041  -6.846
  173    MD2  LEU  39           QD2      LEU  39   6.935  -2.933  -4.328
  174    QB   LEU  39           QB       LEU  39   5.654  -5.168  -5.496
  175    QD   LEU  39           QQD      LEU  39   7.634  -3.487  -5.587
  176    H    THR  40           H        THR  40   8.693  -8.384  -6.005
  177    HA   THR  40           HA       THR  40   8.744  -8.611  -2.960
  178    HB   THR  40           HB       THR  40   9.204 -11.054  -3.382
  179    HG1  THR  40          1HG       THR  40   9.883 -10.713  -5.576
  180   1HG2  THR  40          1HG2      THR  40   6.629  -9.801  -4.345
  181   2HG2  THR  40          3HG2      THR  40   6.820 -11.545  -4.162
  182   3HG2  THR  40          2HG2      THR  40   6.975 -10.489  -2.758
  183    MG   THR  40           QG2      THR  40   6.808 -10.612  -3.755
  184    H    GLY  41           H        GLY  41  10.408  -6.933  -4.755
  185   1HA   GLY  41          1HA       GLY  41  12.802  -7.622  -5.695
  186   2HA   GLY  41          2HA       GLY  41  13.052  -8.257  -4.069
  187    QA   GLY  41           QA       GLY  41  12.927  -7.940  -4.882
  188    H    TYR  42           H        TYR  42  14.682  -6.822  -3.420
  189    HA   TYR  42           HA       TYR  42  13.815  -4.255  -2.367
  190   1HB   TYR  42          2HB       TYR  42  16.544  -5.364  -3.102
  191   2HB   TYR  42          1HB       TYR  42  16.280  -3.965  -2.059
  192    HD1  TYR  42          1HD       TYR  42  16.360  -7.577  -2.252
  193    HD2  TYR  42          2HD       TYR  42  14.928  -4.260   0.073
  194    HE1  TYR  42          1HE       TYR  42  16.029  -9.082  -0.308
  195    HE2  TYR  42          2HE       TYR  42  14.598  -5.764   2.017
  196    HH   TYR  42           HH       TYR  42  15.766  -8.136   2.724
  197    QB   TYR  42           QB       TYR  42  16.412  -4.665  -2.581
  198    QD   TYR  42           QD       TYR  42  15.644  -5.918  -1.090
  199    QE   TYR  42           QE       TYR  42  15.313  -7.423   0.854
  200    QR   TYR  42           QR       TYR  42  15.479  -6.671  -0.118
  201    H    LEU  43           H        LEU  43  15.063  -2.139  -2.982
  202    HA   LEU  43           HA       LEU  43  15.830  -1.794  -5.805
  203   1HB   LEU  43          2HB       LEU  43  13.382  -2.275  -5.997
  204   2HB   LEU  43          1HB       LEU  43  13.058  -0.879  -4.971
  205    HG   LEU  43           HG       LEU  43  14.368   0.508  -6.661
  206   1HD1  LEU  43          1HD1      LEU  43  14.566  -2.168  -7.841
  207   2HD1  LEU  43          3HD1      LEU  43  13.965  -0.961  -8.978
  208   3HD1  LEU  43          2HD1      LEU  43  15.518  -0.722  -8.177
  209   1HD2  LEU  43          1HD2      LEU  43  11.685  -0.374  -6.630
  210   2HD2  LEU  43          3HD2      LEU  43  12.319   1.076  -7.410
  211   3HD2  LEU  43          2HD2      LEU  43  12.190  -0.429  -8.319
  212    MD1  LEU  43           QD1      LEU  43  14.683  -1.284  -8.332
  213    MD2  LEU  43           QD2      LEU  43  12.065   0.091  -7.453
  214    QB   LEU  43           QB       LEU  43  13.220  -1.577  -5.484
  215    QD   LEU  43           QQD      LEU  43  13.374  -0.596  -7.892
  216    H    ASP  44           H        ASP  44  17.086   0.041  -5.860
  217    HA   ASP  44           HA       ASP  44  17.220   1.767  -3.469
  218   1HB   ASP  44          2HB       ASP  44  18.321   1.928  -6.292
  219   2HB   ASP  44          1HB       ASP  44  18.804   3.014  -4.989
  220    QB   ASP  44           QB       ASP  44  18.562   2.471  -5.641
  221    H    TYR  45           H        TYR  45  17.306   4.328  -4.077
  222    HA   TYR  45           HA       TYR  45  14.497   4.887  -5.096
  223   1HB   TYR  45          2HB       TYR  45  14.630   6.801  -3.691
  224   2HB   TYR  45          1HB       TYR  45  15.457   5.536  -2.782
  225    HD1  TYR  45          1HD       TYR  45  15.856   8.650  -4.681
  226    HD2  TYR  45          2HD       TYR  45  17.914   5.497  -2.614
  227    HE1  TYR  45          1HE       TYR  45  17.922  10.021  -4.648
  228    HE2  TYR  45          2HE       TYR  45  19.980   6.868  -2.581
  229    HH   TYR  45           HH       TYR  45  20.924   8.782  -3.166
  230    QB   TYR  45           QB       TYR  45  15.044   6.168  -3.236
  231    QD   TYR  45           QD       TYR  45  16.885   7.074  -3.648
  232    QE   TYR  45           QE       TYR  45  18.951   8.445  -3.615
  233    QR   TYR  45           QR       TYR  45  17.918   7.759  -3.631
  234    H    VAL  46           H        VAL  46  14.195   5.902  -7.038
  235    HA   VAL  46           HA       VAL  46  16.696   6.962  -8.403
  236    HB   VAL  46           HB       VAL  46  14.024   6.715  -9.721
  237   1HG1  VAL  46          3HG1      VAL  46  16.794   6.890 -10.449
  238   2HG1  VAL  46          2HG1      VAL  46  16.150   5.361 -11.049
  239   3HG1  VAL  46          1HG1      VAL  46  15.383   6.882 -11.507
  240   1HG2  VAL  46          3HG2      VAL  46  15.605   4.450  -8.525
  241   2HG2  VAL  46          2HG2      VAL  46  13.857   4.687  -8.558
  242   3HG2  VAL  46          1HG2      VAL  46  14.709   4.199 -10.023
  243    MG1  VAL  46           QG1      VAL  46  16.109   6.378 -11.002
  244    MG2  VAL  46           QG2      VAL  46  14.724   4.446  -9.035
  245    QG   VAL  46           QQG      VAL  46  15.416   5.412 -10.019
  246    H    LEU  47           H        LEU  47  14.789   8.461 -10.260
  247    HA   LEU  47           HA       LEU  47  15.094  11.083  -9.099
  248   1HB   LEU  47          2HB       LEU  47  14.660  10.381 -11.494
  249   2HB   LEU  47          1HB       LEU  47  12.971  10.137 -11.047
  250    HG   LEU  47           HG       LEU  47  14.291  12.751 -10.396
  251   1HD1  LEU  47          1HD1      LEU  47  14.576  11.938 -12.906
  252   2HD1  LEU  47          3HD1      LEU  47  12.879  12.406 -13.017
  253   3HD1  LEU  47          2HD1      LEU  47  14.093  13.597 -12.549
  254   1HD2  LEU  47          3HD2      LEU  47  11.607  11.579 -10.500
  255   2HD2  LEU  47          2HD2      LEU  47  12.168  13.016  -9.645
  256   3HD2  LEU  47          1HD2      LEU  47  11.704  13.126 -11.342
  257    MD1  LEU  47           QD1      LEU  47  13.850  12.647 -12.824
  258    MD2  LEU  47           QD2      LEU  47  11.826  12.574 -10.496
  259    QB   LEU  47           QB       LEU  47  13.816  10.259 -11.270
  260    QD   LEU  47           QQD      LEU  47  12.838  12.610 -11.660
  261    H    LEU  48           H        LEU  48  12.398   8.739  -8.925
  262    HA   LEU  48           HA       LEU  48  11.279  10.348  -6.625
  263   1HB   LEU  48          2HB       LEU  48  10.368  10.542  -9.318
  264   2HB   LEU  48          1HB       LEU  48   9.136   9.662  -8.413
  265    HG   LEU  48           HG       LEU  48  10.333  12.120  -7.188
  266   1HD1  LEU  48          2HD1      LEU  48   8.961  12.068  -9.728
  267   2HD1  LEU  48          1HD1      LEU  48   7.966  12.893  -8.528
  268   3HD1  LEU  48          3HD1      LEU  48   9.607  13.455  -8.848
  269   1HD2  LEU  48          1HD2      LEU  48   8.482  10.335  -6.337
  270   2HD2  LEU  48          3HD2      LEU  48   8.472  12.029  -5.849
  271   3HD2  LEU  48          2HD2      LEU  48   7.429  11.485  -7.163
  272    MD1  LEU  48           QD1      LEU  48   8.845  12.806  -9.035
  273    MD2  LEU  48           QD2      LEU  48   8.127  11.283  -6.450
  274    QB   LEU  48           QB       LEU  48   9.752  10.102  -8.865
  275    QD   LEU  48           QQD      LEU  48   8.486  12.044  -7.742
  276    HA   PRO  49           HA       PRO  49  10.731   6.046  -5.535
  277   1HB   PRO  49          2HB       PRO  49   9.842   6.520  -2.991
  278   2HB   PRO  49          1HB       PRO  49  11.557   6.610  -3.444
  279   1HG   PRO  49          2HG       PRO  49   9.579   8.810  -3.081
  280   2HG   PRO  49          1HG       PRO  49  11.281   8.734  -2.598
  281   1HD   PRO  49          2HD       PRO  49  10.426  10.066  -4.807
  282   2HD   PRO  49          1HD       PRO  49  12.037   9.324  -4.684
  283    QB   PRO  49           QB       PRO  49  10.699   6.565  -3.217
  284    QG   PRO  49           QG       PRO  49  10.430   8.772  -2.840
  285    QD   PRO  49           QD       PRO  49  11.232   9.695  -4.745
  286    H    ALA  50           H        ALA  50   8.866   6.562  -7.275
  287    HA   ALA  50           HA       ALA  50   6.207   7.230  -6.390
  288   1HB   ALA  50          1HB       ALA  50   7.126   5.227  -8.479
  289   2HB   ALA  50          3HB       ALA  50   5.561   6.038  -8.446
  290   3HB   ALA  50          2HB       ALA  50   7.033   6.971  -8.725
  291    MB   ALA  50           QB       ALA  50   6.573   6.078  -8.550
  292    H    LEU  51           H        LEU  51   8.045   4.187  -6.169
  293    HA   LEU  51           HA       LEU  51   5.757   2.493  -5.473
  294   1HB   LEU  51          2HB       LEU  51   8.027   1.794  -6.277
  295   2HB   LEU  51          1HB       LEU  51   8.690   2.279  -4.718
  296    HG   LEU  51           HG       LEU  51   7.021   0.690  -3.641
  297   1HD1  LEU  51          3HD1      LEU  51   5.924   0.626  -6.168
  298   2HD1  LEU  51          2HD1      LEU  51   6.835  -0.883  -6.121
  299   3HD1  LEU  51          1HD1      LEU  51   5.604  -0.558  -4.900
  300   1HD2  LEU  51          3HD2      LEU  51   9.550   0.248  -4.702
  301   2HD2  LEU  51          2HD2      LEU  51   8.702  -0.830  -3.594
  302   3HD2  LEU  51          1HD2      LEU  51   8.607  -1.102  -5.335
  303    MD1  LEU  51           QD1      LEU  51   6.121  -0.272  -5.729
  304    MD2  LEU  51           QD2      LEU  51   8.953  -0.562  -4.544
  305    QB   LEU  51           QB       LEU  51   8.358   2.037  -5.497
  306    QD   LEU  51           QQD      LEU  51   7.537  -0.417  -5.137
  307    H    ALA  52           H        ALA  52   8.264   4.120  -3.448
  308    HA   ALA  52           HA       ALA  52   7.245   3.304  -0.890
  309   1HB   ALA  52          2HB       ALA  52   8.655   5.022  -0.098
  310   2HB   ALA  52          3HB       ALA  52   8.311   6.061  -1.481
  311   3HB   ALA  52          1HB       ALA  52   9.340   4.643  -1.679
  312    MB   ALA  52           QB       ALA  52   8.768   5.242  -1.086
  313    H    ILE  53           H        ILE  53   6.359   6.159  -2.899
  314    HA   ILE  53           HA       ILE  53   4.422   7.227  -0.993
  315    HB   ILE  53           HB       ILE  53   4.575   7.377  -4.022
  316   1HG1  ILE  53          2HG1      ILE  53   6.688   8.057  -3.091
  317   2HG1  ILE  53          1HG1      ILE  53   5.806   9.534  -3.478
  318   1HG2  ILE  53          1HG2      ILE  53   2.770   8.532  -2.069
  319   2HG2  ILE  53          3HG2      ILE  53   3.667   9.795  -2.911
  320   3HG2  ILE  53          2HG2      ILE  53   2.712   8.631  -3.829
  321   1HD1  ILE  53          1HD1      ILE  53   4.969   9.497  -1.061
  322   2HD1  ILE  53          3HD1      ILE  53   6.189   8.257  -0.765
  323   3HD1  ILE  53          2HD1      ILE  53   6.679   9.870  -1.283
  324    MG   ILE  53           QG2      ILE  53   3.050   8.986  -2.936
  325    MD   ILE  53           QD1      ILE  53   5.946   9.208  -1.036
  326    QG   ILE  53           QG1      ILE  53   6.247   8.795  -3.285
  327    H    PHE  54           H        PHE  54   4.075   5.037  -3.832
  328    HA   PHE  54           HA       PHE  54   1.223   4.761  -3.785
  329   1HB   PHE  54          2HB       PHE  54   2.874   3.875  -5.442
  330   2HB   PHE  54          1HB       PHE  54   3.335   2.636  -4.274
  331    HD1  PHE  54          1HD       PHE  54   0.571   3.908  -6.393
  332    HD2  PHE  54          2HD       PHE  54   1.933   0.732  -3.841
  333    HE1  PHE  54          1HE       PHE  54  -1.326   2.495  -7.140
  334    HE2  PHE  54          2HE       PHE  54   0.037  -0.681  -4.588
  335    HZ   PHE  54           HZ       PHE  54  -1.593   0.200  -6.237
  336    QB   PHE  54           QB       PHE  54   3.105   3.256  -4.858
  337    QD   PHE  54           QD       PHE  54   1.252   2.320  -5.117
  338    QE   PHE  54           QE       PHE  54  -0.645   0.907  -5.864
  339    QR   PHE  54           QR       PHE  54  -0.076   1.331  -5.640
  340    H    ILE  55           H        ILE  55   3.697   2.890  -1.940
  341    HA   ILE  55           HA       ILE  55   1.770   1.182  -0.573
  342    HB   ILE  55           HB       ILE  55   4.504   2.230   0.228
  343   1HG1  ILE  55          2HG1      ILE  55   4.550   1.120  -1.944
  344   2HG1  ILE  55          1HG1      ILE  55   5.264   0.046  -0.740
  345   1HG2  ILE  55          2HG2      ILE  55   2.871  -0.133   1.198
  346   2HG2  ILE  55          1HG2      ILE  55   4.585   0.089   1.550
  347   3HG2  ILE  55          3HG2      ILE  55   3.404   1.252   2.151
  348   1HD1  ILE  55          2HD1      ILE  55   2.638  -0.673  -0.568
  349   2HD1  ILE  55          1HD1      ILE  55   2.754  -0.250  -2.277
  350   3HD1  ILE  55          3HD1      ILE  55   3.814  -1.487  -1.600
  351    MG   ILE  55           QG2      ILE  55   3.620   0.402   1.633
  352    MD   ILE  55           QD1      ILE  55   3.069  -0.804  -1.482
  353    QG   ILE  55           QG1      ILE  55   4.907   0.583  -1.342
  354    H    GLY  56           H        GLY  56   3.293   4.311   0.354
  355   1HA   GLY  56          1HA       GLY  56   2.505   5.902   1.931
  356   2HA   GLY  56          2HA       GLY  56   2.139   4.521   2.967
  357    QA   GLY  56           QA       GLY  56   2.322   5.211   2.449
  358    H    LEU  57           H        LEU  57   0.766   5.708  -0.158
  359    HA   LEU  57           HA       LEU  57  -1.778   6.525   0.998
  360   1HB   LEU  57          2HB       LEU  57  -0.544   6.761  -1.369
  361   2HB   LEU  57          1HB       LEU  57  -1.588   5.395  -1.761
  362    HG   LEU  57           HG       LEU  57  -2.859   7.326  -2.324
  363   1HD1  LEU  57          1HD1      LEU  57  -3.947   5.555  -0.809
  364   2HD1  LEU  57          3HD1      LEU  57  -3.763   6.727   0.497
  365   3HD1  LEU  57          2HD1      LEU  57  -4.758   7.119  -0.906
  366   1HD2  LEU  57          2HD2      LEU  57  -1.231   8.684  -0.641
  367   2HD2  LEU  57          1HD2      LEU  57  -2.761   9.339  -1.226
  368   3HD2  LEU  57          3HD2      LEU  57  -2.676   8.583   0.365
  369    MD1  LEU  57           QD1      LEU  57  -4.156   6.467  -0.406
  370    MD2  LEU  57           QD2      LEU  57  -2.222   8.869  -0.501
  371    QB   LEU  57           QB       LEU  57  -1.066   6.078  -1.565
  372    QD   LEU  57           QQD      LEU  57  -3.189   7.668  -0.453
  373    H    THR  58           H        THR  58  -0.613   3.407  -0.327
  374    HA   THR  58           HA       THR  58  -3.196   2.057  -0.269
  375    HB   THR  58           HB       THR  58  -0.369   1.018   0.114
  376    HG1  THR  58          1HG       THR  58  -1.771   1.008  -2.305
  377   1HG2  THR  58          1HG2      THR  58  -2.945  -0.312  -0.757
  378   2HG2  THR  58          3HG2      THR  58  -1.352  -1.039  -0.965
  379   3HG2  THR  58          2HG2      THR  58  -1.965  -0.705   0.655
  380    MG   THR  58           QG2      THR  58  -2.087  -0.685  -0.356
  381    H    ILE  59           H        ILE  59  -0.476   2.045   2.105
  382    HA   ILE  59           HA       ILE  59  -1.957   0.509   4.106
  383    HB   ILE  59           HB       ILE  59   0.347   2.470   4.326
  384   1HG1  ILE  59          2HG1      ILE  59   0.823   0.717   2.707
  385   2HG1  ILE  59          1HG1      ILE  59   1.705   0.355   4.192
  386   1HG2  ILE  59          3HG2      ILE  59  -0.933   0.541   6.215
  387   2HG2  ILE  59          2HG2      ILE  59   0.826   0.671   6.244
  388   3HG2  ILE  59          1HG2      ILE  59  -0.169   2.096   6.548
  389   1HD1  ILE  59          1HD1      ILE  59  -0.432  -1.019   4.825
  390   2HD1  ILE  59          3HD1      ILE  59  -0.764  -0.967   3.093
  391   3HD1  ILE  59          2HD1      ILE  59   0.722  -1.711   3.684
  392    MG   ILE  59           QG2      ILE  59  -0.092   1.102   6.336
  393    MD   ILE  59           QD1      ILE  59  -0.158  -1.232   3.867
  394    QG   ILE  59           QG1      ILE  59   1.264   0.536   3.450
  395    H    TYR  60           H        TYR  60  -1.436   4.059   3.673
  396    HA   TYR  60           HA       TYR  60  -2.820   4.857   6.097
  397   1HB   TYR  60          2HB       TYR  60  -2.220   6.037   3.396
  398   2HB   TYR  60          1HB       TYR  60  -3.274   6.924   4.493
  399    HD1  TYR  60          1HD       TYR  60  -2.141   8.614   5.604
  400    HD2  TYR  60          2HD       TYR  60  -0.161   4.861   4.938
  401    HE1  TYR  60          1HE       TYR  60  -0.169   9.431   6.866
  402    HE2  TYR  60          2HE       TYR  60   1.813   5.679   6.199
  403    HH   TYR  60           HH       TYR  60   2.804   8.048   6.728
  404    QB   TYR  60           QB       TYR  60  -2.747   6.480   3.944
  405    QD   TYR  60           QD       TYR  60  -1.151   6.738   5.271
  406    QE   TYR  60           QE       TYR  60   0.822   7.555   6.532
  407    QR   TYR  60           QR       TYR  60  -0.164   7.146   5.902
  408    H    ALA  61           H        ALA  61  -4.037   4.519   2.716
  409    HA   ALA  61           HA       ALA  61  -6.799   5.123   3.307
  410   1HB   ALA  61          1HB       ALA  61  -5.828   3.090   1.299
  411   2HB   ALA  61          2HB       ALA  61  -5.488   4.808   1.107
  412   3HB   ALA  61          3HB       ALA  61  -7.156   4.239   1.133
  413    MB   ALA  61           QB       ALA  61  -6.157   4.046   1.180
  414    H    ILE  62           H        ILE  62  -5.015   2.007   3.427
  415    HA   ILE  62           HA       ILE  62  -7.362   0.361   3.936
  416    HB   ILE  62           HB       ILE  62  -4.430   0.237   4.056
  417   1HG1  ILE  62          2HG1      ILE  62  -5.022  -2.091   3.156
  418   2HG1  ILE  62          1HG1      ILE  62  -6.707  -1.572   3.220
  419   1HG2  ILE  62          3HG2      ILE  62  -6.140  -1.473   5.882
  420   2HG2  ILE  62          2HG2      ILE  62  -4.507  -1.922   5.390
  421   3HG2  ILE  62          1HG2      ILE  62  -4.771  -0.458   6.338
  422   1HD1  ILE  62          3HD1      ILE  62  -5.797   0.530   1.918
  423   2HD1  ILE  62          2HD1      ILE  62  -4.479  -0.559   1.487
  424   3HD1  ILE  62          1HD1      ILE  62  -6.137  -0.965   1.047
  425    MG   ILE  62           QG2      ILE  62  -5.139  -1.284   5.870
  426    MD   ILE  62           QD1      ILE  62  -5.471  -0.331   1.484
  427    QG   ILE  62           QG1      ILE  62  -5.865  -1.832   3.188
  428    H    GLN  63           H        GLN  63  -5.023   1.926   6.198
  429    HA   GLN  63           HA       GLN  63  -6.264   0.907   8.620
  430   1HB   GLN  63          2HB       GLN  63  -4.029   2.026   8.318
  431   2HB   GLN  63          1HB       GLN  63  -4.879   3.563   8.147
  432   1HG   GLN  63          2HG       GLN  63  -5.917   3.187  10.389
  433   2HG   GLN  63          1HG       GLN  63  -4.932   1.735  10.563
  434   1HE2  GLN  63          1HE2      GLN  63  -2.999   2.027  11.662
  435   2HE2  GLN  63          2HE2      GLN  63  -2.115   3.594  11.725
  436    QB   GLN  63           QB       GLN  63  -4.454   2.795   8.232
  437    QG   GLN  63           QG       GLN  63  -5.425   2.461  10.476
  438    QE   GLN  63           QE2      GLN  63  -2.557   2.810  11.693
  439    H    ARG  64           H        ARG  64  -6.884   3.864   6.678
  440    HA   ARG  64           HA       ARG  64  -8.824   5.001   8.546
  441   1HB   ARG  64          2HB       ARG  64  -8.430   5.210   5.544
  442   2HB   ARG  64          1HB       ARG  64  -9.451   6.296   6.487
  443   1HG   ARG  64          2HG       ARG  64  -6.510   5.846   7.053
  444   2HG   ARG  64          1HG       ARG  64  -7.126   7.179   6.074
  445   1HD   ARG  64          2HD       ARG  64  -8.528   7.910   8.014
  446   2HD   ARG  64          1HD       ARG  64  -7.772   6.638   8.994
  447    HE   ARG  64           HE       ARG  64  -5.883   8.070   9.220
  448   1HH1  ARG  64          1HH1      ARG  64  -4.267   8.234   7.182
  449   2HH1  ARG  64          2HH1      ARG  64  -4.642   9.598   6.184
  450   1HH2  ARG  64          1HH2      ARG  64  -7.844   9.986   7.458
  451   2HH2  ARG  64          2HH2      ARG  64  -6.667  10.591   6.340
  452    QB   ARG  64           QB       ARG  64  -8.941   5.753   6.015
  453    QG   ARG  64           QG       ARG  64  -6.818   6.512   6.563
  454    QD   ARG  64           QD       ARG  64  -8.150   7.274   8.504
  455    QH1  ARG  64           QH1      ARG  64  -4.454   8.916   6.683
  456    QH2  ARG  64           QH2      ARG  64  -7.255  10.289   6.899
  457    H    LYS  65           H        LYS  65  -9.276   3.116   5.496
  458    HA   LYS  65           HA       LYS  65 -12.137   2.879   5.674
  459   1HB   LYS  65          2HB       LYS  65  -9.959   1.037   4.641
  460   2HB   LYS  65          1HB       LYS  65 -11.672   0.803   4.293
  461   1HG   LYS  65          2HG       LYS  65 -11.765   3.083   3.310
  462   2HG   LYS  65          1HG       LYS  65 -10.035   3.262   3.604
  463   1HD   LYS  65          2HD       LYS  65  -9.630   1.243   2.183
  464   2HD   LYS  65          1HD       LYS  65 -11.354   1.206   1.810
  465   1HE   LYS  65          2HE       LYS  65 -10.943   3.742   1.137
  466   2HE   LYS  65          1HE       LYS  65  -9.273   3.179   0.927
  467   1HZ   LYS  65          1HZ       LYS  65 -10.200   1.276  -0.351
  468   2HZ   LYS  65          3HZ       LYS  65 -11.720   2.027  -0.300
  469   3HZ   LYS  65          2HZ       LYS  65 -10.429   2.780  -1.106
  470    QB   LYS  65           QB       LYS  65 -10.816   0.920   4.467
  471    QD   LYS  65           QD       LYS  65 -10.492   1.225   1.996
  472    QG   LYS  65           QG       LYS  65 -10.900   3.172   3.457
  473    QE   LYS  65           QE       LYS  65 -10.108   3.460   1.032
  474    QZ   LYS  65           QZ       LYS  65 -10.783   2.028  -0.586
  475    H    ARG  66           H        ARG  66  -9.584   0.674   6.965
  476    HA   ARG  66           HA       ARG  66 -11.436  -1.175   8.234
  477   1HB   ARG  66          2HB       ARG  66  -8.590  -0.286   8.779
  478   2HB   ARG  66          1HB       ARG  66  -9.347  -1.628   9.638
  479   1HG   ARG  66          2HG       ARG  66  -9.847  -2.681   7.405
  480   2HG   ARG  66          1HG       ARG  66  -8.888  -1.409   6.651
  481   1HD   ARG  66          2HD       ARG  66  -7.888  -3.416   8.706
  482   2HD   ARG  66          1HD       ARG  66  -7.455  -3.362   6.985
  483    HE   ARG  66           HE       ARG  66  -6.826  -0.778   7.756
  484   1HH1  ARG  66          1HH1      ARG  66  -4.726  -3.003   7.362
  485   2HH1  ARG  66          2HH1      ARG  66  -3.879  -2.947   8.872
  486   1HH2  ARG  66          1HH2      ARG  66  -6.360  -1.158  10.504
  487   2HH2  ARG  66          2HH2      ARG  66  -4.802  -1.903  10.650
  488    QB   ARG  66           QB       ARG  66  -8.968  -0.957   9.208
  489    QG   ARG  66           QG       ARG  66  -9.367  -2.045   7.028
  490    QD   ARG  66           QD       ARG  66  -7.672  -3.389   7.845
  491    QH1  ARG  66           QH1      ARG  66  -4.303  -2.975   8.117
  492    QH2  ARG  66           QH2      ARG  66  -5.581  -1.531  10.577
  493    H    GLN  67           H        GLN  67  -9.994   1.918   9.294
  494    HA   GLN  67           HA       GLN  67 -12.118   2.153  11.390
  495   1HB   GLN  67          2HB       GLN  67 -10.358   0.663  12.378
  496   2HB   GLN  67          1HB       GLN  67  -9.182   1.956  12.139
  497   1HG   GLN  67          2HG       GLN  67 -10.498   3.443  13.592
  498   2HG   GLN  67          1HG       GLN  67 -11.703   2.174  13.813
  499   1HE2  GLN  67          1HE2      GLN  67 -10.609   3.082  16.157
  500   2HE2  GLN  67          2HE2      GLN  67  -9.399   1.899  16.776
  501    QB   GLN  67           QB       GLN  67  -9.770   1.310  12.258
  502    QG   GLN  67           QG       GLN  67 -11.100   2.808  13.702
  503    QE   GLN  67           QE2      GLN  67 -10.004   2.490  16.466
  504    H    ALA  68           H        ALA  68 -12.588   4.313  11.689
  505    HA   ALA  68           HA       ALA  68 -10.446   6.362  11.421
  506   1HB   ALA  68          3HB       ALA  68 -12.168   5.529   9.162
  507   2HB   ALA  68          1HB       ALA  68 -10.594   6.323   9.139
  508   3HB   ALA  68          2HB       ALA  68 -12.055   7.273   9.410
  509    MB   ALA  68           QB       ALA  68 -11.606   6.375   9.237
  510    H    ASP  69           H        ASP  69 -11.046   8.168  12.579
  511    HA   ASP  69           HA       ASP  69 -13.639   8.169  13.957
  512   1HB   ASP  69          2HB       ASP  69 -11.477  10.249  13.496
  513   2HB   ASP  69          1HB       ASP  69 -12.804  10.452  14.640
  514    QB   ASP  69           QB       ASP  69 -12.141  10.350  14.068

  No H/Q in entry =         514
  Start of MODEL   14
    1    H    THR  24           H        THR  24 -18.705  -3.585   7.667
    2    HA   THR  24           HA       THR  24 -15.920  -3.691   7.778
    3    HB   THR  24           HB       THR  24 -17.300  -5.382   8.769
    4    HG1  THR  24          1HG       THR  24 -15.916  -6.903   8.389
    5   1HG2  THR  24          3HG2      THR  24 -18.470  -5.432   6.081
    6   2HG2  THR  24          2HG2      THR  24 -18.242  -7.040   6.771
    7   3HG2  THR  24          1HG2      THR  24 -19.202  -5.837   7.633
    8    MG   THR  24           QG2      THR  24 -18.638  -6.103   6.829
    9    HA   PRO  25           HA       PRO  25 -15.191  -3.771   3.314
   10   1HB   PRO  25          2HB       PRO  25 -12.900  -2.310   3.341
   11   2HB   PRO  25          1HB       PRO  25 -14.503  -1.558   3.456
   12   1HG   PRO  25          2HG       PRO  25 -12.477  -2.006   5.556
   13   2HG   PRO  25          1HG       PRO  25 -13.701  -0.736   5.414
   14   1HD   PRO  25          2HD       PRO  25 -13.854  -3.051   7.013
   15   2HD   PRO  25          1HD       PRO  25 -15.170  -1.909   6.662
   16    QB   PRO  25           QB       PRO  25 -13.701  -1.934   3.399
   17    QG   PRO  25           QG       PRO  25 -13.089  -1.371   5.485
   18    QD   PRO  25           QD       PRO  25 -14.512  -2.480   6.837
   19    H    VAL  26           H        VAL  26 -14.794  -6.147   4.376
   20    HA   VAL  26           HA       VAL  26 -12.001  -6.906   4.835
   21    HB   VAL  26           HB       VAL  26 -14.198  -8.075   5.437
   22   1HG1  VAL  26          1HG1      VAL  26 -15.127  -7.894   3.106
   23   2HG1  VAL  26          3HG1      VAL  26 -13.938  -9.090   2.591
   24   3HG1  VAL  26          2HG1      VAL  26 -15.181  -9.530   3.762
   25   1HG2  VAL  26          3HG2      VAL  26 -11.627  -9.072   4.895
   26   2HG2  VAL  26          2HG2      VAL  26 -12.876  -9.857   5.861
   27   3HG2  VAL  26          1HG2      VAL  26 -12.731 -10.224   4.142
   28    MG1  VAL  26           QG1      VAL  26 -14.749  -8.838   3.153
   29    MG2  VAL  26           QG2      VAL  26 -12.411  -9.718   4.966
   30    QG   VAL  26           QQG      VAL  26 -13.580  -9.278   4.060
   31    H    LEU  27           H        LEU  27 -14.058  -6.676   1.929
   32    HA   LEU  27           HA       LEU  27 -12.349  -8.153   0.116
   33   1HB   LEU  27          2HB       LEU  27 -14.670  -7.342  -0.274
   34   2HB   LEU  27          1HB       LEU  27 -14.061  -5.689  -0.350
   35    HG   LEU  27           HG       LEU  27 -12.518  -6.479  -2.219
   36   1HD1  LEU  27          1HD1      LEU  27 -14.380  -8.866  -2.032
   37   2HD1  LEU  27          3HD1      LEU  27 -13.322  -8.540  -3.404
   38   3HD1  LEU  27          2HD1      LEU  27 -12.629  -8.874  -1.817
   39   1HD2  LEU  27          1HD2      LEU  27 -15.516  -6.337  -2.394
   40   2HD2  LEU  27          3HD2      LEU  27 -14.315  -5.180  -2.966
   41   3HD2  LEU  27          2HD2      LEU  27 -14.577  -6.686  -3.846
   42    MD1  LEU  27           QD1      LEU  27 -13.444  -8.760  -2.417
   43    MD2  LEU  27           QD2      LEU  27 -14.803  -6.068  -3.069
   44    QB   LEU  27           QB       LEU  27 -14.365  -6.515  -0.312
   45    QD   LEU  27           QQD      LEU  27 -14.123  -7.414  -2.743
   46    H    VAL  28           H        VAL  28 -12.216  -4.801   1.310
   47    HA   VAL  28           HA       VAL  28 -10.319  -3.761  -0.606
   48    HB   VAL  28           HB       VAL  28 -10.846  -3.223   2.331
   49   1HG1  VAL  28          1HG1      VAL  28  -8.950  -1.994   0.403
   50   2HG1  VAL  28          3HG1      VAL  28  -9.916  -0.872   1.362
   51   3HG1  VAL  28          2HG1      VAL  28  -8.884  -2.056   2.165
   52   1HG2  VAL  28          2HG2      VAL  28 -12.760  -2.910   0.796
   53   2HG2  VAL  28          1HG2      VAL  28 -12.195  -1.362   1.425
   54   3HG2  VAL  28          3HG2      VAL  28 -11.774  -1.853  -0.214
   55    MG1  VAL  28           QG1      VAL  28  -9.250  -1.641   1.310
   56    MG2  VAL  28           QG2      VAL  28 -12.243  -2.042   0.669
   57    QG   VAL  28           QQG      VAL  28 -10.747  -1.841   0.990
   58    H    ILE  29           H        ILE  29  -9.811  -5.520   2.489
   59    HA   ILE  29           HA       ILE  29  -6.907  -5.254   2.494
   60    HB   ILE  29           HB       ILE  29  -8.792  -7.374   3.574
   61   1HG1  ILE  29          2HG1      ILE  29  -7.558  -4.953   4.924
   62   2HG1  ILE  29          1HG1      ILE  29  -9.205  -5.000   4.293
   63   1HG2  ILE  29          3HG2      ILE  29  -5.862  -6.964   3.780
   64   2HG2  ILE  29          2HG2      ILE  29  -6.696  -7.295   5.299
   65   3HG2  ILE  29          1HG2      ILE  29  -6.807  -8.440   3.962
   66   1HD1  ILE  29          1HD1      ILE  29  -8.379  -7.205   6.124
   67   2HD1  ILE  29          3HD1      ILE  29  -8.656  -5.618   6.841
   68   3HD1  ILE  29          2HD1      ILE  29  -9.948  -6.420   5.948
   69    MG   ILE  29           QG2      ILE  29  -6.455  -7.566   4.347
   70    MD   ILE  29           QD1      ILE  29  -8.994  -6.414   6.304
   71    QG   ILE  29           QG1      ILE  29  -8.381  -4.977   4.609
   72    H    LEU  30           H        LEU  30  -9.128  -7.636   1.015
   73    HA   LEU  30           HA       LEU  30  -7.103  -9.570   0.245
   74   1HB   LEU  30          2HB       LEU  30  -9.774  -9.402   0.189
   75   2HB   LEU  30          1HB       LEU  30  -9.460  -8.977  -1.493
   76    HG   LEU  30           HG       LEU  30  -9.706 -11.354  -1.453
   77   1HD1  LEU  30          2HD1      LEU  30  -7.669 -10.329  -2.646
   78   2HD1  LEU  30          1HD1      LEU  30  -6.715 -10.950  -1.299
   79   3HD1  LEU  30          3HD1      LEU  30  -7.614 -12.063  -2.331
   80   1HD2  LEU  30          2HD2      LEU  30  -8.485 -11.037   1.161
   81   2HD2  LEU  30          1HD2      LEU  30  -9.404 -12.401   0.524
   82   3HD2  LEU  30          3HD2      LEU  30  -7.666 -12.298   0.242
   83    MD1  LEU  30           QD1      LEU  30  -7.333 -11.114  -2.092
   84    MD2  LEU  30           QD2      LEU  30  -8.518 -11.912   0.642
   85    QB   LEU  30           QB       LEU  30  -9.617  -9.190  -0.652
   86    QD   LEU  30           QQD      LEU  30  -7.926 -11.513  -0.725
   87    H    LEU  31           H        LEU  31  -8.437  -6.707  -1.483
   88    HA   LEU  31           HA       LEU  31  -6.919  -7.113  -3.931
   89   1HB   LEU  31          2HB       LEU  31  -8.246  -4.841  -2.480
   90   2HB   LEU  31          1HB       LEU  31  -7.305  -4.499  -3.933
   91    HG   LEU  31           HG       LEU  31  -8.714  -6.576  -4.865
   92   1HD1  LEU  31          1HD1      LEU  31 -10.404  -5.357  -2.667
   93   2HD1  LEU  31          3HD1      LEU  31 -11.076  -6.312  -3.989
   94   3HD1  LEU  31          2HD1      LEU  31  -9.948  -7.051  -2.852
   95   1HD2  LEU  31          1HD2      LEU  31  -9.229  -3.643  -4.740
   96   2HD2  LEU  31          3HD2      LEU  31  -8.954  -4.677  -6.142
   97   3HD2  LEU  31          2HD2      LEU  31 -10.535  -4.654  -5.360
   98    MD1  LEU  31           QD1      LEU  31 -10.476  -6.240  -3.169
   99    MD2  LEU  31           QD2      LEU  31  -9.573  -4.325  -5.414
  100    QB   LEU  31           QB       LEU  31  -7.776  -4.670  -3.207
  101    QD   LEU  31           QQD      LEU  31 -10.024  -5.282  -4.292
  102    H    GLY  32           H        GLY  32  -6.184  -5.245  -0.941
  103   1HA   GLY  32          1HA       GLY  32  -4.090  -4.369  -0.238
  104   2HA   GLY  32          2HA       GLY  32  -3.645  -4.210  -1.938
  105    QA   GLY  32           QA       GLY  32  -3.867  -4.290  -1.088
  106    H    VAL  33           H        VAL  33  -4.555  -7.203  -0.218
  107    HA   VAL  33           HA       VAL  33  -1.901  -8.156   0.378
  108    HB   VAL  33           HB       VAL  33  -4.494  -9.521  -0.407
  109   1HG1  VAL  33          1HG1      VAL  33  -1.852 -10.634   0.504
  110   2HG1  VAL  33          3HG1      VAL  33  -3.351 -11.443   0.962
  111   3HG1  VAL  33          2HG1      VAL  33  -2.942 -11.241  -0.742
  112   1HG2  VAL  33          3HG2      VAL  33  -3.876  -8.022   1.806
  113   2HG2  VAL  33          2HG2      VAL  33  -5.084  -9.307   1.782
  114   3HG2  VAL  33          1HG2      VAL  33  -3.449  -9.645   2.352
  115    MG1  VAL  33           QG1      VAL  33  -2.715 -11.106   0.241
  116    MG2  VAL  33           QG2      VAL  33  -4.136  -8.991   1.980
  117    QG   VAL  33           QQG      VAL  33  -3.426 -10.049   1.111
  118    H    VAL  34           H        VAL  34  -3.919  -8.625  -2.566
  119    HA   VAL  34           HA       VAL  34  -2.051 -10.277  -4.017
  120    HB   VAL  34           HB       VAL  34  -4.077  -8.181  -4.847
  121   1HG1  VAL  34          2HG1      VAL  34  -2.542 -10.220  -6.475
  122   2HG1  VAL  34          1HG1      VAL  34  -4.063  -9.518  -7.027
  123   3HG1  VAL  34          3HG1      VAL  34  -2.663  -8.482  -6.752
  124   1HG2  VAL  34          2HG2      VAL  34  -4.469 -10.548  -3.555
  125   2HG2  VAL  34          1HG2      VAL  34  -5.642  -9.837  -4.663
  126   3HG2  VAL  34          3HG2      VAL  34  -4.532 -11.085  -5.233
  127    MG1  VAL  34           QG1      VAL  34  -3.089  -9.407  -6.751
  128    MG2  VAL  34           QG2      VAL  34  -4.881 -10.490  -4.484
  129    QG   VAL  34           QQG      VAL  34  -3.985  -9.948  -5.618
  130    H    GLY  35           H        GLY  35  -2.320  -6.693  -3.818
  131   1HA   GLY  35          1HA       GLY  35  -0.720  -5.068  -4.478
  132   2HA   GLY  35          2HA       GLY  35  -0.274  -6.153  -5.797
  133    QA   GLY  35           QA       GLY  35  -0.497  -5.611  -5.138
  134    H    LEU  36           H        LEU  36  -0.059  -6.754  -2.267
  135    HA   LEU  36           HA       LEU  36   2.762  -6.165  -1.990
  136   1HB   LEU  36          2HB       LEU  36   0.674  -7.812  -0.633
  137   2HB   LEU  36          1HB       LEU  36   2.351  -8.087  -0.163
  138    HG   LEU  36           HG       LEU  36   2.491  -5.499   0.028
  139   1HD1  LEU  36          2HD1      LEU  36   0.253  -5.185  -1.098
  140   2HD1  LEU  36          1HD1      LEU  36  -0.501  -5.881   0.336
  141   3HD1  LEU  36          3HD1      LEU  36   0.397  -4.367   0.458
  142   1HD2  LEU  36          2HD2      LEU  36   2.443  -7.225   1.908
  143   2HD2  LEU  36          1HD2      LEU  36   1.859  -5.619   2.338
  144   3HD2  LEU  36          3HD2      LEU  36   0.711  -6.920   2.024
  145    MD1  LEU  36           QD1      LEU  36   0.050  -5.145  -0.101
  146    MD2  LEU  36           QD2      LEU  36   1.671  -6.588   2.090
  147    QB   LEU  36           QB       LEU  36   1.513  -7.949  -0.398
  148    QD   LEU  36           QQD      LEU  36   0.860  -5.866   0.994
  149    H    SER  37           H        SER  37   1.069  -9.198  -2.910
  150    HA   SER  37           HA       SER  37   3.392 -10.908  -2.972
  151   1HB   SER  37          2HB       SER  37   0.946 -11.482  -3.154
  152   2HB   SER  37          1HB       SER  37   0.981 -10.892  -4.813
  153    HG   SER  37           HG       SER  37   2.174 -13.155  -3.670
  154    QB   SER  37           QB       SER  37   0.964 -11.187  -3.984
  155    H    ALA  38           H        ALA  38   1.906  -8.982  -5.649
  156    HA   ALA  38           HA       ALA  38   3.811  -9.653  -7.686
  157   1HB   ALA  38          3HB       ALA  38   1.635  -8.071  -7.430
  158   2HB   ALA  38          1HB       ALA  38   2.744  -7.939  -8.795
  159   3HB   ALA  38          2HB       ALA  38   2.891  -6.832  -7.429
  160    MB   ALA  38           QB       ALA  38   2.423  -7.614  -7.884
  161    H    LEU  39           H        LEU  39   4.064  -7.341  -4.982
  162    HA   LEU  39           HA       LEU  39   6.865  -6.642  -5.959
  163   1HB   LEU  39          2HB       LEU  39   5.171  -4.847  -5.615
  164   2HB   LEU  39          1HB       LEU  39   5.034  -5.330  -3.924
  165    HG   LEU  39           HG       LEU  39   7.554  -4.962  -3.755
  166   1HD1  LEU  39          2HD1      LEU  39   7.063  -4.304  -6.566
  167   2HD1  LEU  39          1HD1      LEU  39   7.923  -3.027  -5.708
  168   3HD1  LEU  39          3HD1      LEU  39   8.583  -4.661  -5.748
  169   1HD2  LEU  39          3HD2      LEU  39   5.687  -3.361  -3.014
  170   2HD2  LEU  39          2HD2      LEU  39   7.275  -2.642  -3.283
  171   3HD2  LEU  39          1HD2      LEU  39   6.012  -2.469  -4.501
  172    MD1  LEU  39           QD1      LEU  39   7.856  -3.997  -6.007
  173    MD2  LEU  39           QD2      LEU  39   6.325  -2.824  -3.599
  174    QB   LEU  39           QB       LEU  39   5.103  -5.089  -4.769
  175    QD   LEU  39           QQD      LEU  39   7.090  -3.411  -4.803
  176    H    THR  40           H        THR  40   8.192  -8.271  -5.108
  177    HA   THR  40           HA       THR  40   8.133  -8.451  -2.064
  178    HB   THR  40           HB       THR  40   8.574 -10.918  -2.425
  179    HG1  THR  40          1HG       THR  40   9.048 -11.392  -4.406
  180   1HG2  THR  40          2HG2      THR  40   6.011  -9.704  -3.486
  181   2HG2  THR  40          1HG2      THR  40   6.201 -11.415  -3.100
  182   3HG2  THR  40          3HG2      THR  40   6.344 -10.202  -1.828
  183    MG   THR  40           QG2      THR  40   6.186 -10.440  -2.805
  184    H    GLY  41           H        GLY  41   9.877  -6.842  -3.826
  185   1HA   GLY  41          1HA       GLY  41  12.280  -7.669  -4.699
  186   2HA   GLY  41          2HA       GLY  41  12.476  -8.171  -3.018
  187    QA   GLY  41           QA       GLY  41  12.378  -7.920  -3.859
  188    H    TYR  42           H        TYR  42  14.170  -6.698  -2.558
  189    HA   TYR  42           HA       TYR  42  13.286  -4.032  -1.724
  190   1HB   TYR  42          2HB       TYR  42  15.553  -3.838  -1.022
  191   2HB   TYR  42          1HB       TYR  42  15.203  -5.564  -0.919
  192    HD1  TYR  42          1HD       TYR  42  17.009  -2.946  -2.765
  193    HD2  TYR  42          2HD       TYR  42  16.099  -7.140  -2.574
  194    HE1  TYR  42          1HE       TYR  42  18.845  -3.419  -4.365
  195    HE2  TYR  42          2HE       TYR  42  17.934  -7.611  -4.173
  196    HH   TYR  42           HH       TYR  42  20.358  -5.776  -4.782
  197    QB   TYR  42           QB       TYR  42  15.378  -4.701  -0.971
  198    QD   TYR  42           QD       TYR  42  16.554  -5.043  -2.669
  199    QE   TYR  42           QE       TYR  42  18.389  -5.515  -4.269
  200    QR   TYR  42           QR       TYR  42  17.472  -5.279  -3.469
  201    H    LEU  43           H        LEU  43  14.654  -2.020  -2.467
  202    HA   LEU  43           HA       LEU  43  15.554  -1.952  -5.264
  203   1HB   LEU  43          2HB       LEU  43  13.121  -2.414  -5.564
  204   2HB   LEU  43          1HB       LEU  43  12.752  -0.941  -4.667
  205    HG   LEU  43           HG       LEU  43  14.165   0.309  -6.381
  206   1HD1  LEU  43          2HD1      LEU  43  14.695  -2.356  -7.208
  207   2HD1  LEU  43          1HD1      LEU  43  13.748  -1.603  -8.492
  208   3HD1  LEU  43          3HD1      LEU  43  15.259  -0.864  -7.961
  209   1HD2  LEU  43          2HD2      LEU  43  11.568  -0.035  -6.323
  210   2HD2  LEU  43          1HD2      LEU  43  12.309   0.618  -7.784
  211   3HD2  LEU  43          3HD2      LEU  43  11.851  -1.083  -7.713
  212    MD1  LEU  43           QD1      LEU  43  14.567  -1.608  -7.887
  213    MD2  LEU  43           QD2      LEU  43  11.909  -0.167  -7.273
  214    QB   LEU  43           QB       LEU  43  12.937  -1.677  -5.116
  215    QD   LEU  43           QQD      LEU  43  13.238  -0.887  -7.580
  216    H    ASP  44           H        ASP  44  16.874  -0.169  -5.385
  217    HA   ASP  44           HA       ASP  44  16.727   1.850  -3.190
  218   1HB   ASP  44          2HB       ASP  44  18.811   0.911  -4.211
  219   2HB   ASP  44          1HB       ASP  44  18.390   1.713  -5.725
  220    QB   ASP  44           QB       ASP  44  18.601   1.312  -4.968
  221    H    TYR  45           H        TYR  45  15.721   3.826  -3.264
  222    HA   TYR  45           HA       TYR  45  13.895   4.473  -5.420
  223   1HB   TYR  45          2HB       TYR  45  13.578   6.465  -4.158
  224   2HB   TYR  45          1HB       TYR  45  14.076   5.264  -2.967
  225    HD1  TYR  45          1HD       TYR  45  15.038   8.295  -4.789
  226    HD2  TYR  45          2HD       TYR  45  16.370   5.265  -2.051
  227    HE1  TYR  45          1HE       TYR  45  16.987   9.701  -4.181
  228    HE2  TYR  45          2HE       TYR  45  18.319   6.671  -1.442
  229    HH   TYR  45           HH       TYR  45  18.700   9.949  -2.759
  230    QB   TYR  45           QB       TYR  45  13.827   5.865  -3.562
  231    QD   TYR  45           QD       TYR  45  15.704   6.780  -3.420
  232    QE   TYR  45           QE       TYR  45  17.653   8.186  -2.812
  233    QR   TYR  45           QR       TYR  45  16.678   7.483  -3.116
  234    H    VAL  46           H        VAL  46  14.073   5.750  -7.272
  235    HA   VAL  46           HA       VAL  46  16.930   6.503  -7.999
  236    HB   VAL  46           HB       VAL  46  16.034   6.424 -10.286
  237   1HG1  VAL  46          1HG1      VAL  46  16.695   4.301  -9.146
  238   2HG1  VAL  46          3HG1      VAL  46  15.016   4.081  -8.652
  239   3HG1  VAL  46          2HG1      VAL  46  15.442   4.059 -10.364
  240   1HG2  VAL  46          1HG2      VAL  46  13.555   6.834  -8.878
  241   2HG2  VAL  46          3HG2      VAL  46  13.856   6.905 -10.615
  242   3HG2  VAL  46          2HG2      VAL  46  13.432   5.370  -9.855
  243    MG1  VAL  46           QG1      VAL  46  15.717   4.147  -9.387
  244    MG2  VAL  46           QG2      VAL  46  13.615   6.370  -9.783
  245    QG   VAL  46           QQG      VAL  46  14.666   5.258  -9.585
  246    H    LEU  47           H        LEU  47  15.465   8.181 -10.192
  247    HA   LEU  47           HA       LEU  47  15.839  10.768  -8.919
  248   1HB   LEU  47          2HB       LEU  47  15.854  10.138 -11.370
  249   2HB   LEU  47          1HB       LEU  47  14.095  10.041 -11.293
  250    HG   LEU  47           HG       LEU  47  15.458  12.521 -10.302
  251   1HD1  LEU  47          1HD1      LEU  47  16.227  11.726 -12.705
  252   2HD1  LEU  47          3HD1      LEU  47  14.632  12.311 -13.178
  253   3HD1  LEU  47          2HD1      LEU  47  15.788  13.411 -12.425
  254   1HD2  LEU  47          1HD2      LEU  47  12.774  11.592 -11.013
  255   2HD2  LEU  47          3HD2      LEU  47  13.254  12.967 -10.020
  256   3HD2  LEU  47          2HD2      LEU  47  13.179  13.130 -11.775
  257    MD1  LEU  47           QD1      LEU  47  15.549  12.483 -12.769
  258    MD2  LEU  47           QD2      LEU  47  13.069  12.563 -10.936
  259    QB   LEU  47           QB       LEU  47  14.974  10.089 -11.332
  260    QD   LEU  47           QQD      LEU  47  14.309  12.523 -11.853
  261    H    LEU  48           H        LEU  48  12.963   8.690  -9.359
  262    HA   LEU  48           HA       LEU  48  11.477  10.638  -7.534
  263   1HB   LEU  48          2HB       LEU  48  11.038  10.302 -10.207
  264   2HB   LEU  48          1HB       LEU  48   9.954   9.079  -9.542
  265    HG   LEU  48           HG       LEU  48   9.028  10.845  -8.002
  266   1HD1  LEU  48          3HD1      LEU  48  11.094  12.407  -9.456
  267   2HD1  LEU  48          2HD1      LEU  48   9.548  13.217  -9.200
  268   3HD1  LEU  48          1HD1      LEU  48  10.468  12.617  -7.820
  269   1HD2  LEU  48          3HD2      LEU  48   8.717  10.637 -10.910
  270   2HD2  LEU  48          2HD2      LEU  48   7.481  10.733  -9.655
  271   3HD2  LEU  48          1HD2      LEU  48   8.219  12.207 -10.280
  272    MD1  LEU  48           QD1      LEU  48  10.370  12.747  -8.825
  273    MD2  LEU  48           QD2      LEU  48   8.139  11.193 -10.282
  274    QB   LEU  48           QB       LEU  48  10.496   9.691  -9.874
  275    QD   LEU  48           QQD      LEU  48   9.255  11.970  -9.554
  276    HA   PRO  49           HA       PRO  49  11.272   6.648  -5.438
  277   1HB   PRO  49          2HB       PRO  49  10.440   7.678  -3.043
  278   2HB   PRO  49          1HB       PRO  49  12.139   7.694  -3.561
  279   1HG   PRO  49          2HG       PRO  49  10.113   9.880  -3.655
  280   2HG   PRO  49          1HG       PRO  49  11.828   9.952  -3.218
  281   1HD   PRO  49          2HD       PRO  49  10.893  10.725  -5.645
  282   2HD   PRO  49          1HD       PRO  49  12.520  10.046  -5.407
  283    QB   PRO  49           QB       PRO  49  11.289   7.686  -3.302
  284    QG   PRO  49           QG       PRO  49  10.970   9.916  -3.436
  285    QD   PRO  49           QD       PRO  49  11.706  10.386  -5.526
  286    H    ALA  50           H        ALA  50   9.326   6.829  -7.219
  287    HA   ALA  50           HA       ALA  50   6.671   7.509  -6.219
  288   1HB   ALA  50          2HB       ALA  50   7.753   5.621  -8.328
  289   2HB   ALA  50          3HB       ALA  50   7.130   7.254  -8.564
  290   3HB   ALA  50          1HB       ALA  50   6.030   5.944  -8.134
  291    MB   ALA  50           QB       ALA  50   6.971   6.273  -8.342
  292    H    LEU  51           H        LEU  51   8.706   4.607  -5.930
  293    HA   LEU  51           HA       LEU  51   6.591   2.778  -5.086
  294   1HB   LEU  51          2HB       LEU  51   8.893   2.209  -5.860
  295   2HB   LEU  51          1HB       LEU  51   9.540   2.890  -4.367
  296    HG   LEU  51           HG       LEU  51   8.055   1.258  -3.108
  297   1HD1  LEU  51          2HD1      LEU  51   7.647   0.320  -5.944
  298   2HD1  LEU  51          1HD1      LEU  51   7.507  -0.802  -4.591
  299   3HD1  LEU  51          3HD1      LEU  51   6.437   0.595  -4.691
  300   1HD2  LEU  51          2HD2      LEU  51  10.549   0.851  -4.471
  301   2HD2  LEU  51          1HD2      LEU  51  10.010   0.149  -2.946
  302   3HD2  LEU  51          3HD2      LEU  51   9.656  -0.670  -4.467
  303    MD1  LEU  51           QD1      LEU  51   7.197   0.038  -5.075
  304    MD2  LEU  51           QD2      LEU  51  10.072   0.110  -3.961
  305    QB   LEU  51           QB       LEU  51   9.217   2.549  -5.113
  306    QD   LEU  51           QQD      LEU  51   8.634   0.074  -4.518
  307    H    ALA  52           H        ALA  52   8.968   4.706  -3.166
  308    HA   ALA  52           HA       ALA  52   7.979   3.988  -0.564
  309   1HB   ALA  52          2HB       ALA  52   9.194   5.937   0.123
  310   2HB   ALA  52          3HB       ALA  52   8.940   6.723  -1.435
  311   3HB   ALA  52          1HB       ALA  52  10.021   5.336  -1.315
  312    MB   ALA  52           QB       ALA  52   9.385   5.999  -0.875
  313    H    ILE  53           H        ILE  53   6.937   6.647  -2.759
  314    HA   ILE  53           HA       ILE  53   4.918   7.713  -0.941
  315    HB   ILE  53           HB       ILE  53   5.158   7.667  -3.968
  316   1HG1  ILE  53          2HG1      ILE  53   6.000   9.772  -1.950
  317   2HG1  ILE  53          1HG1      ILE  53   7.104   8.612  -2.689
  318   1HG2  ILE  53          3HG2      ILE  53   3.562   9.477  -2.127
  319   2HG2  ILE  53          2HG2      ILE  53   3.748   9.706  -3.867
  320   3HG2  ILE  53          1HG2      ILE  53   2.892   8.292  -3.250
  321   1HD1  ILE  53          1HD1      ILE  53   5.532   9.855  -4.751
  322   2HD1  ILE  53          3HD1      ILE  53   6.257  11.108  -3.745
  323   3HD1  ILE  53          2HD1      ILE  53   7.281   9.901  -4.523
  324    MG   ILE  53           QG2      ILE  53   3.401   9.158  -3.081
  325    MD   ILE  53           QD1      ILE  53   6.356  10.288  -4.340
  326    QG   ILE  53           QG1      ILE  53   6.552   9.192  -2.320
  327    H    PHE  54           H        PHE  54   4.737   5.317  -3.624
  328    HA   PHE  54           HA       PHE  54   1.907   4.860  -3.560
  329   1HB   PHE  54          2HB       PHE  54   3.622   3.986  -5.160
  330   2HB   PHE  54          1HB       PHE  54   4.153   2.851  -3.919
  331    HD1  PHE  54          1HD       PHE  54   1.322   3.822  -6.110
  332    HD2  PHE  54          2HD       PHE  54   2.874   0.888  -3.382
  333    HE1  PHE  54          1HE       PHE  54  -0.478   2.251  -6.774
  334    HE2  PHE  54          2HE       PHE  54   1.073  -0.682  -4.047
  335    HZ   PHE  54           HZ       PHE  54  -0.603  -0.001  -5.743
  336    QB   PHE  54           QB       PHE  54   3.888   3.419  -4.539
  337    QD   PHE  54           QD       PHE  54   2.098   2.355  -4.746
  338    QE   PHE  54           QE       PHE  54   0.297   0.784  -5.410
  339    QR   PHE  54           QR       PHE  54   0.837   1.255  -5.211
  340    H    ILE  55           H        ILE  55   4.495   3.270  -1.611
  341    HA   ILE  55           HA       ILE  55   2.692   1.521  -0.138
  342    HB   ILE  55           HB       ILE  55   5.337   2.822   0.590
  343   1HG1  ILE  55          2HG1      ILE  55   5.449   1.550  -1.496
  344   2HG1  ILE  55          1HG1      ILE  55   6.265   0.649  -0.218
  345   1HG2  ILE  55          1HG2      ILE  55   3.886   0.418   1.736
  346   2HG2  ILE  55          3HG2      ILE  55   5.569   0.815   2.081
  347   3HG2  ILE  55          2HG2      ILE  55   4.283   1.914   2.582
  348   1HD1  ILE  55          3HD1      ILE  55   3.659  -0.226   0.014
  349   2HD1  ILE  55          2HD1      ILE  55   3.841  -0.036  -1.730
  350   3HD1  ILE  55          1HD1      ILE  55   4.942  -1.085  -0.838
  351    MG   ILE  55           QG2      ILE  55   4.579   1.049   2.133
  352    MD   ILE  55           QD1      ILE  55   4.148  -0.449  -0.851
  353    QG   ILE  55           QG1      ILE  55   5.857   1.099  -0.857
  354    H    GLY  56           H        GLY  56   3.985   4.800   0.614
  355   1HA   GLY  56          1HA       GLY  56   3.072   6.422   2.086
  356   2HA   GLY  56          2HA       GLY  56   2.752   5.083   3.188
  357    QA   GLY  56           QA       GLY  56   2.912   5.752   2.637
  358    H    LEU  57           H        LEU  57   1.411   6.034  -0.031
  359    HA   LEU  57           HA       LEU  57  -1.211   6.754   1.004
  360   1HB   LEU  57          2HB       LEU  57  -0.181   7.236  -1.246
  361   2HB   LEU  57          1HB       LEU  57  -0.464   5.549  -1.677
  362    HG   LEU  57           HG       LEU  57  -2.743   7.191  -0.621
  363   1HD1  LEU  57          2HD1      LEU  57  -1.652   7.231  -3.451
  364   2HD1  LEU  57          1HD1      LEU  57  -3.264   7.794  -3.008
  365   3HD1  LEU  57          3HD1      LEU  57  -1.838   8.610  -2.366
  366   1HD2  LEU  57          2HD2      LEU  57  -2.287   4.680  -2.153
  367   2HD2  LEU  57          1HD2      LEU  57  -3.523   5.056  -0.953
  368   3HD2  LEU  57          3HD2      LEU  57  -3.702   5.629  -2.611
  369    MD1  LEU  57           QD1      LEU  57  -2.251   7.878  -2.942
  370    MD2  LEU  57           QD2      LEU  57  -3.171   5.122  -1.905
  371    QB   LEU  57           QB       LEU  57  -0.322   6.393  -1.462
  372    QD   LEU  57           QQD      LEU  57  -2.711   6.500  -2.424
  373    H    THR  58           H        THR  58   0.163   3.642  -0.122
  374    HA   THR  58           HA       THR  58  -2.341   2.151  -0.036
  375    HB   THR  58           HB       THR  58   0.546   1.327   0.416
  376    HG1  THR  58          1HG       THR  58  -0.957   2.047  -1.775
  377   1HG2  THR  58          2HG2      THR  58  -1.943  -0.165   0.416
  378   2HG2  THR  58          1HG2      THR  58  -0.877  -0.708  -0.880
  379   3HG2  THR  58          3HG2      THR  58  -0.312  -0.718   0.791
  380    MG   THR  58           QG2      THR  58  -1.044  -0.530   0.109
  381    H    ILE  59           H        ILE  59   0.330   2.420   2.378
  382    HA   ILE  59           HA       ILE  59  -1.093   0.907   4.436
  383    HB   ILE  59           HB       ILE  59   1.084   3.015   4.568
  384   1HG1  ILE  59          2HG1      ILE  59   1.658   1.153   3.086
  385   2HG1  ILE  59          1HG1      ILE  59   2.574   1.005   4.586
  386   1HG2  ILE  59          2HG2      ILE  59  -0.239   1.341   6.596
  387   2HG2  ILE  59          1HG2      ILE  59   1.519   1.203   6.597
  388   3HG2  ILE  59          3HG2      ILE  59   0.758   2.781   6.804
  389   1HD1  ILE  59          2HD1      ILE  59   0.684  -0.505   5.422
  390   2HD1  ILE  59          1HD1      ILE  59   0.115  -0.545   3.752
  391   3HD1  ILE  59          3HD1      ILE  59   1.712  -1.176   4.155
  392    MG   ILE  59           QG2      ILE  59   0.679   1.775   6.666
  393    MD   ILE  59           QD1      ILE  59   0.837  -0.742   4.443
  394    QG   ILE  59           QG1      ILE  59   2.116   1.079   3.836
  395    H    TYR  60           H        TYR  60  -0.792   4.454   3.813
  396    HA   TYR  60           HA       TYR  60  -2.266   5.308   6.156
  397   1HB   TYR  60          2HB       TYR  60  -0.955   6.692   4.502
  398   2HB   TYR  60          1HB       TYR  60  -2.277   6.485   3.354
  399    HD1  TYR  60          1HD       TYR  60  -3.519   8.437   3.161
  400    HD2  TYR  60          2HD       TYR  60  -2.142   7.210   7.040
  401    HE1  TYR  60          1HE       TYR  60  -4.737  10.334   4.194
  402    HE2  TYR  60          2HE       TYR  60  -3.360   9.110   8.073
  403    HH   TYR  60           HH       TYR  60  -4.222  11.316   7.411
  404    QB   TYR  60           QB       TYR  60  -1.616   6.588   3.928
  405    QD   TYR  60           QD       TYR  60  -2.831   7.823   5.101
  406    QE   TYR  60           QE       TYR  60  -4.049   9.722   6.133
  407    QR   TYR  60           QR       TYR  60  -3.440   8.773   5.617
  408    H    ALA  61           H        ALA  61  -3.423   4.614   2.811
  409    HA   ALA  61           HA       ALA  61  -6.228   5.050   3.328
  410   1HB   ALA  61          1HB       ALA  61  -6.319   3.256   1.399
  411   2HB   ALA  61          3HB       ALA  61  -5.555   4.819   1.101
  412   3HB   ALA  61          2HB       ALA  61  -4.563   3.404   1.449
  413    MB   ALA  61           QB       ALA  61  -5.479   3.826   1.317
  414    H    ILE  62           H        ILE  62  -4.216   2.103   3.754
  415    HA   ILE  62           HA       ILE  62  -6.430   0.337   4.412
  416    HB   ILE  62           HB       ILE  62  -3.493   0.439   5.124
  417   1HG1  ILE  62          2HG1      ILE  62  -4.936  -1.423   3.233
  418   2HG1  ILE  62          1HG1      ILE  62  -4.368   0.163   2.709
  419   1HG2  ILE  62          1HG2      ILE  62  -5.615  -1.318   6.111
  420   2HG2  ILE  62          3HG2      ILE  62  -4.329  -2.209   5.296
  421   3HG2  ILE  62          2HG2      ILE  62  -3.947  -1.160   6.661
  422   1HD1  ILE  62          3HD1      ILE  62  -2.231  -1.022   4.137
  423   2HD1  ILE  62          2HD1      ILE  62  -2.856  -2.264   3.052
  424   3HD1  ILE  62          1HD1      ILE  62  -2.321  -0.713   2.403
  425    MG   ILE  62           QG2      ILE  62  -4.630  -1.562   6.022
  426    MD   ILE  62           QD1      ILE  62  -2.469  -1.333   3.197
  427    QG   ILE  62           QG1      ILE  62  -4.652  -0.630   2.971
  428    H    GLN  63           H        GLN  63  -4.271   2.318   6.521
  429    HA   GLN  63           HA       GLN  63  -5.452   1.457   9.029
  430   1HB   GLN  63          2HB       GLN  63  -3.337   2.766   8.603
  431   2HB   GLN  63          1HB       GLN  63  -4.344   4.180   8.286
  432   1HG   GLN  63          2HG       GLN  63  -5.346   3.937  10.552
  433   2HG   GLN  63          1HG       GLN  63  -4.246   2.595  10.868
  434   1HE2  GLN  63          1HE2      GLN  63  -2.338   3.144  11.914
  435   2HE2  GLN  63          2HE2      GLN  63  -1.594   4.782  11.837
  436    QB   GLN  63           QB       GLN  63  -3.840   3.473   8.445
  437    QG   GLN  63           QG       GLN  63  -4.796   3.266  10.710
  438    QE   GLN  63           QE2      GLN  63  -1.966   3.963  11.875
  439    H    ARG  64           H        ARG  64  -6.324   4.125   6.785
  440    HA   ARG  64           HA       ARG  64  -8.429   5.219   8.495
  441   1HB   ARG  64          2HB       ARG  64  -7.966   5.183   5.496
  442   2HB   ARG  64          1HB       ARG  64  -9.127   6.236   6.306
  443   1HG   ARG  64          2HG       ARG  64  -7.313   7.238   7.631
  444   2HG   ARG  64          1HG       ARG  64  -6.143   6.174   6.847
  445   1HD   ARG  64          2HD       ARG  64  -6.090   8.340   5.721
  446   2HD   ARG  64          1HD       ARG  64  -6.858   7.171   4.627
  447    HE   ARG  64           HE       ARG  64  -8.556   8.873   6.495
  448   1HH1  ARG  64          1HH1      ARG  64 -10.058   7.093   4.738
  449   2HH1  ARG  64          2HH1      ARG  64 -10.346   8.028   3.308
  450   1HH2  ARG  64          1HH2      ARG  64  -7.846  10.332   3.992
  451   2HH2  ARG  64          2HH2      ARG  64  -9.094   9.862   2.887
  452    QB   ARG  64           QB       ARG  64  -8.547   5.709   5.901
  453    QG   ARG  64           QG       ARG  64  -6.728   6.706   7.239
  454    QD   ARG  64           QD       ARG  64  -6.474   7.755   5.174
  455    QH1  ARG  64           QH1      ARG  64 -10.202   7.561   4.023
  456    QH2  ARG  64           QH2      ARG  64  -8.470  10.097   3.440
  457    H    LYS  65           H        LYS  65  -8.566   2.990   5.657
  458    HA   LYS  65           HA       LYS  65 -11.396   2.467   5.790
  459   1HB   LYS  65          2HB       LYS  65 -10.174   1.729   3.911
  460   2HB   LYS  65          1HB       LYS  65  -8.944   0.951   4.906
  461   1HG   LYS  65          2HG       LYS  65 -11.736  -0.039   5.208
  462   2HG   LYS  65          1HG       LYS  65 -10.906  -0.443   3.705
  463   1HD   LYS  65          2HD       LYS  65  -8.936  -1.012   5.462
  464   2HD   LYS  65          1HD       LYS  65 -10.338  -1.340   6.481
  465   1HE   LYS  65          2HE       LYS  65 -11.114  -2.566   4.165
  466   2HE   LYS  65          1HE       LYS  65  -9.357  -2.820   4.111
  467   1HZ   LYS  65          1HZ       LYS  65 -10.916  -3.238   6.592
  468   2HZ   LYS  65          3HZ       LYS  65 -10.717  -4.481   5.455
  469   3HZ   LYS  65          2HZ       LYS  65  -9.358  -3.802   6.216
  470    QB   LYS  65           QB       LYS  65  -9.559   1.340   4.409
  471    QD   LYS  65           QD       LYS  65  -9.637  -1.176   5.972
  472    QG   LYS  65           QG       LYS  65 -11.321  -0.241   4.457
  473    QE   LYS  65           QE       LYS  65 -10.236  -2.693   4.138
  474    QZ   LYS  65           QZ       LYS  65 -10.330  -3.841   6.088
  475    H    ARG  66           H        ARG  66  -8.673   0.633   7.302
  476    HA   ARG  66           HA       ARG  66 -10.375  -1.235   8.739
  477   1HB   ARG  66          2HB       ARG  66  -7.626  -0.056   9.247
  478   2HB   ARG  66          1HB       ARG  66  -8.278  -1.414  10.165
  479   1HG   ARG  66          2HG       ARG  66  -8.606  -2.648   8.010
  480   2HG   ARG  66          1HG       ARG  66  -7.804  -1.320   7.172
  481   1HD   ARG  66          2HD       ARG  66  -5.780  -1.681   8.602
  482   2HD   ARG  66          1HD       ARG  66  -6.582  -3.092   9.318
  483    HE   ARG  66           HE       ARG  66  -6.764  -3.300   6.422
  484   1HH1  ARG  66          1HH1      ARG  66  -5.866  -5.578   6.367
  485   2HH1  ARG  66          2HH1      ARG  66  -4.186  -5.727   6.759
  486   1HH2  ARG  66          1HH2      ARG  66  -3.958  -2.561   8.156
  487   2HH2  ARG  66          2HH2      ARG  66  -3.106  -4.020   7.771
  488    QB   ARG  66           QB       ARG  66  -7.952  -0.735   9.706
  489    QG   ARG  66           QG       ARG  66  -8.205  -1.984   7.591
  490    QD   ARG  66           QD       ARG  66  -6.181  -2.386   8.960
  491    QH1  ARG  66           QH1      ARG  66  -5.026  -5.652   6.563
  492    QH2  ARG  66           QH2      ARG  66  -3.532  -3.291   7.964
  493    H    GLN  67           H        GLN  67  -9.229   2.061   9.494
  494    HA   GLN  67           HA       GLN  67 -11.358   2.274  11.595
  495   1HB   GLN  67          2HB       GLN  67  -9.434   1.113  12.693
  496   2HB   GLN  67          1HB       GLN  67  -8.407   2.485  12.277
  497   1HG   GLN  67          2HG       GLN  67  -9.973   3.974  13.551
  498   2HG   GLN  67          1HG       GLN  67 -10.850   2.534  14.070
  499   1HE2  GLN  67          1HE2      GLN  67 -10.266   1.869  16.129
  500   2HE2  GLN  67          2HE2      GLN  67  -8.597   2.012  16.790
  501    QB   GLN  67           QB       GLN  67  -8.920   1.799  12.485
  502    QG   GLN  67           QG       GLN  67 -10.412   3.254  13.811
  503    QE   GLN  67           QE2      GLN  67  -9.432   1.940  16.459
  504    H    ALA  68           H        ALA  68 -12.039   4.403  11.760
  505    HA   ALA  68           HA       ALA  68 -10.488   6.383  10.076
  506   1HB   ALA  68          2HB       ALA  68 -13.142   6.757  11.468
  507   2HB   ALA  68          3HB       ALA  68 -13.015   5.828   9.974
  508   3HB   ALA  68          1HB       ALA  68 -12.563   7.533   9.994
  509    MB   ALA  68           QB       ALA  68 -12.907   6.706  10.479
  510    H    ASP  69           H        ASP  69  -9.436   8.165  10.929
  511    HA   ASP  69           HA       ASP  69  -8.909   8.194  13.827
  512   1HB   ASP  69          2HB       ASP  69  -8.451  10.176  11.573
  513   2HB   ASP  69          1HB       ASP  69  -7.728  10.313  13.176
  514    QB   ASP  69           QB       ASP  69  -8.090  10.245  12.375

  No H/Q in entry =         514
  Start of MODEL   15
    1    H    THR  24           H        THR  24 -15.497  -4.357  10.080
    2    HA   THR  24           HA       THR  24 -13.281  -3.948   9.275
    3    HB   THR  24           HB       THR  24 -11.825  -5.682   9.825
    4    HG1  THR  24          1HG       THR  24 -12.290  -7.837   9.347
    5   1HG2  THR  24          2HG2      THR  24 -13.864  -5.366  11.489
    6   2HG2  THR  24          1HG2      THR  24 -14.223  -7.025  11.010
    7   3HG2  THR  24          3HG2      THR  24 -12.672  -6.638  11.757
    8    MG   THR  24           QG2      THR  24 -13.586  -6.343  11.419
    9    HA   PRO  25           HA       PRO  25 -13.875  -4.451   4.890
   10   1HB   PRO  25          2HB       PRO  25 -11.791  -2.854   4.121
   11   2HB   PRO  25          1HB       PRO  25 -13.340  -2.209   4.699
   12   1HG   PRO  25          2HG       PRO  25 -10.756  -2.503   6.144
   13   2HG   PRO  25          1HG       PRO  25 -11.949  -1.197   6.218
   14   1HD   PRO  25          2HD       PRO  25 -11.721  -3.141   8.121
   15   2HD   PRO  25          1HD       PRO  25 -13.237  -2.283   7.765
   16    QB   PRO  25           QB       PRO  25 -12.566  -2.532   4.410
   17    QG   PRO  25           QG       PRO  25 -11.352  -1.850   6.181
   18    QD   PRO  25           QD       PRO  25 -12.479  -2.712   7.943
   19    H    VAL  26           H        VAL  26 -13.027  -6.770   5.658
   20    HA   VAL  26           HA       VAL  26 -10.240  -7.453   5.427
   21    HB   VAL  26           HB       VAL  26 -12.255  -8.805   6.204
   22   1HG1  VAL  26          3HG1      VAL  26 -13.603  -8.332   4.139
   23   2HG1  VAL  26          2HG1      VAL  26 -12.504  -9.371   3.234
   24   3HG1  VAL  26          1HG1      VAL  26 -13.496 -10.049   4.524
   25   1HG2  VAL  26          2HG2      VAL  26  -9.946  -9.715   4.599
   26   2HG2  VAL  26          1HG2      VAL  26 -10.483 -10.239   6.195
   27   3HG2  VAL  26          3HG2      VAL  26 -11.245 -10.898   4.748
   28    MG1  VAL  26           QG1      VAL  26 -13.201  -9.251   3.966
   29    MG2  VAL  26           QG2      VAL  26 -10.558 -10.284   5.181
   30    QG   VAL  26           QQG      VAL  26 -11.879  -9.767   4.573
   31    H    LEU  27           H        LEU  27 -12.742  -6.995   2.918
   32    HA   LEU  27           HA       LEU  27 -11.327  -8.138   0.685
   33   1HB   LEU  27          2HB       LEU  27 -13.673  -7.322   0.759
   34   2HB   LEU  27          1HB       LEU  27 -13.080  -5.663   0.835
   35    HG   LEU  27           HG       LEU  27 -11.829  -6.161  -1.338
   36   1HD1  LEU  27          3HD1      LEU  27 -13.181  -8.719  -0.835
   37   2HD1  LEU  27          2HD1      LEU  27 -13.463  -8.090  -2.458
   38   3HD1  LEU  27          1HD1      LEU  27 -11.815  -8.359  -1.891
   39   1HD2  LEU  27          1HD2      LEU  27 -14.349  -5.191  -0.860
   40   2HD2  LEU  27          3HD2      LEU  27 -13.577  -5.207  -2.446
   41   3HD2  LEU  27          2HD2      LEU  27 -14.690  -6.500  -1.993
   42    MD1  LEU  27           QD1      LEU  27 -12.820  -8.389  -1.728
   43    MD2  LEU  27           QD2      LEU  27 -14.205  -5.633  -1.766
   44    QB   LEU  27           QB       LEU  27 -13.377  -6.493   0.797
   45    QD   LEU  27           QQD      LEU  27 -13.513  -7.011  -1.747
   46    H    VAL  28           H        VAL  28 -11.144  -4.855   2.118
   47    HA   VAL  28           HA       VAL  28  -9.363  -3.716   0.135
   48    HB   VAL  28           HB       VAL  28  -9.811  -3.269   3.098
   49   1HG1  VAL  28          1HG1      VAL  28  -8.248  -1.631   1.084
   50   2HG1  VAL  28          3HG1      VAL  28  -8.809  -0.995   2.630
   51   3HG1  VAL  28          2HG1      VAL  28  -7.651  -2.325   2.591
   52   1HG2  VAL  28          1HG2      VAL  28 -10.807  -1.874   0.593
   53   2HG2  VAL  28          3HG2      VAL  28 -11.764  -2.896   1.665
   54   3HG2  VAL  28          2HG2      VAL  28 -11.148  -1.347   2.241
   55    MG1  VAL  28           QG1      VAL  28  -8.236  -1.650   2.102
   56    MG2  VAL  28           QG2      VAL  28 -11.240  -2.039   1.500
   57    QG   VAL  28           QQG      VAL  28  -9.738  -1.844   1.801
   58    H    ILE  29           H        ILE  29  -8.655  -5.405   3.243
   59    HA   ILE  29           HA       ILE  29  -5.750  -5.175   2.977
   60    HB   ILE  29           HB       ILE  29  -7.544  -7.187   4.375
   61   1HG1  ILE  29          2HG1      ILE  29  -6.221  -4.664   5.417
   62   2HG1  ILE  29          1HG1      ILE  29  -7.917  -4.772   4.947
   63   1HG2  ILE  29          1HG2      ILE  29  -4.595  -6.608   4.496
   64   2HG2  ILE  29          3HG2      ILE  29  -5.435  -7.192   5.932
   65   3HG2  ILE  29          2HG2      ILE  29  -5.419  -8.166   4.463
   66   1HD1  ILE  29          2HD1      ILE  29  -6.663  -6.593   7.014
   67   2HD1  ILE  29          1HD1      ILE  29  -7.467  -5.079   7.429
   68   3HD1  ILE  29          3HD1      ILE  29  -8.379  -6.382   6.666
   69    MG   ILE  29           QG2      ILE  29  -5.150  -7.322   4.964
   70    MD   ILE  29           QD1      ILE  29  -7.503  -6.018   7.036
   71    QG   ILE  29           QG1      ILE  29  -7.069  -4.718   5.182
   72    H    LEU  30           H        LEU  30  -8.129  -7.631   1.915
   73    HA   LEU  30           HA       LEU  30  -6.191  -9.635   1.091
   74   1HB   LEU  30          2HB       LEU  30  -8.648  -9.900   1.410
   75   2HB   LEU  30          1HB       LEU  30  -8.919  -8.928  -0.038
   76    HG   LEU  30           HG       LEU  30  -7.465 -10.614  -1.283
   77   1HD1  LEU  30          2HD1      LEU  30  -7.775 -11.962   1.396
   78   2HD1  LEU  30          1HD1      LEU  30  -7.563 -12.915  -0.073
   79   3HD1  LEU  30          3HD1      LEU  30  -6.317 -11.769   0.421
   80   1HD2  LEU  30          2HD2      LEU  30 -10.194 -10.621  -0.611
   81   2HD2  LEU  30          1HD2      LEU  30  -9.438 -11.484  -1.951
   82   3HD2  LEU  30          3HD2      LEU  30  -9.667 -12.291  -0.400
   83    MD1  LEU  30           QD1      LEU  30  -7.218 -12.215   0.581
   84    MD2  LEU  30           QD2      LEU  30  -9.767 -11.465  -0.988
   85    QB   LEU  30           QB       LEU  30  -8.783  -9.414   0.686
   86    QD   LEU  30           QQD      LEU  30  -8.492 -11.840  -0.203
   87    H    LEU  31           H        LEU  31  -7.747  -6.935  -0.714
   88    HA   LEU  31           HA       LEU  31  -6.505  -7.548  -3.273
   89   1HB   LEU  31          2HB       LEU  31  -7.461  -4.988  -1.958
   90   2HB   LEU  31          1HB       LEU  31  -7.064  -5.118  -3.672
   91    HG   LEU  31           HG       LEU  31  -9.146  -6.786  -2.230
   92   1HD1  LEU  31          2HD1      LEU  31  -9.311  -4.354  -4.014
   93   2HD1  LEU  31          1HD1      LEU  31 -10.669  -5.465  -3.837
   94   3HD1  LEU  31          3HD1      LEU  31 -10.048  -4.600  -2.430
   95   1HD2  LEU  31          2HD2      LEU  31  -7.829  -6.955  -4.854
   96   2HD2  LEU  31          1HD2      LEU  31  -8.766  -8.173  -3.987
   97   3HD2  LEU  31          3HD2      LEU  31  -9.589  -6.947  -4.952
   98    MD1  LEU  31           QD1      LEU  31 -10.010  -4.806  -3.427
   99    MD2  LEU  31           QD2      LEU  31  -8.728  -7.358  -4.598
  100    QB   LEU  31           QB       LEU  31  -7.263  -5.053  -2.815
  101    QD   LEU  31           QQD      LEU  31  -9.369  -6.082  -4.012
  102    H    GLY  32           H        GLY  32  -5.465  -5.431  -0.553
  103   1HA   GLY  32          1HA       GLY  32  -3.324  -4.470  -0.180
  104   2HA   GLY  32          2HA       GLY  32  -3.070  -4.477  -1.926
  105    QA   GLY  32           QA       GLY  32  -3.197  -4.473  -1.053
  106    H    VAL  33           H        VAL  33  -3.741  -7.288   0.172
  107    HA   VAL  33           HA       VAL  33  -1.013  -8.159   0.545
  108    HB   VAL  33           HB       VAL  33  -3.666  -9.601   0.255
  109   1HG1  VAL  33          2HG1      VAL  33  -0.923 -10.615   0.990
  110   2HG1  VAL  33          1HG1      VAL  33  -2.374 -11.389   1.627
  111   3HG1  VAL  33          3HG1      VAL  33  -2.101 -11.325  -0.114
  112   1HG2  VAL  33          3HG2      VAL  33  -2.739  -7.879   2.204
  113   2HG2  VAL  33          2HG2      VAL  33  -3.983  -9.104   2.448
  114   3HG2  VAL  33          1HG2      VAL  33  -2.305  -9.458   2.858
  115    MG1  VAL  33           QG1      VAL  33  -1.799 -11.110   0.834
  116    MG2  VAL  33           QG2      VAL  33  -3.009  -8.814   2.503
  117    QG   VAL  33           QQG      VAL  33  -2.404  -9.962   1.669
  118    H    VAL  34           H        VAL  34  -3.376  -8.962  -2.048
  119    HA   VAL  34           HA       VAL  34  -1.667 -10.767  -3.518
  120    HB   VAL  34           HB       VAL  34  -3.847  -8.823  -4.323
  121   1HG1  VAL  34          3HG1      VAL  34  -2.166 -10.636  -5.923
  122   2HG1  VAL  34          2HG1      VAL  34  -3.897 -10.879  -6.151
  123   3HG1  VAL  34          1HG1      VAL  34  -3.183  -9.293  -6.444
  124   1HG2  VAL  34          3HG2      VAL  34  -4.057 -10.938  -2.676
  125   2HG2  VAL  34          2HG2      VAL  34  -5.335 -10.504  -3.810
  126   3HG2  VAL  34          1HG2      VAL  34  -4.192 -11.784  -4.219
  127    MG1  VAL  34           QG1      VAL  34  -3.082 -10.270  -6.173
  128    MG2  VAL  34           QG2      VAL  34  -4.528 -11.075  -3.568
  129    QG   VAL  34           QQG      VAL  34  -3.805 -10.672  -4.871
  130    H    GLY  35           H        GLY  35  -2.015  -7.190  -3.710
  131   1HA   GLY  35          1HA       GLY  35  -0.564  -5.636  -4.767
  132   2HA   GLY  35          2HA       GLY  35  -0.286  -6.859  -6.009
  133    QA   GLY  35           QA       GLY  35  -0.425  -6.247  -5.388
  134    H    LEU  36           H        LEU  36   0.453  -7.066  -2.504
  135    HA   LEU  36           HA       LEU  36   3.269  -6.408  -2.718
  136   1HB   LEU  36          2HB       LEU  36   1.726  -8.269  -0.884
  137   2HB   LEU  36          1HB       LEU  36   3.354  -7.676  -0.559
  138    HG   LEU  36           HG       LEU  36   0.884  -5.955  -0.925
  139   1HD1  LEU  36          3HD1      LEU  36   1.128  -7.285   1.236
  140   2HD1  LEU  36          2HD1      LEU  36   2.586  -6.342   1.547
  141   3HD1  LEU  36          1HD1      LEU  36   1.023  -5.535   1.428
  142   1HD2  LEU  36          3HD2      LEU  36   3.752  -5.398  -1.035
  143   2HD2  LEU  36          2HD2      LEU  36   2.394  -4.357  -1.463
  144   3HD2  LEU  36          1HD2      LEU  36   2.938  -4.453   0.212
  145    MD1  LEU  36           QD1      LEU  36   1.579  -6.387   1.404
  146    MD2  LEU  36           QD2      LEU  36   3.028  -4.736  -0.762
  147    QB   LEU  36           QB       LEU  36   2.540  -7.972  -0.721
  148    QD   LEU  36           QQD      LEU  36   2.304  -5.562   0.321
  149    H    SER  37           H        SER  37   1.524  -9.520  -3.089
  150    HA   SER  37           HA       SER  37   3.844 -11.234  -3.224
  151   1HB   SER  37          2HB       SER  37   2.271 -12.788  -4.104
  152   2HB   SER  37          1HB       SER  37   1.309 -11.695  -3.114
  153    HG   SER  37           HG       SER  37   0.326 -11.039  -4.851
  154    QB   SER  37           QB       SER  37   1.790 -12.242  -3.609
  155    H    ALA  38           H        ALA  38   2.055  -9.584  -5.899
  156    HA   ALA  38           HA       ALA  38   3.690 -10.501  -8.066
  157   1HB   ALA  38          1HB       ALA  38   1.556  -9.028  -7.924
  158   2HB   ALA  38          2HB       ALA  38   2.698  -8.689  -9.224
  159   3HB   ALA  38          3HB       ALA  38   2.675  -7.671  -7.783
  160    MB   ALA  38           QB       ALA  38   2.310  -8.463  -8.310
  161    H    LEU  39           H        LEU  39   4.311  -7.959  -5.649
  162    HA   LEU  39           HA       LEU  39   6.953  -7.380  -7.053
  163   1HB   LEU  39          2HB       LEU  39   5.309  -5.552  -6.613
  164   2HB   LEU  39          1HB       LEU  39   5.442  -5.887  -4.886
  165    HG   LEU  39           HG       LEU  39   7.957  -5.529  -5.151
  166   1HD1  LEU  39          3HD1      LEU  39   6.954  -4.868  -7.880
  167   2HD1  LEU  39          2HD1      LEU  39   8.219  -3.833  -7.215
  168   3HD1  LEU  39          1HD1      LEU  39   8.497  -5.566  -7.387
  169   1HD2  LEU  39          3HD2      LEU  39   5.985  -3.278  -5.635
  170   2HD2  LEU  39          2HD2      LEU  39   6.605  -3.836  -4.082
  171   3HD2  LEU  39          1HD2      LEU  39   7.677  -3.014  -5.216
  172    MD1  LEU  39           QD1      LEU  39   7.890  -4.756  -7.494
  173    MD2  LEU  39           QD2      LEU  39   6.755  -3.376  -4.978
  174    QB   LEU  39           QB       LEU  39   5.375  -5.719  -5.750
  175    QD   LEU  39           QQD      LEU  39   7.323  -4.066  -6.236
  176    H    THR  40           H        THR  40   8.524  -8.760  -6.263
  177    HA   THR  40           HA       THR  40   8.901  -8.712  -3.254
  178    HB   THR  40           HB       THR  40   7.439 -10.655  -4.018
  179    HG1  THR  40          1HG       THR  40   8.383 -11.074  -2.144
  180   1HG2  THR  40          3HG2      THR  40   9.084 -10.862  -6.107
  181   2HG2  THR  40          2HG2      THR  40   9.925 -11.968  -5.020
  182   3HG2  THR  40          1HG2      THR  40   8.243 -12.268  -5.455
  183    MG   THR  40           QG2      THR  40   9.084 -11.699  -5.527
  184    H    GLY  41           H        GLY  41  10.396  -7.420  -5.412
  185   1HA   GLY  41          1HA       GLY  41  12.522  -7.903  -6.634
  186   2HA   GLY  41          2HA       GLY  41  12.870  -9.194  -5.482
  187    QA   GLY  41           QA       GLY  41  12.696  -8.548  -6.058
  188    H    TYR  42           H        TYR  42  14.414  -6.693  -6.294
  189    HA   TYR  42           HA       TYR  42  14.501  -5.365  -3.548
  190   1HB   TYR  42          2HB       TYR  42  16.808  -6.476  -5.178
  191   2HB   TYR  42          1HB       TYR  42  16.960  -5.629  -3.638
  192    HD1  TYR  42          1HD       TYR  42  16.210  -8.785  -5.267
  193    HD2  TYR  42          2HD       TYR  42  15.913  -6.621  -1.568
  194    HE1  TYR  42          1HE       TYR  42  15.815 -10.913  -4.053
  195    HE2  TYR  42          2HE       TYR  42  15.519  -8.748  -0.355
  196    HH   TYR  42           HH       TYR  42  16.269 -11.590  -1.336
  197    QB   TYR  42           QB       TYR  42  16.884  -6.053  -4.408
  198    QD   TYR  42           QD       TYR  42  16.061  -7.703  -3.417
  199    QE   TYR  42           QE       TYR  42  15.667  -9.831  -2.204
  200    QR   TYR  42           QR       TYR  42  15.864  -8.767  -2.811
  201    H    LEU  43           H        LEU  43  15.120  -3.175  -3.565
  202    HA   LEU  43           HA       LEU  43  16.310  -1.885  -5.915
  203   1HB   LEU  43          2HB       LEU  43  14.106  -2.557  -6.852
  204   2HB   LEU  43          1HB       LEU  43  13.301  -1.649  -5.572
  205    HG   LEU  43           HG       LEU  43  14.587   0.395  -6.378
  206   1HD1  LEU  43          1HD1      LEU  43  15.873  -1.556  -7.953
  207   2HD1  LEU  43          3HD1      LEU  43  14.892  -0.616  -9.077
  208   3HD1  LEU  43          2HD1      LEU  43  16.079   0.193  -8.056
  209   1HD2  LEU  43          2HD2      LEU  43  12.506  -1.036  -8.026
  210   2HD2  LEU  43          1HD2      LEU  43  12.303   0.351  -6.955
  211   3HD2  LEU  43          3HD2      LEU  43  13.106   0.550  -8.512
  212    MD1  LEU  43           QD1      LEU  43  15.615  -0.660  -8.362
  213    MD2  LEU  43           QD2      LEU  43  12.638  -0.045  -7.831
  214    QB   LEU  43           QB       LEU  43  13.704  -2.103  -6.212
  215    QD   LEU  43           QQD      LEU  43  14.126  -0.352  -8.097
  216    H    ASP  44           H        ASP  44  16.883   0.261  -5.412
  217    HA   ASP  44           HA       ASP  44  15.929   1.194  -2.671
  218   1HB   ASP  44          2HB       ASP  44  18.383   0.777  -3.283
  219   2HB   ASP  44          1HB       ASP  44  18.254   2.185  -4.337
  220    QB   ASP  44           QB       ASP  44  18.319   1.481  -3.810
  221    H    TYR  45           H        TYR  45  15.550   3.563  -2.416
  222    HA   TYR  45           HA       TYR  45  13.684   4.559  -4.392
  223   1HB   TYR  45          2HB       TYR  45  13.686   6.491  -2.991
  224   2HB   TYR  45          1HB       TYR  45  14.084   5.149  -1.917
  225    HD1  TYR  45          1HD       TYR  45  15.367   8.136  -3.635
  226    HD2  TYR  45          2HD       TYR  45  16.368   4.830  -1.080
  227    HE1  TYR  45          1HE       TYR  45  17.507   9.240  -3.044
  228    HE2  TYR  45          2HE       TYR  45  18.508   5.935  -0.488
  229    HH   TYR  45           HH       TYR  45  19.576   8.861  -2.120
  230    QB   TYR  45           QB       TYR  45  13.885   5.820  -2.454
  231    QD   TYR  45           QD       TYR  45  15.867   6.483  -2.357
  232    QE   TYR  45           QE       TYR  45  18.007   7.588  -1.766
  233    QR   TYR  45           QR       TYR  45  16.937   7.035  -2.062
  234    H    VAL  46           H        VAL  46  13.896   5.859  -6.208
  235    HA   VAL  46           HA       VAL  46  16.770   6.443  -7.026
  236    HB   VAL  46           HB       VAL  46  14.376   6.684  -8.814
  237   1HG1  VAL  46          3HG1      VAL  46  16.909   7.025  -9.380
  238   2HG1  VAL  46          2HG1      VAL  46  16.970   5.263  -9.367
  239   3HG1  VAL  46          1HG1      VAL  46  15.903   6.100 -10.494
  240   1HG2  VAL  46          1HG2      VAL  46  15.463   4.139  -7.608
  241   2HG2  VAL  46          3HG2      VAL  46  13.781   4.641  -7.779
  242   3HG2  VAL  46          2HG2      VAL  46  14.700   4.139  -9.198
  243    MG1  VAL  46           QG1      VAL  46  16.594   6.129  -9.747
  244    MG2  VAL  46           QG2      VAL  46  14.648   4.306  -8.195
  245    QG   VAL  46           QQG      VAL  46  15.621   5.218  -8.971
  246    H    LEU  47           H        LEU  47  15.260   8.262  -9.107
  247    HA   LEU  47           HA       LEU  47  15.869  10.793  -7.816
  248   1HB   LEU  47          2HB       LEU  47  15.696  10.293 -10.259
  249   2HB   LEU  47          1HB       LEU  47  13.948  10.151 -10.078
  250    HG   LEU  47           HG       LEU  47  13.978  12.509  -9.118
  251   1HD1  LEU  47          2HD1      LEU  47  16.806  12.045  -9.453
  252   2HD1  LEU  47          1HD1      LEU  47  16.313  13.429 -10.428
  253   3HD1  LEU  47          3HD1      LEU  47  15.995  13.415  -8.694
  254   1HD2  LEU  47          2HD2      LEU  47  14.839  11.964 -11.973
  255   2HD2  LEU  47          1HD2      LEU  47  13.195  12.177 -11.372
  256   3HD2  LEU  47          3HD2      LEU  47  14.303  13.548 -11.415
  257    MD1  LEU  47           QD1      LEU  47  16.372  12.963  -9.525
  258    MD2  LEU  47           QD2      LEU  47  14.112  12.563 -11.587
  259    QB   LEU  47           QB       LEU  47  14.822  10.222 -10.169
  260    QD   LEU  47           QQD      LEU  47  15.242  12.763 -10.556
  261    H    LEU  48           H        LEU  48  12.884   8.849  -8.009
  262    HA   LEU  48           HA       LEU  48  11.705  10.697  -5.907
  263   1HB   LEU  48          2HB       LEU  48  10.913  10.353  -8.722
  264   2HB   LEU  48          1HB       LEU  48   9.579  10.164  -7.584
  265    HG   LEU  48           HG       LEU  48  11.274  12.416  -6.862
  266   1HD1  LEU  48          1HD1      LEU  48  11.656  12.485  -9.313
  267   2HD1  LEU  48          3HD1      LEU  48   9.911  12.496  -9.572
  268   3HD1  LEU  48          2HD1      LEU  48  10.690  13.857  -8.765
  269   1HD2  LEU  48          1HD2      LEU  48   8.353  12.085  -7.616
  270   2HD2  LEU  48          3HD2      LEU  48   9.023  12.088  -5.984
  271   3HD2  LEU  48          2HD2      LEU  48   9.044  13.564  -6.951
  272    MD1  LEU  48           QD1      LEU  48  10.752  12.946  -9.216
  273    MD2  LEU  48           QD2      LEU  48   8.807  12.579  -6.850
  274    QB   LEU  48           QB       LEU  48  10.246  10.259  -8.153
  275    QD   LEU  48           QQD      LEU  48   9.780  12.763  -8.033
  276    HA   PRO  49           HA       PRO  49  10.531   6.720  -4.377
  277   1HB   PRO  49          2HB       PRO  49   8.959   7.542  -2.309
  278   2HB   PRO  49          1HB       PRO  49  10.728   7.696  -2.277
  279   1HG   PRO  49          2HG       PRO  49   8.659   9.759  -2.829
  280   2HG   PRO  49          1HG       PRO  49  10.191   9.902  -1.951
  281   1HD   PRO  49          2HD       PRO  49   9.804  10.715  -4.553
  282   2HD   PRO  49          1HD       PRO  49  11.383  10.293  -3.853
  283    QB   PRO  49           QB       PRO  49   9.844   7.619  -2.293
  284    QG   PRO  49           QG       PRO  49   9.425   9.830  -2.390
  285    QD   PRO  49           QD       PRO  49  10.594  10.504  -4.203
  286    H    ALA  50           H        ALA  50   9.185   7.300  -6.717
  287    HA   ALA  50           HA       ALA  50   6.364   7.739  -6.592
  288   1HB   ALA  50          2HB       ALA  50   7.974   5.793  -8.280
  289   2HB   ALA  50          3HB       ALA  50   7.743   7.508  -8.623
  290   3HB   ALA  50          1HB       ALA  50   6.370   6.403  -8.687
  291    MB   ALA  50           QB       ALA  50   7.363   6.568  -8.530
  292    H    LEU  51           H        LEU  51   8.123   4.595  -6.336
  293    HA   LEU  51           HA       LEU  51   5.692   3.045  -5.798
  294   1HB   LEU  51          2HB       LEU  51   8.220   2.503  -6.487
  295   2HB   LEU  51          1HB       LEU  51   8.383   2.266  -4.747
  296    HG   LEU  51           HG       LEU  51   7.787   0.130  -5.636
  297   1HD1  LEU  51          2HD1      LEU  51   6.486   0.972  -3.621
  298   2HD1  LEU  51          1HD1      LEU  51   5.166   1.344  -4.729
  299   3HD1  LEU  51          3HD1      LEU  51   5.706  -0.323  -4.528
  300   1HD2  LEU  51          1HD2      LEU  51   6.154   1.787  -7.444
  301   2HD2  LEU  51          3HD2      LEU  51   6.894   0.212  -7.727
  302   3HD2  LEU  51          2HD2      LEU  51   5.343   0.322  -6.894
  303    MD1  LEU  51           QD1      LEU  51   5.786   0.664  -4.292
  304    MD2  LEU  51           QD2      LEU  51   6.131   0.774  -7.355
  305    QB   LEU  51           QB       LEU  51   8.302   2.385  -5.617
  306    QD   LEU  51           QQD      LEU  51   5.958   0.719  -5.824
  307    H    ALA  52           H        ALA  52   8.286   4.315  -3.632
  308    HA   ALA  52           HA       ALA  52   7.177   3.390  -1.151
  309   1HB   ALA  52          1HB       ALA  52   9.258   4.973  -2.080
  310   2HB   ALA  52          3HB       ALA  52   8.309   6.097  -1.106
  311   3HB   ALA  52          2HB       ALA  52   8.931   4.612  -0.385
  312    MB   ALA  52           QB       ALA  52   8.833   5.227  -1.190
  313    H    ILE  53           H        ILE  53   6.528   6.453  -2.936
  314    HA   ILE  53           HA       ILE  53   4.628   7.498  -0.981
  315    HB   ILE  53           HB       ILE  53   4.970   7.856  -3.976
  316   1HG1  ILE  53          2HG1      ILE  53   6.888   8.415  -2.376
  317   2HG1  ILE  53          1HG1      ILE  53   6.333   9.738  -3.402
  318   1HG2  ILE  53          2HG2      ILE  53   3.249   9.270  -1.946
  319   2HG2  ILE  53          1HG2      ILE  53   3.847  10.125  -3.368
  320   3HG2  ILE  53          3HG2      ILE  53   2.817   8.707  -3.561
  321   1HD1  ILE  53          2HD1      ILE  53   4.919   9.469  -0.815
  322   2HD1  ILE  53          1HD1      ILE  53   6.614   9.944  -0.702
  323   3HD1  ILE  53          3HD1      ILE  53   5.486  10.920  -1.644
  324    MG   ILE  53           QG2      ILE  53   3.304   9.367  -2.958
  325    MD   ILE  53           QD1      ILE  53   5.673  10.111  -1.054
  326    QG   ILE  53           QG1      ILE  53   6.611   9.076  -2.889
  327    H    PHE  54           H        PHE  54   4.198   5.533  -3.967
  328    HA   PHE  54           HA       PHE  54   1.328   5.455  -3.979
  329   1HB   PHE  54          2HB       PHE  54   2.928   4.597  -5.691
  330   2HB   PHE  54          1HB       PHE  54   3.316   3.252  -4.619
  331    HD1  PHE  54          1HD       PHE  54   0.650   4.814  -6.662
  332    HD2  PHE  54          2HD       PHE  54   1.797   1.408  -4.310
  333    HE1  PHE  54          1HE       PHE  54  -1.314   3.564  -7.515
  334    HE2  PHE  54          2HE       PHE  54  -0.167   0.158  -5.163
  335    HZ   PHE  54           HZ       PHE  54  -1.724   1.236  -6.765
  336    QB   PHE  54           QB       PHE  54   3.122   3.925  -5.155
  337    QD   PHE  54           QD       PHE  54   1.224   3.111  -5.486
  338    QE   PHE  54           QE       PHE  54  -0.741   1.861  -6.339
  339    QR   PHE  54           QR       PHE  54  -0.152   2.236  -6.083
  340    H    ILE  55           H        ILE  55   3.645   3.265  -2.282
  341    HA   ILE  55           HA       ILE  55   1.587   1.607  -1.055
  342    HB   ILE  55           HB       ILE  55   4.388   2.389  -0.186
  343   1HG1  ILE  55          2HG1      ILE  55   3.394  -0.021  -1.740
  344   2HG1  ILE  55          1HG1      ILE  55   4.174   1.382  -2.469
  345   1HG2  ILE  55          2HG2      ILE  55   2.385   0.836   1.140
  346   2HG2  ILE  55          1HG2      ILE  55   3.644  -0.264   0.576
  347   3HG2  ILE  55          3HG2      ILE  55   4.063   1.092   1.623
  348   1HD1  ILE  55          1HD1      ILE  55   5.409  -0.417  -0.362
  349   2HD1  ILE  55          3HD1      ILE  55   5.804  -0.433  -2.081
  350   3HD1  ILE  55          2HD1      ILE  55   6.188   0.983  -1.101
  351    MG   ILE  55           QG2      ILE  55   3.364   0.555   1.113
  352    MD   ILE  55           QD1      ILE  55   5.800   0.045  -1.181
  353    QG   ILE  55           QG1      ILE  55   3.784   0.681  -2.104
  354    H    GLY  56           H        GLY  56   3.321   4.538   0.115
  355   1HA   GLY  56          1HA       GLY  56   2.629   6.062   1.798
  356   2HA   GLY  56          2HA       GLY  56   2.155   4.639   2.728
  357    QA   GLY  56           QA       GLY  56   2.392   5.350   2.263
  358    H    LEU  57           H        LEU  57   0.904   6.137  -0.312
  359    HA   LEU  57           HA       LEU  57  -1.591   7.049   0.884
  360   1HB   LEU  57          2HB       LEU  57  -0.529   7.677  -1.319
  361   2HB   LEU  57          1HB       LEU  57  -1.046   6.113  -1.949
  362    HG   LEU  57           HG       LEU  57  -3.074   7.872  -0.617
  363   1HD1  LEU  57          1HD1      LEU  57  -1.556   9.015  -2.523
  364   2HD1  LEU  57          3HD1      LEU  57  -2.697   8.155  -3.558
  365   3HD1  LEU  57          2HD1      LEU  57  -3.285   9.331  -2.381
  366   1HD2  LEU  57          2HD2      LEU  57  -2.976   5.469  -2.250
  367   2HD2  LEU  57          1HD2      LEU  57  -4.325   6.129  -1.326
  368   3HD2  LEU  57          3HD2      LEU  57  -4.032   6.681  -2.976
  369    MD1  LEU  57           QD1      LEU  57  -2.513   8.834  -2.821
  370    MD2  LEU  57           QD2      LEU  57  -3.778   6.093  -2.184
  371    QB   LEU  57           QB       LEU  57  -0.788   6.895  -1.634
  372    QD   LEU  57           QQD      LEU  57  -3.145   7.463  -2.502
  373    H    THR  58           H        THR  58  -0.636   3.959  -0.661
  374    HA   THR  58           HA       THR  58  -3.303   2.788  -0.705
  375    HB   THR  58           HB       THR  58  -0.564   1.521  -0.371
  376    HG1  THR  58          1HG       THR  58  -1.754   1.611  -2.838
  377   1HG2  THR  58          2HG2      THR  58  -2.533   0.018   0.010
  378   2HG2  THR  58          1HG2      THR  58  -3.092   0.409  -1.616
  379   3HG2  THR  58          3HG2      THR  58  -1.563  -0.440  -1.390
  380    MG   THR  58           QG2      THR  58  -2.396  -0.004  -0.999
  381    H    ILE  59           H        ILE  59  -0.616   2.425   1.678
  382    HA   ILE  59           HA       ILE  59  -2.216   0.870   3.566
  383    HB   ILE  59           HB       ILE  59   0.215   2.653   3.896
  384   1HG1  ILE  59          2HG1      ILE  59  -0.009  -0.345   3.472
  385   2HG1  ILE  59          1HG1      ILE  59   0.388   0.811   2.200
  386   1HG2  ILE  59          2HG2      ILE  59  -0.958   2.059   6.037
  387   2HG2  ILE  59          1HG2      ILE  59  -0.744   0.356   5.630
  388   3HG2  ILE  59          3HG2      ILE  59   0.664   1.380   5.915
  389   1HD1  ILE  59          3HD1      ILE  59   1.966   0.584   4.773
  390   2HD1  ILE  59          2HD1      ILE  59   2.390  -0.294   3.303
  391   3HD1  ILE  59          1HD1      ILE  59   2.413   1.469   3.314
  392    MG   ILE  59           QG2      ILE  59  -0.346   1.265   5.861
  393    MD   ILE  59           QD1      ILE  59   2.256   0.586   3.797
  394    QG   ILE  59           QG1      ILE  59   0.189   0.233   2.836
  395    H    TYR  60           H        TYR  60  -1.503   4.401   3.326
  396    HA   TYR  60           HA       TYR  60  -2.812   5.168   5.789
  397   1HB   TYR  60          2HB       TYR  60  -1.403   6.569   4.244
  398   2HB   TYR  60          1HB       TYR  60  -2.754   6.610   3.113
  399    HD1  TYR  60          1HD       TYR  60  -1.727   7.515   6.578
  400    HD2  TYR  60          2HD       TYR  60  -4.552   8.138   3.401
  401    HE1  TYR  60          1HE       TYR  60  -2.692   9.436   7.811
  402    HE2  TYR  60          2HE       TYR  60  -5.518  10.060   4.639
  403    HH   TYR  60           HH       TYR  60  -5.658  10.907   6.898
  404    QB   TYR  60           QB       TYR  60  -2.078   6.589   3.679
  405    QD   TYR  60           QD       TYR  60  -3.139   7.827   4.989
  406    QE   TYR  60           QE       TYR  60  -4.105   9.748   6.225
  407    QR   TYR  60           QR       TYR  60  -3.622   8.787   5.607
  408    H    ALA  61           H        ALA  61  -4.133   4.944   2.441
  409    HA   ALA  61           HA       ALA  61  -6.854   5.634   3.110
  410   1HB   ALA  61          1HB       ALA  61  -6.202   3.550   1.062
  411   2HB   ALA  61          3HB       ALA  61  -7.237   4.972   0.917
  412   3HB   ALA  61          2HB       ALA  61  -5.483   5.150   0.887
  413    MB   ALA  61           QB       ALA  61  -6.307   4.557   0.955
  414    H    ILE  62           H        ILE  62  -5.179   2.457   3.153
  415    HA   ILE  62           HA       ILE  62  -7.559   0.881   3.703
  416    HB   ILE  62           HB       ILE  62  -4.617   0.579   4.350
  417   1HG1  ILE  62          2HG1      ILE  62  -6.283  -0.831   2.257
  418   2HG1  ILE  62          1HG1      ILE  62  -5.491   0.714   1.936
  419   1HG2  ILE  62          3HG2      ILE  62  -6.961  -1.147   4.962
  420   2HG2  ILE  62          2HG2      ILE  62  -5.551  -1.959   4.283
  421   3HG2  ILE  62          1HG2      ILE  62  -5.402  -1.037   5.780
  422   1HD1  ILE  62          2HD1      ILE  62  -3.952  -1.615   3.071
  423   2HD1  ILE  62          1HD1      ILE  62  -4.198  -1.446   1.333
  424   3HD1  ILE  62          3HD1      ILE  62  -3.335  -0.195   2.227
  425    MG   ILE  62           QG2      ILE  62  -5.972  -1.381   5.008
  426    MD   ILE  62           QD1      ILE  62  -3.828  -1.085   2.210
  427    QG   ILE  62           QG1      ILE  62  -5.887  -0.058   2.096
  428    H    GLN  63           H        GLN  63  -5.146   2.377   5.934
  429    HA   GLN  63           HA       GLN  63  -6.358   1.391   8.377
  430   1HB   GLN  63          2HB       GLN  63  -4.850   3.938   7.708
  431   2HB   GLN  63          1HB       GLN  63  -5.130   3.351   9.349
  432   1HG   GLN  63          2HG       GLN  63  -3.933   1.274   8.838
  433   2HG   GLN  63          1HG       GLN  63  -3.690   1.806   7.174
  434   1HE2  GLN  63          1HE2      GLN  63  -1.429   1.180   8.765
  435   2HE2  GLN  63          2HE2      GLN  63  -0.572   2.718   9.149
  436    QB   GLN  63           QB       GLN  63  -4.990   3.644   8.528
  437    QG   GLN  63           QG       GLN  63  -3.811   1.540   8.006
  438    QE   GLN  63           QE2      GLN  63  -1.001   1.949   8.957
  439    H    ARG  64           H        ARG  64  -7.019   4.318   6.409
  440    HA   ARG  64           HA       ARG  64  -8.903   5.496   8.308
  441   1HB   ARG  64          2HB       ARG  64  -7.759   6.602   6.382
  442   2HB   ARG  64          1HB       ARG  64  -8.763   5.658   5.279
  443   1HG   ARG  64          2HG       ARG  64 -10.748   6.650   6.682
  444   2HG   ARG  64          1HG       ARG  64  -9.565   7.877   7.138
  445   1HD   ARG  64          2HD       ARG  64 -10.434   7.154   4.317
  446   2HD   ARG  64          1HD       ARG  64 -10.707   8.692   5.162
  447    HE   ARG  64           HE       ARG  64  -7.938   7.629   4.440
  448   1HH1  ARG  64          1HH1      ARG  64  -7.378   9.659   6.260
  449   2HH1  ARG  64          2HH1      ARG  64  -7.540  11.167   5.422
  450   1HH2  ARG  64          1HH2      ARG  64  -9.441   9.834   2.847
  451   2HH2  ARG  64          2HH2      ARG  64  -8.708  11.265   3.490
  452    QB   ARG  64           QB       ARG  64  -8.261   6.130   5.831
  453    QG   ARG  64           QG       ARG  64 -10.157   7.264   6.910
  454    QD   ARG  64           QD       ARG  64 -10.570   7.923   4.740
  455    QH1  ARG  64           QH1      ARG  64  -7.459  10.413   5.841
  456    QH2  ARG  64           QH2      ARG  64  -9.074  10.549   3.169
  457    H    LYS  65           H        LYS  65  -9.441   3.544   5.316
  458    HA   LYS  65           HA       LYS  65 -12.301   3.312   5.597
  459   1HB   LYS  65          2HB       LYS  65 -10.179   1.435   4.509
  460   2HB   LYS  65          1HB       LYS  65 -11.907   1.262   4.190
  461   1HG   LYS  65          2HG       LYS  65 -11.925   3.567   3.236
  462   2HG   LYS  65          1HG       LYS  65 -10.178   3.644   3.463
  463   1HD   LYS  65          2HD       LYS  65  -9.949   1.614   2.020
  464   2HD   LYS  65          1HD       LYS  65 -11.685   1.682   1.711
  465   1HE   LYS  65          2HE       LYS  65 -11.245   3.117   0.012
  466   2HE   LYS  65          1HE       LYS  65 -10.705   4.297   1.223
  467   1HZ   LYS  65          3HZ       LYS  65  -8.533   3.208   1.239
  468   2HZ   LYS  65          2HZ       LYS  65  -9.049   2.139   0.024
  469   3HZ   LYS  65          1HZ       LYS  65  -8.909   3.800  -0.305
  470    QB   LYS  65           QB       LYS  65 -11.043   1.348   4.349
  471    QD   LYS  65           QD       LYS  65 -10.817   1.648   1.865
  472    QG   LYS  65           QG       LYS  65 -11.052   3.606   3.350
  473    QE   LYS  65           QE       LYS  65 -10.975   3.707   0.617
  474    QZ   LYS  65           QZ       LYS  65  -8.830   3.049   0.320
  475    H    ARG  66           H        ARG  66  -9.703   1.088   6.766
  476    HA   ARG  66           HA       ARG  66 -11.452  -0.767   8.121
  477   1HB   ARG  66          2HB       ARG  66  -8.990  -0.952   7.647
  478   2HB   ARG  66          1HB       ARG  66  -8.697   0.214   8.938
  479   1HG   ARG  66          2HG       ARG  66  -9.880  -1.319  10.525
  480   2HG   ARG  66          1HG       ARG  66 -10.009  -2.505   9.226
  481   1HD   ARG  66          2HD       ARG  66  -7.392  -1.367  10.280
  482   2HD   ARG  66          1HD       ARG  66  -8.036  -2.976  10.659
  483    HE   ARG  66           HE       ARG  66  -8.138  -3.143   7.948
  484   1HH1  ARG  66          1HH1      ARG  66  -6.257  -0.624   8.110
  485   2HH1  ARG  66          2HH1      ARG  66  -4.712  -1.375   7.881
  486   1HH2  ARG  66          1HH2      ARG  66  -5.876  -4.577   8.524
  487   2HH2  ARG  66          2HH2      ARG  66  -4.497  -3.611   8.113
  488    QB   ARG  66           QB       ARG  66  -8.843  -0.369   8.293
  489    QG   ARG  66           QG       ARG  66  -9.944  -1.912   9.875
  490    QD   ARG  66           QD       ARG  66  -7.714  -2.171  10.469
  491    QH1  ARG  66           QH1      ARG  66  -5.484  -1.000   7.996
  492    QH2  ARG  66           QH2      ARG  66  -5.187  -4.094   8.318
  493    H    GLN  67           H        GLN  67 -10.020   2.340   9.198
  494    HA   GLN  67           HA       GLN  67 -12.158   2.524  11.306
  495   1HB   GLN  67          2HB       GLN  67  -9.197   2.192  11.851
  496   2HB   GLN  67          1HB       GLN  67 -10.303   2.873  13.043
  497   1HG   GLN  67          2HG       GLN  67 -11.720   0.790  12.776
  498   2HG   GLN  67          1HG       GLN  67 -10.408   0.109  11.813
  499   1HE2  GLN  67          1HE2      GLN  67 -11.192  -1.153  14.248
  500   2HE2  GLN  67          2HE2      GLN  67  -9.865  -0.912  15.443
  501    QB   GLN  67           QB       GLN  67  -9.750   2.533  12.447
  502    QG   GLN  67           QG       GLN  67 -11.064   0.449  12.295
  503    QE   GLN  67           QE2      GLN  67 -10.528  -1.033  14.845
  504    H    ALA  68           H        ALA  68 -12.445   4.695  12.054
  505    HA   ALA  68           HA       ALA  68 -10.709   6.708  10.541
  506   1HB   ALA  68          2HB       ALA  68 -13.636   6.824  11.337
  507   2HB   ALA  68          3HB       ALA  68 -13.041   6.436   9.723
  508   3HB   ALA  68          1HB       ALA  68 -12.773   8.043  10.398
  509    MB   ALA  68           QB       ALA  68 -13.150   7.101  10.486
  510    H    ASP  69           H        ASP  69 -10.102   8.624  11.662
  511    HA   ASP  69           HA       ASP  69  -9.652   8.379  14.502
  512   1HB   ASP  69          2HB       ASP  69  -9.899  10.754  12.631
  513   2HB   ASP  69          1HB       ASP  69  -9.254  10.869  14.268
  514    QB   ASP  69           QB       ASP  69  -9.576  10.812  13.450

  No H/Q in entry =         514