*HEADER    SIGNALING PROTEIN                       17-JUN-02   1M12              
*TITLE     NMR SOLUTION STRUCTURE OF HUMAN SAPOSIN C                             
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: SAPOSIN C;                                                 
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 ORGANISM_SCIENTIFIC: HOMO SAPIENS;                                   
*SOURCE   3 ORGANISM_COMMON: HUMAN;                                              
*SOURCE   4 EXPRESSION_SYSTEM: ESCHERICHIA COLI;                                 
*SOURCE   5 EXPRESSION_SYSTEM_COMMON: BACTERIA;                                  
*SOURCE   6 EXPRESSION_SYSTEM_STRAIN: BL21(DE3);                                 
*SOURCE   7 EXPRESSION_SYSTEM_VECTOR_TYPE: PET-30B                               
*KEYWDS    DISULFIDE BRIDGES, ALPHA-HELICES                                      
*EXPDTA    NMR, 20 STRUCTURES                                                    
*AUTHOR    E.DE ALBA, S.WEILER, N.TJANDRA                                        
*REVDAT   1   29-JUL-03 1M12    0                                                
THE FOLLOWING ARE COORDINATES OF THE ALIGNMENT TENSORS USED IN THE 
STRUCTURE CALCULATION. 
MODEL        1      
ATOM   1311  X   ANI   500     322.831 -18.024  17.525  1.00  0.00          
ATOM   1312  Y   ANI   500     323.558 -13.916  16.780  1.00  0.00          
ATOM   1313  Z   ANI   500     325.833 -16.876  14.747  1.00  0.00          
ATOM   1314  OO  ANI   500     325.247 -16.248  17.621  1.00  0.00          
ATOM   1315  X   ANI   600     197.791  -1.962  -0.075  1.00  0.00          
ATOM   1316  Y   ANI   600     198.207   2.180  -0.894  1.00  0.00          
ATOM   1317  Z   ANI   600     200.625  -0.641  -2.943  1.00  0.00          
ATOM   1318  OO  ANI   600     200.074  -0.016  -0.061  1.00  0.00          
MODEL        2      
ATOM   1311  X   ANI   500     221.607  30.019   6.339  1.00  0.00
ATOM   1312  Y   ANI   500     217.515  30.656   5.409  1.00  0.00
ATOM   1313  Z   ANI   500     218.589  28.914   9.114  1.00  0.00
ATOM   1314  OO  ANI   500     219.159  28.288   6.236  1.00  0.00
ATOM   1315  X   ANI   600     196.471  14.479  10.246  1.00  0.00
ATOM   1316  Y   ANI   600     197.218  18.592   9.526  1.00  0.00
ATOM   1317  Z   ANI   600     199.453  15.638   7.458  1.00  0.00
ATOM   1318  OO  ANI   600     198.895  16.244  10.343  1.00  0.00
MODEL        3      
ATOM   1311  X   ANI   500     217.998-130.287 -39.667  1.00  0.00
ATOM   1312  Y   ANI   500     218.751-126.182 -40.413  1.00  0.00
ATOM   1313  Z   ANI   500     221.010-129.159 -42.441  1.00  0.00
ATOM   1314  OO  ANI   500     220.423-128.525 -39.567  1.00  0.00
ATOM   1315  X   ANI   600     190.557 -51.452 -19.452  1.00  0.00
ATOM   1316  Y   ANI   600     194.714 -51.055 -18.701  1.00  0.00
ATOM   1317  Z   ANI   600     191.945 -48.567 -16.667  1.00  0.00
ATOM   1318  OO  ANI   600     192.523 -49.188 -19.545  1.00  0.00
MODEL        4      
ATOM   1311  X   ANI   500     148.655  16.003 -69.571  1.00  0.00
ATOM   1312  Y   ANI   500     149.444  20.103 -70.300  1.00  0.00
ATOM   1313  Z   ANI   500     151.659  17.115 -72.361  1.00  0.00
ATOM   1314  OO  ANI   500     151.100  17.739 -69.480  1.00  0.00
ATOM   1315  X   ANI   600     192.160  11.546 -60.145  1.00  0.00
ATOM   1316  Y   ANI   600     191.643   7.415 -59.330  1.00  0.00
ATOM   1317  Z   ANI   600     190.316   9.030 -63.022  1.00  0.00
ATOM   1318  OO  ANI   600     189.825   9.663 -60.130  1.00  0.00
MODEL        5      
ATOM   1311  X   ANI   500     227.154 -28.694 -86.209  1.00  0.00
ATOM   1312  Y   ANI   500     226.401 -32.799 -85.463  1.00  0.00
ATOM   1313  Z   ANI   500     225.333 -31.096 -89.188  1.00  0.00
ATOM   1314  OO  ANI   500     224.731 -30.459 -86.319  1.00  0.00
ATOM   1315  X   ANI   600     193.315 -10.688 -41.259  1.00  0.00
ATOM   1316  Y   ANI   600     193.363  -6.552 -42.200  1.00  0.00
ATOM   1317  Z   ANI   600     195.919  -9.228 -44.273  1.00  0.00
ATOM   1318  OO  ANI   600     195.431  -8.567 -41.388  1.00  0.00
MODEL        6      
ATOM   1311  X   ANI   500     177.273  96.189 -15.180  1.00  0.00
ATOM   1312  Y   ANI   500     173.172  96.765 -16.130  1.00  0.00
ATOM   1313  Z   ANI   500     174.255  95.026 -12.424  1.00  0.00
ATOM   1314  OO  ANI   500     174.852  94.420 -15.301  1.00  0.00
ATOM   1315  X   ANI   600     190.143  50.067 -13.534  1.00  0.00
ATOM   1316  Y   ANI   600     190.562  54.222 -14.287  1.00  0.00
ATOM   1317  Z   ANI   600     193.017  51.435 -16.339  1.00  0.00
ATOM   1318  OO  ANI   600     192.421  52.017 -13.457  1.00  0.00
MODEL        7      
ATOM   1311  X   ANI   500      93.317  59.737-104.151  1.00  0.00
ATOM   1312  Y   ANI   500      94.023  63.848-104.882  1.00  0.00
ATOM   1313  Z   ANI   500      96.313  60.903-106.923  1.00  0.00
ATOM   1314  OO  ANI   500      95.725  61.523-104.047  1.00  0.00
ATOM   1315  X   ANI   600     173.620  21.976 -91.028  1.00  0.00
ATOM   1316  Y   ANI   600     177.784  21.948 -90.211  1.00  0.00
ATOM   1317  Z   ANI   600     175.237  24.648 -88.156  1.00  0.00
ATOM   1318  OO  ANI   600     175.798  24.039 -91.039  1.00  0.00
MODEL        8      
ATOM   1311  X   ANI   500     133.687 -99.780-140.320  1.00  0.00
ATOM   1312  Y   ANI   500     134.456 -95.676-141.049  1.00  0.00
ATOM   1313  Z   ANI   500     136.706 -98.652-143.085  1.00  0.00
ATOM   1314  OO  ANI   500     136.119 -98.028-140.210  1.00  0.00
ATOM   1315  X   ANI   600     168.951 -52.540 -89.626  1.00  0.00
ATOM   1316  Y   ANI   600     169.849 -48.459 -90.362  1.00  0.00
ATOM   1317  Z   ANI   600     171.954 -51.501 -92.438  1.00  0.00
ATOM   1318  OO  ANI   600     171.442 -50.869 -89.551  1.00  0.00
MODEL        9      
ATOM   1311  X   ANI   500     215.270 -51.861 -20.627  1.00  0.00
ATOM   1312  Y   ANI   500     219.368 -52.453 -19.684  1.00  0.00
ATOM   1313  Z   ANI   500     217.116 -49.470 -17.656  1.00  0.00
ATOM   1314  OO  ANI   500     217.702 -50.106 -20.529  1.00  0.00
ATOM   1315  X   ANI   600     199.874 -14.103 -20.424  1.00  0.00
ATOM   1316  Y   ANI   600     195.718 -14.167 -21.271  1.00  0.00
ATOM   1317  Z   ANI   600     197.145 -15.604 -17.543  1.00  0.00
ATOM   1318  OO  ANI   600     197.741 -16.212 -20.420  1.00  0.00
MODEL       10      
ATOM   1311  X   ANI   500      67.571-164.913  22.525  1.00  0.00
ATOM   1312  Y   ANI   500      66.835-169.025  23.248  1.00  0.00
ATOM   1313  Z   ANI   500      65.752-167.303  19.535  1.00  0.00
ATOM   1314  OO  ANI   500      65.154-166.686  22.410  1.00  0.00
ATOM   1315  X   ANI   600     174.277 -95.053  -4.365  1.00  0.00
ATOM   1316  Y   ANI   600     174.390 -90.892  -5.186  1.00  0.00
ATOM   1317  Z   ANI   600     177.027 -93.527  -7.213  1.00  0.00
ATOM   1318  OO  ANI   600     176.409 -92.942  -4.336  1.00  0.00
MODEL       11      
ATOM   1311  X   ANI   500     248.664   1.542  48.088  1.00  0.00
ATOM   1312  Y   ANI   500     252.762   1.015  49.062  1.00  0.00
ATOM   1313  Z   ANI   500     250.454   3.970  51.063  1.00  0.00
ATOM   1314  OO  ANI   500     251.068   3.333  48.195  1.00  0.00
ATOM   1315  X   ANI   600     195.099  13.780  23.528  1.00  0.00
ATOM   1316  Y   ANI   600     199.040  12.599  24.564  1.00  0.00
ATOM   1317  Z   ANI   600     197.180  15.816  26.614  1.00  0.00
ATOM   1318  OO  ANI   600     197.745  15.177  23.738  1.00  0.00
MODEL       12      
ATOM   1311  X   ANI   500     200.829 -43.891  64.075  1.00  0.00
ATOM   1312  Y   ANI   500     200.093 -48.001  64.793  1.00  0.00
ATOM   1313  Z   ANI   500     198.983 -46.270  61.091  1.00  0.00
ATOM   1314  OO  ANI   500     198.408 -45.659  63.971  1.00  0.00
ATOM   1315  X   ANI   600     199.183 -16.162  31.977  1.00  0.00
ATOM   1316  Y   ANI   600     195.058 -15.483  31.257  1.00  0.00
ATOM   1317  Z   ANI   600     196.315 -17.203  34.925  1.00  0.00
ATOM   1318  OO  ANI   600     196.713 -17.864  32.026  1.00  0.00
MODEL       13      
ATOM   1311  X   ANI   500     233.918 -26.487-105.872  1.00  0.00
ATOM   1312  Y   ANI   500     233.148 -30.589-105.124  1.00  0.00
ATOM   1313  Z   ANI   500     232.054 -28.873-108.836  1.00  0.00
ATOM   1314  OO  ANI   500     231.484 -28.238-105.961  1.00  0.00
ATOM   1315  X   ANI   600     191.110   0.136 -64.213  1.00  0.00
ATOM   1316  Y   ANI   600     190.824  -4.012 -63.368  1.00  0.00
ATOM   1317  Z   ANI   600     189.437  -2.503 -67.083  1.00  0.00
ATOM   1318  OO  ANI   600     188.886  -1.878 -64.201  1.00  0.00
MODEL       14      
ATOM   1311  X   ANI   500      82.599   1.863-155.732  1.00  0.00
ATOM   1312  Y   ANI   500      81.806  -2.234-154.985  1.00  0.00
ATOM   1313  Z   ANI   500      80.726  -0.515-158.700  1.00  0.00
ATOM   1314  OO  ANI   500      80.154   0.125-155.826  1.00  0.00
ATOM   1315  X   ANI   600     157.250   3.096-125.033  1.00  0.00
ATOM   1316  Y   ANI   600     153.226   3.967-126.056  1.00  0.00
ATOM   1317  Z   ANI   600     154.117   2.104-122.349  1.00  0.00
ATOM   1318  OO  ANI   600     154.718   1.499-125.225  1.00  0.00
MODEL       15      
ATOM   1311  X   ANI   500     152.945 -21.640-119.713  1.00  0.00
ATOM   1312  Y   ANI   500     152.202 -25.740-118.947  1.00  0.00
ATOM   1313  Z   ANI   500     151.128 -24.058-122.680  1.00  0.00
ATOM   1314  OO  ANI   500     150.525 -23.408-119.814  1.00  0.00
ATOM   1315  X   ANI   600     179.521 -27.495 -78.349  1.00  0.00
ATOM   1316  Y   ANI   600     183.613 -28.076 -77.393  1.00  0.00
ATOM   1317  Z   ANI   600     181.365 -25.097 -75.375  1.00  0.00
ATOM   1318  OO  ANI   600     181.947 -25.733 -78.248  1.00  0.00
MODEL       16      
ATOM   1311  X   ANI   500      40.009 -55.451 -25.038  1.00  0.00
ATOM   1312  Y   ANI   500      39.279 -59.562 -24.309  1.00  0.00
ATOM   1313  Z   ANI   500      38.181 -57.845 -28.021  1.00  0.00
ATOM   1314  OO  ANI   500      37.593 -57.224 -25.144  1.00  0.00
ATOM   1315  X   ANI   600     184.679 -50.124 -61.387  1.00  0.00
ATOM   1316  Y   ANI   600     184.051 -54.251 -60.631  1.00  0.00
ATOM   1317  Z   ANI   600     182.852 -52.567 -64.335  1.00  0.00
ATOM   1318  OO  ANI   600     182.303 -51.956 -61.450  1.00  0.00
MODEL       17      
ATOM   1311  X   ANI   500     224.468-137.383 -37.706  1.00  0.00
ATOM   1312  Y   ANI   500     228.558-137.963 -36.720  1.00  0.00
ATOM   1313  Z   ANI   500     226.276-134.994 -34.708  1.00  0.00
ATOM   1314  OO  ANI   500     226.892-135.620 -37.577  1.00  0.00
ATOM   1315  X   ANI   600     193.447 -52.752 -22.783  1.00  0.00
ATOM   1316  Y   ANI   600     192.777 -56.870 -22.011  1.00  0.00
ATOM   1317  Z   ANI   600     191.601 -55.190 -25.725  1.00  0.00
ATOM   1318  OO  ANI   600     191.054 -54.561 -22.843  1.00  0.00
MODEL       18      
ATOM   1311  X   ANI   500      87.919 -14.569  39.852  1.00  0.00
ATOM   1312  Y   ANI   500      87.171 -18.678  40.570  1.00  0.00
ATOM   1313  Z   ANI   500      86.062 -16.941  36.872  1.00  0.00
ATOM   1314  OO  ANI   500      85.491 -16.329  39.753  1.00  0.00
ATOM   1315  X   ANI   600     195.303 -19.589  21.311  1.00  0.00
ATOM   1316  Y   ANI   600     195.725 -15.458  20.440  1.00  0.00
ATOM   1317  Z   ANI   600     198.019 -18.320  18.308  1.00  0.00
ATOM   1318  OO  ANI   600     197.604 -17.667  21.206  1.00  0.00
MODEL       19      
ATOM   1311  X   ANI   500     333.928 -93.540  33.611  1.00  0.00
ATOM   1312  Y   ANI   500     334.680 -89.434  32.876  1.00  0.00
ATOM   1313  Z   ANI   500     336.942 -92.407  30.845  1.00  0.00
ATOM   1314  OO  ANI   500     336.353 -91.778  33.718  1.00  0.00
ATOM   1315  X   ANI   600     199.781 -23.525  15.700  1.00  0.00
ATOM   1316  Y   ANI   600     199.844 -27.662  16.645  1.00  0.00
ATOM   1317  Z   ANI   600     198.202 -26.352  12.959  1.00  0.00
ATOM   1318  OO  ANI   600     197.719 -25.699  15.847  1.00  0.00
MODEL       20      
ATOM   1311  X   ANI   500     185.479-104.601 -83.553  1.00  0.00
ATOM   1312  Y   ANI   500     184.709-108.704 -82.817  1.00  0.00
ATOM   1313  Z   ANI   500     183.660-106.990 -86.545  1.00  0.00
ATOM   1314  OO  ANI   500     183.049-106.357 -83.676  1.00  0.00
ATOM   1315  X   ANI   600     188.108 -54.102 -48.923  1.00  0.00
ATOM   1316  Y   ANI   600     183.996 -53.596 -49.834  1.00  0.00
ATOM   1317  Z   ANI   600     185.153 -55.277 -46.115  1.00  0.00
ATOM   1318  OO  ANI   600     185.714 -55.908 -48.994  1.00  0.00

assign (resid 44 and name HN ) (resid 45 and name HN ) 3.6 0.9 0.9
assign (resid 66 and name HN ) (resid 67 and name HN ) 4.8 1.2 1.2
assign (resid 57 and name HN ) (resid 58 and name HN ) 2.6 0.7 0.7
assign (resid 18 and name HN ) (resid 19 and name HN ) 2.8 0.7 0.7
assign (resid 50 and name HN ) (resid 51 and name HN ) 2.6 0.7 0.7
assign (resid 27 and name HN ) (resid 28 and name HN ) 2.9 0.7 0.7
assign (resid 19 and name HN ) (resid 20 and name HN ) 2.8 0.7 0.7
assign (resid 45 and name HN ) (resid 46 and name HN ) 3.3 0.8 0.8
assign (resid 80 and name HN ) (resid 81 and name HN ) 5.1 1.3 1.3
assign (resid 34 and name HN ) (resid 35 and name HN ) 2.2 0.6 0.6
assign (resid 62 and name HN ) (resid 63 and name HN ) 2.7 0.7 0.7
assign (resid 7 and name HN ) (resid 8 and name HN ) 2.8 0.7 0.7
assign (resid 9 and name HN ) (resid 10 and name HN ) 2.7 0.7 0.7
assign (resid 65 and name HN ) (resid 66 and name HN ) 2.6 0.7 0.7
assign (resid 10 and name HN ) (resid 11 and name HN ) 2.9 0.7 0.7
assign (resid 47 and name HN ) (resid 48 and name HN ) 3.0 0.8 0.8
assign (resid 56 and name HN ) (resid 57 and name HN ) 2.6 0.7 0.7
assign (resid 12 and name HN ) (resid 13 and name HN ) 2.7 0.7 0.7
assign (resid 14 and name HN ) (resid 15 and name HN ) 2.8 0.7 0.7
assign (resid 49 and name HN ) (resid 50 and name HN ) 2.6 0.7 0.7
assign (resid 38 and name HN ) (resid 39 and name HN ) 2.5 0.6 0.6
assign (resid 24 and name HN ) (resid 25 and name HN ) 4.5 1.1 1.1
assign (resid 31 and name HN ) (resid 32 and name HN ) 2.4 0.6 0.6
assign (resid 16 and name HN ) (resid 17 and name HN ) 2.9 0.7 0.7
assign (resid 63 and name HN ) (resid 64 and name HN ) 2.6 0.7 0.7
assign (resid 8 and name HN ) (resid 9 and name HN ) 3.1 0.8 0.8
assign (resid 5 and name HN ) (resid 6 and name HN ) 3.0 0.8 0.8
assign (resid 37 and name HN ) (resid 38 and name HN ) 3.0 0.8 0.8
assign (resid 61 and name HN ) (resid 62 and name HN ) 2.7 0.7 0.7
assign (resid 13 and name HN ) (resid 14 and name HN ) 2.7 0.7 0.7
assign (resid 3 and name HN ) (resid 4 and name HN ) 3.0 0.8 0.8
assign (resid 70 and name HN ) (resid 71 and name HN ) 2.4 0.6 0.6
assign (resid 11 and name HN ) (resid 12 and name HN ) 2.8 0.7 0.7
assign (resid 69 and name HN ) (resid 70 and name HN ) 2.9 0.7 0.7
assign (resid 4 and name HN ) (resid 5 and name HN ) 2.6 0.7 0.7
assign (resid 29 and name HN ) (resid 30 and name HN ) 2.6 0.7 0.7
assign (resid 72 and name HN ) (resid 73 and name HN ) 3.2 0.8 0.8
assign (resid 26 and name HN ) (resid 27 and name HN ) 2.8 0.7 0.7
assign (resid 76 and name HN ) (resid 77 and name HN ) 3.4 0.8 0.8
assign (resid 53 and name HN ) (resid 54 and name HN ) 2.6 0.7 0.7
assign (resid 46 and name HN ) (resid 47 and name HN ) 2.8 0.7 0.7
assign (resid 22 and name HN ) (resid 23 and name HN ) 2.6 0.7 0.7
assign (resid 6 and name HN ) (resid 7 and name HN ) 2.8 0.7 0.7
assign (resid 58 and name HN ) (resid 59 and name HN ) 3.0 0.8 0.8
assign (resid 25 and name HN ) (resid 26 and name HN ) 2.8 0.7 0.7
assign (resid 20 and name HN ) (resid 21 and name HN ) 2.7 0.7 0.7
assign (resid 33 and name HN ) (resid 34 and name HN ) 2.8 0.7 0.7
assign (resid 71 and name HN ) (resid 72 and name HN ) 3.8 0.9 0.9
assign (resid 36 and name HN ) (resid 37 and name HN ) 2.8 0.7 0.7
assign (resid 15 and name HN ) (resid 16 and name HN ) 2.9 0.7 0.7
assign (resid 74 and name HN ) (resid 75 and name HN ) 3.1 0.8 0.8
assign (resid 55 and name HN ) (resid 56 and name HN ) 3.1 0.8 0.8
assign (resid 35 and name HN ) (resid 36 and name HN ) 2.9 0.7 0.7
assign (resid 52 and name HN ) (resid 53 and name HN ) 2.9 0.7 0.7
assign (resid 21 and name HN ) (resid 22 and name HN ) 2.5 0.6 0.6
assign (resid 77 and name HN ) (resid 78 and name HN ) 2.7 0.7 0.7
assign (resid 59 and name HN ) (resid 60 and name HN ) 2.7 0.7 0.7
assign (resid 54 and name HN ) (resid 55 and name HN ) 2.4 0.6 0.6
assign (resid 64 and name HN ) (resid 65 and name HN ) 2.6 0.7 0.7
assign (resid 75 and name HN ) (resid 76 and name HN ) 3.0 0.8 0.8
assign (resid 80 and name HN ) (resid 82 and name HN ) 3.8 0.9 0.9
assign (resid 49 and name HN ) (resid 51 and name HN ) 3.9 1.0 1.0
assign (resid 29 and name HN ) (resid 31 and name HN ) 3.8 0.9 0.9
assign (resid 6 and name HN ) (resid 8 and name HN ) 4.3 1.1 1.1
assign (resid 64 and name HN ) (resid 66 and name HN ) 3.9 1.0 1.0
assign (resid 11 and name HN ) (resid 13 and name HN ) 4.4 1.1 1.1
assign (resid 55 and name HN ) (resid 57 and name HN ) 4.4 1.1 1.1
assign (resid 37 and name HN ) (resid 39 and name HN ) 4.9 1.2 1.2
assign (resid 15 and name HN ) (resid 17 and name HN ) 4.8 1.2 1.2
assign (resid 7 and name HN ) (resid 9 and name HN ) 4.5 1.1 1.1
assign (resid 27 and name HN ) (resid 29 and name HN ) 4.6 1.1 1.1
assign (resid 60 and name HN ) (resid 62 and name HN ) 4.2 1.1 1.1
assign (resid 75 and name HN ) (resid 77 and name HN ) 5.2 1.3 1.3
assign (resid 52 and name HN ) (resid 54 and name HN ) 3.7 0.9 0.9
assign (resid 21 and name HN ) (resid 23 and name HN ) 3.5 0.9 0.9
assign (resid 45 and name HN ) (resid 47 and name HN ) 3.7 0.9 0.9
assign (resid 14 and name HN ) (resid 16 and name HN ) 5.1 1.3 1.3
assign (resid 20 and name HN ) (resid 22 and name HN ) 4.0 1.0 1.0
assign (resid 76 and name HN ) (resid 78 and name HN ) 4.6 1.1 1.1
assign (resid 58 and name HN ) (resid 60 and name HN ) 3.9 1.0 1.0
assign (resid 53 and name HN ) (resid 55 and name HN ) 4.2 1.1 1.1
assign (resid 63 and name HN ) (resid 65 and name HN ) 4.7 1.2 1.2
assign (resid 74 and name HN ) (resid 76 and name HN ) 4.9 1.2 1.2
assign (resid 60 and name HN ) (resid 63 and name HN ) 4.3 1.1 1.1
assign (resid 24 and name HN ) (resid 27 and name HN ) 3.7 0.9 0.9
assign (resid 19 and name HN ) (resid 22 and name HN ) 4.0 1.0 1.0
assign (resid 1 and name HA ) (resid 2 and name HN ) 4.5 1.6 1.6
assign (resid 1 and name HB# ) (resid 2 and name HN ) 5.1 1.3 1.3
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assign (resid 2 and name HA ) (resid 3 and name HN ) 2.7 0.7 0.7
assign (resid 2 and name HA ) (resid 4 and name HN ) 4.2 1.1 1.1
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assign (resid 3 and (name HG1# or name HG2# )) (resid 4 and name HN ) 3.4 0.8 0.8
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assign (resid 3 and (name HG2# or name HG1# )) (resid 7 and name HN ) 4.5 1.1 1.1
assign (resid 3 and (name HG2# or name HG1# )) (resid 46 and name HN ) 4.5 1.1 1.1
assign (resid 3 and name HA ) (resid 4 and name HN ) 3.6 0.9 0.9
assign (resid 3 and name HA ) (resid 5 and name HN ) 4.1 1.0 1.0
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assign (resid 3 and name HA ) (resid 7 and name HN ) 4.4 1.1 1.1
assign (resid 3 and name HB ) (resid 6 and name HN ) 5.0 1.2 1.2
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assign (resid 4 and name HA ) (resid 5 and name HN ) 3.8 0.9 0.9
assign (resid 4 and name HA ) (resid 8 and name HN ) 4.3 1.1 1.1
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assign (resid 5 and (name HB1 or name HB2 )) (resid 6 and name HN ) 3.6 0.9 0.9
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assign (resid 5 and name HA ) (resid 6 and name HN ) 4.1 1.0 1.0
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assign (resid 6 and name HA ) (resid 7 and name HN ) 3.8 0.9 0.9
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assign (resid 6 and name HB# ) (resid 7 and name HN ) 3.3 0.8 0.8
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assign (resid 6 and name HN ) (resid 7 and name HG* ) 3.9 1.0 1.0
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assign (resid 7 and name HA ) (resid 8 and name HN ) 3.7 0.9 0.9
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assign (resid 7 and name HG* ) (resid 9 and name HN ) 4.6 1.1 1.1
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assign (resid 8 and (name HB1 or name HB2 )) (resid 9 and name HN ) 3.2 0.8 0.8
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assign (resid 8 and name HA ) (resid 9 and name HN ) 3.9 1.0 1.0
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assign (resid 8 and name HN ) (resid 11 and (name HD1# or name HD2# )) 4.9 1.2 1.2
assign (resid 9 and (name HG1 or name HG2 )) (resid 10 and name HN ) 4.2 1.1 1.1
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assign (resid 10 and name HA ) (resid 11 and name HN ) 3.7 0.9 0.9
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assign (resid 10 and name HA ) (resid 14 and name HN ) 4.5 1.1 1.1
assign (resid 10 and name HB# ) (resid 11 and name HN ) 3.0 0.8 0.8
assign (resid 10 and name HB# ) (resid 12 and name HN ) 4.3 1.1 1.1
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assign (resid 11 and (name HB1 or name HB2 )) (resid 12 and name HN ) 3.5 0.9 0.9
assign (resid 11 and (name HD1# or name HD2# )) (resid 12 and name HN ) 4.2 1.1 1.1
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assign (resid 12 and name HA ) (resid 13 and name HN ) 3.8 0.9 0.9
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assign (resid 14 and name HA ) (resid 15 and name HN ) 3.8 0.9 0.9
assign (resid 14 and name HA ) (resid 16 and name HN ) 4.5 1.1 1.1
assign (resid 14 and name HA ) (resid 17 and name HN ) 4.1 1.0 1.0
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assign (resid 15 and name HB ) (resid 16 and name HN ) 3.2 0.8 0.8
assign (resid 15 and name HG* ) (resid 17 and name HN ) 4.5 1.1 1.1
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assign (resid 16 and name HA ) (resid 17 and name HN ) 3.1 0.8 0.8
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assign (resid 3 and name HA ) (resid 6 and (name HG1 or name HG2 )) 3.7 0.9 0.9
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assign (resid 3 and name HA ) (resid 6 and name HB# ) 3.0 0.8 0.8
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assign (resid 3 and name HB ) (resid 43 and (name HD2# or name HD1# )) 2.9 0.7 0.7
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assign (resid 4 and (name HB1 or name HB2 )) (resid 77 and name HA ) 5.0 1.2 1.2
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assign (resid 4 and (name HB2 or name HB1 )) (resid 7 and name HB ) 5.0 1.2 1.2
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assign (resid 4 and (name HB2 or name HB1 )) (resid 77 and (name HB1 or name HB2 )) 4.8 1.2 1.2
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assign (resid 4 and (name HB2 or name HB1 )) (resid 77 and (name HD2# or name HD1# )) 3.9 1.0 1.0
assign (resid 4 and (name HB2 or name HB1 )) (resid 77 and name HA ) 4.4 1.1 1.1
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assign (resid 4 and name HD# ) (resid 50 and name HB ) 5.1 1.3 1.3
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assign (resid 4 and name HE# ) (resid 46 and (name HB1 or name HB2 )) 4.3 1.1 1.1
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assign (resid 4 and name HE# ) (resid 46 and name HA ) 3.1 0.8 0.8
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assign (resid 4 and name HE# ) (resid 50 and (name HG1# or name HG2# )) 3.0 0.8 0.8
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assign (resid 5 and name HA ) (resid 8 and (name HB1 or name HB2 )) 3.2 1.1 1.1
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assign (resid 5 and name HA ) (resid 77 and (name HB1 or name HB2 )) 4.3 1.1 1.1
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assign (resid 5 and name HA ) (resid 77 and (name HD1# or name HD2# )) 5.1 1.3 1.3
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assign (resid 5 and name HA ) (resid 78 and (name HB1 or name HB2 )) 4.8 1.2 1.2
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assign (resid 6 and (name HG2 or name HG1 )) (resid 7 and name HB ) 4.6 1.1 1.1
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assign (resid 6 and name HB# ) (resid 7 and name HA ) 4.3 1.1 1.1
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assign (resid 7 and (name HG1# or name HG2# )) (resid 10 and name HD# ) 3.7 0.9 0.9
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assign (resid 7 and name HA ) (resid 10 and name HA ) 3.9 1.0 1.0
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assign (resid 8 and (name HB1 or name HB2 )) (resid 9 and (name HG2 or name HG1 )) 5.0 1.2 1.2
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assign (resid 8 and (name HB1 or name HB2 )) (resid 50 and (name HG2# or name HG1# )) 4.3 1.1 1.1
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assign (resid 8 and (name HB2 or name HB1 )) (resid 11 and (name HB2 or name HB1 )) 3.8 0.9 0.9
assign (resid 8 and (name HB2 or name HB1 )) (resid 11 and (name HD1# or name HD2# )) 4.6 1.1 1.1
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assign (resid 8 and (name HB2 or name HB1 )) (resid 77 and (name HD1# or name HD2# )) 3.9 1.0 1.0
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assign (resid 8 and (name HB2 or name HB1 )) (resid 77 and name HA ) 5.2 1.3 1.3
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assign (resid 9 and name HA ) (resid 12 and name HB ) 2.8 0.7 0.7
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assign (resid 11 and (name HD2# or name HD1# )) (resid 32 and name HA ) 3.8 0.9 0.9
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assign (resid 11 and name HA ) (resid 14 and name HB# ) 3.3 0.8 0.8
assign (resid 11 and name HA ) (resid 14 and name HG# ) 3.8 0.9 0.9
assign (resid 11 and name HA ) (resid 15 and (name HG2# or name HG1# )) 3.5 0.9 0.9
assign (resid 11 and name HA ) (resid 35 and name HE# ) 4.1 1.0 1.0
assign (resid 11 and name HA ) (resid 35 and name HG# ) 5.1 1.3 1.3
assign (resid 11 and name HA ) (resid 58 and name HD1# ) 4.5 1.1 1.1
assign (resid 11 and name HA ) (resid 58 and name HG2# ) 4.9 1.2 1.2
assign (resid 11 and name HG ) (resid 51 and (name HG1# or name HG2# )) 4.7 1.2 1.2
assign (resid 11 and name HG ) (resid 58 and name HD1# ) 4.8 1.2 1.2
assign (resid 12 and (name HG1# or name HG2# )) (resid 58 and (name HG12 or name HG13 )) 4.5 1.1 1.1
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assign (resid 12 and (name HG1# or name HG2# )) (resid 58 and name HA ) 4.2 1.1 1.1
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assign (resid 12 and (name HG1# or name HG2# )) (resid 68 and name HA ) 4.1 1.0 1.0
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assign (resid 12 and (name HG1# or name HG2# )) (resid 71 and (name HG2# or name HG1# )) 2.4 0.6 0.6
assign (resid 12 and (name HG1# or name HG2# )) (resid 71 and name HB ) 2.5 0.6 0.6
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assign (resid 12 and (name HG2# or name HG1# )) (resid 13 and name HA ) 3.0 0.8 0.8
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assign (resid 12 and (name HG2# or name HG1# )) (resid 62 and name HA ) 4.0 1.0 1.0
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assign (resid 12 and (name HG2# or name HG1# )) (resid 68 and (name HB2 or name HB1 )) 2.6 0.7 0.7
assign (resid 12 and (name HG2# or name HG1# )) (resid 68 and (name HG1 or name HG2 )) 3.2 0.8 0.8
assign (resid 12 and (name HG2# or name HG1# )) (resid 68 and (name HG2 or name HG1 )) 3.2 0.8 0.8
assign (resid 12 and (name HG2# or name HG1# )) (resid 68 and name HA ) 2.7 0.7 0.7
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assign (resid 12 and (name HG2# or name HG1# )) (resid 69 and name HB# ) 3.5 0.9 0.9
assign (resid 12 and name HA ) (resid 15 and name HB ) 2.8 0.7 0.7
assign (resid 12 and name HA ) (resid 16 and name HG2# ) 4.2 1.1 1.1
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assign (resid 12 and name HA ) (resid 62 and (name HD1# or name HD2# )) 2.7 0.7 0.7
assign (resid 12 and name HA ) (resid 68 and name HA ) 4.5 1.1 1.1
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assign (resid 13 and (name HG1 or name HG2 )) (resid 14 and name HA ) 3.5 0.9 0.9
assign (resid 13 and name HA ) (resid 16 and name HB ) 4.5 1.1 1.1
assign (resid 13 and name HA ) (resid 16 and name HG2# ) 3.1 0.8 0.8
assign (resid 13 and name HE# ) (resid 16 and name HG2# ) 5.2 1.3 1.3
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assign (resid 14 and name HA ) (resid 17 and name HB# ) 2.7 0.7 0.7
assign (resid 14 and name HA ) (resid 17 and name HD# ) 3.5 0.9 0.9
assign (resid 14 and name HA ) (resid 35 and name HE# ) 4.0 1.0 1.0
assign (resid 14 and name HB# ) (resid 15 and (name HG2# or name HG1# )) 4.3 1.1 1.1
assign (resid 14 and name HB# ) (resid 18 and (name HD2# or name HD1# )) 4.5 1.1 1.1
assign (resid 14 and name HB# ) (resid 35 and (name HG1 or name HG2 )) 3.9 1.0 1.0
assign (resid 14 and name HB# ) (resid 35 and name HE# ) 3.1 0.8 0.8
assign (resid 14 and name HB# ) (resid 35 and (name HG2 or name HG1 )) 4.5 1.1 1.1
assign (resid 14 and name HG# ) (resid 35 and (name HG1 or name HG2 )) 4.0 1.0 1.0
assign (resid 15 and (name HG1# or name HG2# )) (resid 16 and name HB ) 3.5 0.9 0.9
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assign (resid 15 and (name HG1# or name HG2# )) (resid 19 and name HA ) 4.0 1.0 1.0
assign (resid 15 and (name HG1# or name HG2# )) (resid 19 and name HB ) 3.8 0.9 0.9
assign (resid 15 and (name HG1# or name HG2# )) (resid 19 and name HD1# ) 2.4 0.6 0.6
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assign (resid 15 and (name HG1# or name HG2# )) (resid 58 and name HB ) 4.1 1.0 1.0
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assign (resid 15 and (name HG1# or name HG2# )) (resid 62 and (name HB1 or name HB2 )) 3.0 0.8 0.8
assign (resid 15 and (name HG2# or name HG1# )) (resid 28 and name HA ) 3.6 0.9 0.9
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assign (resid 15 and (name HG2# or name HG1# )) (resid 62 and (name HB2 or name HB1 )) 2.7 0.7 0.7
assign (resid 15 and name HA ) (resid 18 and (name HB1 or name HB2 )) 3.2 0.8 0.8
assign (resid 15 and name HA ) (resid 18 and (name HD1# or name HD2# )) 3.8 0.9 0.9
assign (resid 15 and name HA ) (resid 18 and (name HD2# or name HD1# )) 2.7 0.7 0.7
assign (resid 15 and name HA ) (resid 18 and name HA ) 5.2 1.3 1.3
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assign (resid 15 and name HA ) (resid 19 and (name HG12 or name HG13 )) 4.5 1.1 1.1
assign (resid 15 and name HA ) (resid 19 and name HD1# ) 4.3 1.1 1.1
assign (resid 15 and name HA ) (resid 28 and (name HG13 or name HG12 )) 5.0 1.2 1.2
assign (resid 15 and name HA ) (resid 28 and name HD1# ) 3.8 0.9 0.9
assign (resid 15 and name HA ) (resid 28 and name HG2# ) 3.3 0.8 0.8
assign (resid 15 and name HA ) (resid 35 and name HE# ) 3.0 0.8 0.8
assign (resid 15 and name HB ) (resid 16 and name HG2# ) 4.6 1.1 1.1
assign (resid 15 and name HB ) (resid 18 and (name HD2# or name HD1# )) 4.7 1.2 1.2
assign (resid 15 and name HB ) (resid 28 and name HG2# ) 4.2 1.1 1.1
assign (resid 15 and name HB ) (resid 35 and name HE# ) 4.7 1.2 1.2
assign (resid 15 and name HB ) (resid 58 and name HG2# ) 3.3 0.8 0.8
assign (resid 15 and name HB ) (resid 62 and (name HD1# or name HD2# )) 2.8 0.7 0.7
assign (resid 16 and name HA ) (resid 17 and name HA ) 4.2 1.1 1.1
assign (resid 16 and name HA ) (resid 17 and name HB# ) 4.7 1.2 1.2
assign (resid 16 and name HA ) (resid 19 and (name HG12 or name HG13 )) 4.3 1.1 1.1
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assign (resid 16 and name HB ) (resid 19 and name HB ) 2.5 0.9 0.9
assign (resid 16 and name HB ) (resid 62 and (name HD1# or name HD2# )) 3.7 0.9 0.9
assign (resid 16 and name HG2# ) (resid 17 and name HB# ) 3.9 1.0 1.0
assign (resid 16 and name HG2# ) (resid 19 and (name HG12 or name HG13 )) 4.8 1.2 1.2
assign (resid 16 and name HG2# ) (resid 19 and name HB ) 3.6 0.9 0.9
assign (resid 16 and name HG2# ) (resid 19 and name HD1# ) 3.2 0.8 0.8
assign (resid 16 and name HG2# ) (resid 19 and name HG2# ) 3.8 0.9 0.9
assign (resid 16 and name HG2# ) (resid 62 and (name HB1 or name HB2 )) 4.7 1.2 1.2
assign (resid 16 and name HG2# ) (resid 62 and (name HD1# or name HD2# )) 3.1 0.8 0.8
assign (resid 16 and name HG2# ) (resid 62 and (name HD2# or name HD1# )) 2.6 0.7 0.7
assign (resid 16 and name HG2# ) (resid 62 and name HA ) 4.6 1.1 1.1
assign (resid 16 and name HG2# ) (resid 68 and (name HB1 or name HB2 )) 3.0 0.8 0.8
assign (resid 16 and name HG2# ) (resid 68 and (name HB2 or name HB1 )) 3.1 0.8 0.8
assign (resid 16 and name HG2# ) (resid 68 and (name HG1 or name HG2 )) 2.8 0.7 0.7
assign (resid 16 and name HG2# ) (resid 68 and (name HG2 or name HG1 )) 2.9 0.7 0.7
assign (resid 16 and name HG2# ) (resid 68 and name HA ) 3.9 1.0 1.0
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assign (resid 17 and (name HG2 or name HG1 )) (resid 18 and (name HD1# or name HD2# )) 2.4 0.6 0.6
assign (resid 17 and (name HG2 or name HG1 )) (resid 21 and (name HB1 or name HB2 )) 3.3 0.8 0.8
assign (resid 17 and (name HG2 or name HG1 )) (resid 21 and (name HB2 or name HB1 )) 3.3 0.8 0.8
assign (resid 17 and name HA ) (resid 19 and name HG2# ) 5.3 1.3 1.3
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assign (resid 17 and name HA ) (resid 20 and (name HB2 or name HB1 )) 2.8 0.7 0.7
assign (resid 17 and name HA ) (resid 20 and name HA ) 4.1 1.0 1.0
assign (resid 17 and name HB# ) (resid 18 and (name HD1# or name HD2# )) 3.6 0.9 0.9
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assign (resid 17 and name HE# ) (resid 21 and (name HB2 or name HB1 )) 3.6 0.9 0.9
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assign (resid 18 and (name HB1 or name HB2 )) (resid 23 and (name HD1 or name HD2 )) 5.0 1.2 1.2
assign (resid 18 and (name HB1 or name HB2 )) (resid 23 and name HG# ) 3.8 0.9 0.9
assign (resid 18 and (name HB1 or name HB2 )) (resid 28 and (name HG12 or name HG13 )) 3.8 0.9 0.9
assign (resid 18 and (name HB1 or name HB2 )) (resid 28 and (name HG13 or name HG12 )) 3.7 0.9 0.9
assign (resid 18 and (name HB1 or name HB2 )) (resid 28 and name HA ) 4.5 1.1 1.1
assign (resid 18 and (name HB1 or name HB2 )) (resid 28 and name HD1# ) 3.1 0.8 0.8
assign (resid 18 and (name HB1 or name HB2 )) (resid 28 and name HG2# ) 3.7 0.9 0.9
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assign (resid 18 and (name HB2 or name HB1 )) (resid 23 and (name HB1 or name HB2 )) 3.9 1.0 1.0
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assign (resid 18 and (name HB2 or name HB1 )) (resid 23 and (name HD1 or name HD2 )) 4.4 1.1 1.1
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assign (resid 18 and (name HB2 or name HB1 )) (resid 28 and name HB ) 5.1 1.3 1.3
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assign (resid 18 and (name HB2 or name HB1 )) (resid 28 and name HG1# ) 3.8 0.9 0.9
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assign (resid 18 and (name HD1# or name HD2# )) (resid 21 and name HA ) 5.0 1.2 1.2
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assign (resid 18 and (name HD1# or name HD2# )) (resid 23 and (name HB2 or name HB1 )) 3.9 1.0 1.0
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assign (resid 18 and (name HD1# or name HD2# )) (resid 23 and (name HE1 or name HE2 )) 2.9 0.7 0.7
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assign (resid 18 and (name HD1# or name HD2# )) (resid 28 and (name HG12 or name HG13 )) 3.7 0.9 0.9
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assign (resid 18 and (name HD2# or name HD1# )) (resid 28 and (name HG12 or name HG13 )) 3.3 0.8 0.8
assign (resid 18 and (name HD2# or name HD1# )) (resid 28 and (name HG13 or name HG12 )) 3.4 0.8 0.8
assign (resid 18 and (name HD2# or name HD1# )) (resid 28 and name HA ) 2.7 0.7 0.7
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assign (resid 18 and name HA ) (resid 19 and name HA ) 4.9 1.2 1.2
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assign (resid 18 and name HA ) (resid 23 and name HA ) 5.1 1.3 1.3
assign (resid 18 and name HA ) (resid 23 and name HG# ) 3.1 0.8 0.8
assign (resid 18 and name HA ) (resid 28 and (name HG13 or name HG12 )) 4.9 1.2 1.2
assign (resid 18 and name HA ) (resid 28 and name HD1# ) 4.1 1.0 1.0
assign (resid 18 and name HA ) (resid 28 and name HG2# ) 5.1 1.3 1.3
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assign (resid 18 and name HG ) (resid 28 and (name HG13 or name HG12 )) 4.9 1.2 1.2
assign (resid 18 and name HG ) (resid 28 and name HA ) 5.1 1.3 1.3
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assign (resid 21 and name HA ) (resid 22 and (name HB2 or name HB1 )) 4.2 1.1 1.1
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assign (resid 23 and (name HB1 or name HB2 )) (resid 28 and name HD1# ) 3.2 0.8 0.8
assign (resid 23 and (name HB1 or name HB2 )) (resid 28 and name HG2# ) 5.1 1.3 1.3
assign (resid 23 and (name HB2 or name HB1 )) (resid 28 and (name HG12 or name HG13 )) 3.6 0.9 0.9
assign (resid 23 and (name HB2 or name HB1 )) (resid 28 and (name HG13 or name HG12 )) 3.8 0.9 0.9
assign (resid 23 and (name HB2 or name HB1 )) (resid 28 and name HB ) 4.8 1.2 1.2
assign (resid 23 and (name HB2 or name HB1 )) (resid 28 and name HD1# ) 3.1 0.8 0.8
assign (resid 23 and (name HB2 or name HB1 )) (resid 28 and name HG2# ) 4.7 1.2 1.2
assign (resid 23 and (name HD1 or name HD2 )) (resid 24 and name HG2# ) 4.7 1.2 1.2
assign (resid 23 and (name HD1 or name HD2 )) (resid 27 and (name HB1 or name HB2 )) 4.4 1.1 1.1
assign (resid 23 and (name HD1 or name HD2 )) (resid 27 and (name HG1 or name HG2 )) 5.1 1.3 1.3
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assign (resid 23 and (name HD1 or name HD2 )) (resid 35 and name HE# ) 4.3 1.1 1.1
assign (resid 23 and (name HD2 or name HD1 )) (resid 24 and name HG2# ) 4.6 1.1 1.1
assign (resid 23 and (name HD2 or name HD1 )) (resid 27 and (name HB1 or name HB2 )) 4.4 1.1 1.1
assign (resid 23 and (name HD2 or name HD1 )) (resid 27 and (name HB2 or name HB1 )) 3.8 0.9 0.9
assign (resid 23 and (name HD2 or name HD1 )) (resid 27 and (name HG2 or name HG1 )) 4.7 1.2 1.2
assign (resid 23 and (name HD2 or name HD1 )) (resid 28 and name HD1# ) 5.0 1.2 1.2
assign (resid 23 and (name HE1 or name HE2 )) (resid 24 and name HG2# ) 5.2 1.3 1.3
assign (resid 23 and (name HE1 or name HE2 )) (resid 27 and (name HB2 or name HB1 )) 4.6 1.1 1.1
assign (resid 23 and name HA ) (resid 24 and name HA ) 4.3 1.1 1.1
assign (resid 23 and name HA ) (resid 24 and name HG2# ) 3.5 0.9 0.9
assign (resid 23 and name HA ) (resid 27 and (name HB1 or name HB2 )) 3.9 1.0 1.0
assign (resid 23 and name HA ) (resid 27 and (name HB2 or name HB1 )) 4.1 1.0 1.0
assign (resid 23 and name HA ) (resid 27 and (name HG2 or name HG1 )) 4.3 1.1 1.1
assign (resid 23 and name HA ) (resid 28 and (name HG12 or name HG13 )) 4.7 1.2 1.2
assign (resid 23 and name HA ) (resid 28 and name HD1# ) 4.1 1.0 1.0
assign (resid 23 and name HG# ) (resid 27 and (name HB1 or name HB2 )) 4.0 1.0 1.0
assign (resid 23 and name HG# ) (resid 27 and (name HB2 or name HB1 )) 3.7 0.9 0.9
assign (resid 23 and name HG# ) (resid 27 and (name HG1 or name HG2 )) 4.3 1.1 1.1
assign (resid 23 and name HG# ) (resid 27 and (name HG2 or name HG1 )) 4.5 1.1 1.1
assign (resid 23 and name HG# ) (resid 28 and (name HG13 or name HG12 )) 4.3 1.1 1.1
assign (resid 23 and name HG# ) (resid 28 and name HD1# ) 3.8 0.9 0.9
assign (resid 24 and name HA ) (resid 25 and name HB# ) 4.0 1.0 1.0
assign (resid 24 and name HA ) (resid 28 and name HD1# ) 4.3 1.1 1.1
assign (resid 24 and name HB ) (resid 25 and name HA ) 5.2 1.3 1.3
assign (resid 24 and name HB ) (resid 25 and name HB# ) 4.3 1.1 1.1
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assign (resid 24 and name HB ) (resid 27 and (name HG1 or name HG2 )) 4.8 1.2 1.2
assign (resid 24 and name HG2# ) (resid 25 and name HB# ) 4.3 1.1 1.1
assign (resid 24 and name HG2# ) (resid 26 and (name HB1 or name HB2 )) 4.1 1.0 1.0
assign (resid 24 and name HG2# ) (resid 26 and name HA ) 4.8 1.2 1.2
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assign (resid 24 and name HG2# ) (resid 28 and name HD1# ) 4.7 1.2 1.2
assign (resid 25 and (name HG1 or name HG2 )) (resid 28 and name HD1# ) 4.1 1.0 1.0
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assign (resid 25 and (name HG1 or name HG2 )) (resid 29 and (name HD2# or name HD1# )) 2.9 0.7 0.7
assign (resid 25 and (name HG1 or name HG2 )) (resid 29 and name HG ) 3.6 0.9 0.9
assign (resid 25 and (name HG2 or name HG1 )) (resid 26 and name HA ) 4.2 1.1 1.1
assign (resid 25 and (name HG2 or name HG1 )) (resid 29 and (name HB2 or name HB1 )) 4.9 1.2 1.2
assign (resid 25 and (name HG2 or name HG1 )) (resid 29 and (name HD2# or name HD1# )) 2.9 0.7 0.7
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assign (resid 25 and (name HG2 or name HG1 )) (resid 29 and name HG ) 3.6 0.9 0.9
assign (resid 25 and (name HG1 or name HG2 )) (resid 63 and (name HD1#  or name HD2# )) 2.7 0.7 0.7
assign (resid 25 and (name HG2 or name HG1 )) (resid 63 and (name HD1#  or name HD2# )) 2.7 0.7 0.7
assign (resid 25 and name HA ) (resid 26 and name HA ) 4.6 1.1 1.1
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assign (resid 25 and name HA ) (resid 28 and (name HG12 or name HG13 )) 4.1 1.0 1.0
assign (resid 25 and name HA ) (resid 28 and (name HG13 or name HG12 )) 5.0 1.2 1.2
assign (resid 25 and name HA ) (resid 28 and name HA ) 4.7 1.2 1.2
assign (resid 25 and name HA ) (resid 28 and name HB ) 2.7 0.7 0.7
assign (resid 25 and name HA ) (resid 28 and name HD1# ) 2.8 0.7 0.7
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assign (resid 25 and name HA ) (resid 29 and (name HD1# or name HD2# )) 4.6 1.1 1.1
assign (resid 25 and name HA ) (resid 29 and name HG ) 4.7 1.2 1.2
assign (resid 25 and name HA ) (resid 59 and (name HD1# or name HD2# )) 2.8 0.7 0.7
assign (resid 25 and name HA ) (resid 59 and (name HD2# or name HD1# )) 3.1 0.8 0.8
assign (resid 25 and name HB# ) (resid 28 and name HB ) 4.1 1.0 1.0
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assign (resid 25 and name HB# ) (resid 63 and (name HD1# or name HD2# )) 2.7 0.7 0.7
assign (resid 25 and name HB# ) (resid 29 and name HG ) 4.1 1.0 1.0
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assign (resid 26 and (name HB1 or name HB2 )) (resid 29 and (name HB1 or name HB2 )) 4.5 1.1 1.1
assign (resid 26 and (name HB1 or name HB2 )) (resid 29 and (name HD2# or name HD1# )) 3.8 0.9 0.9
assign (resid 26 and (name HB1 or name HB2 )) (resid 29 and name HG ) 5.1 1.3 1.3
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assign (resid 26 and name HA ) (resid 29 and (name HB1 or name HB2 )) 2.7 0.7 0.7
assign (resid 26 and name HA ) (resid 29 and (name HB2 or name HB1 )) 3.0 0.8 0.8
assign (resid 26 and name HA ) (resid 29 and (name HD1# or name HD2# )) 3.9 1.0 1.0
assign (resid 26 and name HA ) (resid 29 and (name HD2# or name HD1# )) 2.6 0.7 0.7
assign (resid 26 and name HA ) (resid 29 and name HG ) 3.4 0.8 0.8
assign (resid 26 and name HD# ) (resid 29 and (name HD2# or name HD1# )) 4.3 1.1 1.1
assign (resid 27 and (name HB1 or name HB2 )) (resid 28 and (name HG12 or name HG13 )) 4.4 1.1 1.1
assign (resid 27 and (name HB1 or name HB2 )) (resid 28 and name HB ) 5.2 1.3 1.3
assign (resid 27 and (name HB2 or name HB1 )) (resid 28 and name HA ) 4.8 1.2 1.2
assign (resid 27 and (name HB2 or name HB1 )) (resid 30 and name HB# ) 4.6 1.1 1.1
assign (resid 27 and name HA ) (resid 30 and name HA ) 4.4 1.1 1.1
assign (resid 27 and name HA ) (resid 30 and name HB# ) 2.8 0.7 0.7
assign (resid 28 and (name HG12 or name HG13 )) (resid 29 and name HG ) 4.3 1.1 1.1
assign (resid 28 and (name HG12 or name HG13 )) (resid 31 and name HB# ) 4.4 1.1 1.1
assign (resid 28 and (name HG12 or name HG13 )) (resid 59 and (name HD1# or name HD2# )) 4.5 1.1 1.1
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assign (resid 28 and (name HG13 or name HG12 )) (resid 59 and (name HD2# or name HD1# )) 4.2 1.1 1.1
assign (resid 28 and name HA ) (resid 31 and name HA ) 4.8 1.2 1.2
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assign (resid 28 and name HA ) (resid 35 and name HE# ) 3.8 0.9 0.9
assign (resid 28 and name HA ) (resid 59 and (name HD1# or name HD2# )) 4.7 1.2 1.2
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assign (resid 28 and name HD1# ) (resid 31 and name HB# ) 4.3 1.1 1.1
assign (resid 28 and name HD1# ) (resid 35 and name HE# ) 4.3 1.1 1.1
assign (resid 28 and name HD1# ) (resid 59 and (name HD1# or name HD2# )) 3.2 0.8 0.8
assign (resid 28 and name HD1# ) (resid 59 and (name HD2# or name HD1# )) 2.3 0.6 0.6
assign (resid 28 and name HD1# ) (resid 59 and name HA ) 4.7 1.2 1.2
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assign (resid 28 and name HG2# ) (resid 29 and (name HD1# or name HD2# )) 3.4 0.8 0.8
assign (resid 28 and name HG2# ) (resid 29 and (name HD2# or name HD1# )) 4.3 1.1 1.1
assign (resid 28 and name HG2# ) (resid 29 and name HA ) 3.7 0.9 0.9
assign (resid 28 and name HG2# ) (resid 29 and name HG ) 4.2 1.1 1.1
assign (resid 28 and name HG2# ) (resid 31 and name HB# ) 3.2 0.8 0.8
assign (resid 28 and name HG2# ) (resid 32 and name HA ) 5.1 1.3 1.3
assign (resid 28 and name HG2# ) (resid 32 and name HD# ) 3.7 0.9 0.9
assign (resid 28 and name HG2# ) (resid 32 and name HZ ) 3.5 0.9 0.9
assign (resid 28 and name HG2# ) (resid 35 and name HE# ) 2.9 0.7 0.7
assign (resid 28 and name HG2# ) (resid 59 and (name HD1# or name HD2# )) 2.6 0.7 0.7
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assign (resid 28 and name HG2# ) (resid 59 and name HA ) 4.1 1.0 1.0
assign (resid 29 and (name HB1 or name HB2 )) (resid 30 and name HA ) 5.0 1.2 1.2
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assign (resid 29 and (name HB2 or name HB1 )) (resid 30 and name HA ) 4.5 1.1 1.1
assign (resid 29 and (name HB2 or name HB1 )) (resid 32 and name HD# ) 4.5 1.1 1.1
assign (resid 29 and (name HD1# or name HD2# )) (resid 31 and name HB# ) 4.8 1.2 1.2
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assign (resid 29 and name HA ) (resid 30 and name HA ) 4.8 1.2 1.2
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assign (resid 29 and name HA ) (resid 32 and name HA ) 4.7 1.2 1.2
assign (resid 29 and name HA ) (resid 32 and name HB# ) 3.7 0.9 0.9
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assign (resid 31 and name HB# ) (resid 35 and name HA ) 5.0 1.2 1.2
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assign (resid 32 and name HA ) (resid 33 and name HA ) 4.5 1.1 1.1
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assign (resid 32 and name HA ) (resid 35 and (name HG2 or name HG1 )) 3.2 0.8 0.8
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assign (resid 32 and name HA ) (resid 51 and (name HG1# or name HG2# )) 3.5 0.9 0.9
assign (resid 32 and name HA ) (resid 51 and (name HG2# or name HG1# )) 3.6 0.9 0.9
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assign (resid 33 and (name HB1 or name HB2 )) (resid 34 and name HG# ) 4.1 1.0 1.0
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assign (resid 35 and (name HG1 or name HG2 )) (resid 51 and (name HG1# or name HG2# )) 4.4 1.1 1.1
assign (resid 35 and (name HG2 or name HG1 )) (resid 51 and (name HG1# or name HG2# )) 4.5 1.1 1.1
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assign (resid 53 and name HG2# ) (resid 54 and (name HB1 or name HB2 )) 4.7 1.2 1.2
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assign (resid 53 and name HG2# ) (resid 54 and name HD# ) 3.1 0.8 0.8
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assign (resid 54 and (name HB1 or name HB2 )) (resid 55 and (name HA2 or name HA1 )) 5.1 1.3 1.3
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assign ( resid 9  and name O ) ( resid 13 and name HN ) 1.9 0.4 0.6
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assign ( resid 10  and name O ) ( resid 14 and name HN ) 1.9 0.4 0.6
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assign ( resid 11  and name O ) ( resid 15 and name HN ) 1.9 0.4 0.6
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assign ( resid 12  and name O ) ( resid 16 and name HN ) 1.9 0.4 0.6
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assign ( resid 13  and name O ) ( resid 17 and name HN ) 1.9 0.4 0.6
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assign ( resid 15  and name O ) ( resid 19 and name HN ) 1.9 0.4 0.6
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assign ( resid 26  and name O ) ( resid 30 and name HN ) 1.9 0.4 0.6
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assign ( resid 28  and name O ) ( resid 32 and name HN ) 1.9 0.4 0.6
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assign ( resid 55  and name O ) ( resid 59 and name HN ) 1.9 0.4 0.6
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assign ( resid 69  and name O ) ( resid 73 and name HN ) 1.9 0.4 0.6
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assign  ( resid 2   and name N )
        ( resid 2   and name CA )
        ( resid 2   and name C )
        ( resid 3   and name N ) 5.00 125.88 25 2

assign ( resid 3   and name N )
 ( resid 3   and name CA ) 
 ( resid 3   and name C )
 ( resid 4   and name N ) 5.00 -36.21 30 2

assign ( resid 4   and name N )
 ( resid 4   and name CA ) 
 ( resid 4   and name C )
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assign ( resid 5   and name N )
 ( resid 5   and name CA ) 
 ( resid 5   and name C )
 ( resid 6   and name N ) 5.00 -39.33 7 2

assign ( resid 6   and name N )
 ( resid 6   and name CA ) 
 ( resid 6   and name C )
 ( resid 7   and name N ) 5.00 -36.61 14 2

assign ( resid 7   and name N )
 ( resid 7   and name CA ) 
 ( resid 7   and name C )
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 ( resid 78 and name C )  4.298  0  0

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 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 32 and name CA )
 ( resid 32 and name C )  -2.163  0  0
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 33 and name CA )
 ( resid 33 and name C )  6.171  0  0
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 34 and name CA )
 ( resid 34 and name C )  -2.763  50  0
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 35 and name CA )
 ( resid 35 and name C )  -5.005  50  0
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 36 and name CA )
 ( resid 36 and name C )  7.922  0  50
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 37 and name CA )
 ( resid 37 and name C )  -1.106  50  0
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 38 and name CA )
 ( resid 38 and name C )  -2.336  50  0
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 61 and name CA )
 ( resid 61 and name C )  -0.926  50  0
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 68 and name CA )
 ( resid 68 and name C )  -3.713  50  0
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 79 and name CA )
 ( resid 79 and name C )  -3.956  50  0
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 80 and name CA )
 ( resid 80 and name C )  -0.029  50  0
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 81 and name CA )
 ( resid 81 and name C )  1.219  0  50
assign ( resid 500 and name OO )
 ( resid 500 and name Z )
 ( resid 500 and name X )
 ( resid 500 and name Y )
 ( resid 83 and name CA )
 ( resid 83 and name C )  0.707  0  50

  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    SER   1          HT1       SER   1   6.542  15.699  -1.939
    2   2H    SER   1          HT2       SER   1   7.238  16.941  -1.012
    3   3H    SER   1          HT3       SER   1   6.048  17.305  -2.168
    4    HA   SER   1           HA       SER   1   5.717  15.907   0.420
    5   1HB   SER   1          HB2       SER   1   4.254  18.262  -0.802
    6   2HB   SER   1          HB1       SER   1   4.121  17.675   0.853
    7    HG   SER   1           HG       SER   1   5.598  19.536   0.343
    8    H    ASP   2           HN       ASP   2   5.401  14.523  -2.104
    9    HA   ASP   2           HA       ASP   2   2.633  14.489  -2.906
   10   1HB   ASP   2          HB2       ASP   2   4.308  13.694  -4.443
   11   2HB   ASP   2          HB1       ASP   2   4.881  12.501  -3.281
   12    H    VAL   3           HN       VAL   3   1.217  14.116  -1.280
   13    HA   VAL   3           HA       VAL   3   1.524  12.374   0.939
   14    HB   VAL   3           HB       VAL   3  -0.691  12.847   1.432
   15   1HG1  VAL   3          HG11      VAL   3  -0.979  15.159   0.993
   16   2HG1  VAL   3          HG12      VAL   3  -0.137  15.054  -0.553
   17   3HG1  VAL   3          HG13      VAL   3   0.765  14.897   0.955
   18   1HG2  VAL   3          HG21      VAL   3  -1.171  12.948  -1.560
   19   2HG2  VAL   3          HG22      VAL   3  -2.354  13.536  -0.390
   20   3HG2  VAL   3          HG23      VAL   3  -1.878  11.838  -0.385
   21    H    TYR   4           HN       TYR   4   1.003  11.517  -2.418
   22    HA   TYR   4           HA       TYR   4  -0.579   9.201  -1.756
   23   1HB   TYR   4          HB2       TYR   4   0.812  10.160  -4.260
   24   2HB   TYR   4          HB1       TYR   4   0.288   8.482  -4.212
   25    HD1  TYR   4           HD1      TYR   4  -2.193   8.102  -3.395
   26    HD2  TYR   4           HD2      TYR   4  -0.702  11.791  -5.000
   27    HE1  TYR   4           HE1      TYR   4  -4.492   8.742  -4.042
   28    HE2  TYR   4           HE2      TYR   4  -3.008  12.451  -5.621
   29    HH   TYR   4           HH       TYR   4  -5.205  11.159  -6.164
   30    H    CYS   5           HN       CYS   5   2.860   9.642  -2.439
   31    HA   CYS   5           HA       CYS   5   3.605   6.897  -2.256
   32   1HB   CYS   5          HB2       CYS   5   5.098   9.461  -1.640
   33   2HB   CYS   5          HB1       CYS   5   5.857   7.874  -1.505
   34    H    GLU   6           HN       GLU   6   3.275   9.369   0.294
   35    HA   GLU   6           HA       GLU   6   4.230   7.797   2.443
   36   1HB   GLU   6          HB2       GLU   6   3.825  10.122   2.825
   37   2HB   GLU   6          HB1       GLU   6   2.142   9.986   2.324
   38   1HG   GLU   6          HG2       GLU   6   3.127   8.360   4.665
   39   2HG   GLU   6          HG1       GLU   6   2.737  10.063   4.894
   40    H    VAL   7           HN       VAL   7   0.939   7.997   1.088
   41    HA   VAL   7           HA       VAL   7  -0.140   6.135   3.038
   42    HB   VAL   7           HB       VAL   7  -1.211   7.077   0.355
   43   1HG1  VAL   7          HG11      VAL   7  -2.362   5.063   0.805
   44   2HG1  VAL   7          HG12      VAL   7  -3.426   6.315   1.445
   45   3HG1  VAL   7          HG13      VAL   7  -2.410   5.376   2.539
   46   1HG2  VAL   7          HG21      VAL   7  -1.155   8.982   1.739
   47   2HG2  VAL   7          HG22      VAL   7  -1.490   8.056   3.199
   48   3HG2  VAL   7          HG23      VAL   7  -2.775   8.357   2.031
   49    H    CYS   8           HN       CYS   8   1.040   5.643  -0.327
   50    HA   CYS   8           HA       CYS   8   0.218   2.924  -0.541
   51   1HB   CYS   8          HB2       CYS   8   1.014   4.141  -2.457
   52   2HB   CYS   8          HB1       CYS   8   2.583   4.399  -1.714
   53    H    GLU   9           HN       GLU   9   3.153   4.372   0.914
   54    HA   GLU   9           HA       GLU   9   4.305   1.773   1.463
   55   1HB   GLU   9          HB2       GLU   9   4.926   4.620   2.187
   56   2HB   GLU   9          HB1       GLU   9   5.633   3.355   3.190
   57   1HG   GLU   9          HG2       GLU   9   5.850   3.323   0.173
   58   2HG   GLU   9          HG1       GLU   9   7.037   4.133   1.194
   59    H    PHE  10           HN       PHE  10   2.079   3.986   3.161
   60    HA   PHE  10           HA       PHE  10   2.353   2.673   5.701
   61   1HB   PHE  10          HB2       PHE  10   1.337   4.907   5.528
   62   2HB   PHE  10          HB1       PHE  10   0.001   4.226   4.592
   63    HD1  PHE  10           HD1      PHE  10  -1.684   2.822   5.625
   64    HD2  PHE  10           HD2      PHE  10   1.605   4.366   7.911
   65    HE1  PHE  10           HE1      PHE  10  -2.817   2.123   7.725
   66    HE2  PHE  10           HE2      PHE  10   0.476   3.680  10.011
   67    HZ   PHE  10           HZ       PHE  10  -1.738   2.563   9.916
   68    H    LEU  11           HN       LEU  11  -0.008   2.302   3.024
   69    HA   LEU  11           HA       LEU  11  -1.495   0.181   4.262
   70   1HB   LEU  11          HB2       LEU  11  -1.030   0.773   1.315
   71   2HB   LEU  11          HB1       LEU  11  -2.178  -0.433   1.924
   72    HG   LEU  11           HG       LEU  11  -2.290   2.443   2.871
   73   1HD1  LEU  11          HD11      LEU  11  -2.413   2.603   0.455
   74   2HD1  LEU  11          HD12      LEU  11  -4.041   2.797   1.105
   75   3HD1  LEU  11          HD13      LEU  11  -3.557   1.263   0.383
   76   1HD2  LEU  11          HD21      LEU  11  -3.666   0.957   4.165
   77   2HD2  LEU  11          HD22      LEU  11  -4.255   0.134   2.722
   78   3HD2  LEU  11          HD23      LEU  11  -4.754   1.789   3.059
   79    H    VAL  12           HN       VAL  12   1.357   0.123   2.071
   80    HA   VAL  12           HA       VAL  12   1.541  -2.698   1.893
   81    HB   VAL  12           HB       VAL  12   3.528  -0.424   1.699
   82   1HG1  VAL  12          HG11      VAL  12   4.089  -3.389   1.507
   83   2HG1  VAL  12          HG12      VAL  12   4.911  -2.199   2.517
   84   3HG1  VAL  12          HG13      VAL  12   5.124  -2.165   0.770
   85   1HG2  VAL  12          HG21      VAL  12   1.853  -0.833  -0.113
   86   2HG2  VAL  12          HG22      VAL  12   2.532  -2.447  -0.329
   87   3HG2  VAL  12          HG23      VAL  12   3.519  -1.022  -0.660
   88    H    LYS  13           HN       LYS  13   3.084  -0.431   4.232
   89    HA   LYS  13           HA       LYS  13   4.459  -2.412   5.738
   90   1HB   LYS  13          HB2       LYS  13   5.019  -0.119   6.126
   91   2HB   LYS  13          HB1       LYS  13   3.349   0.303   6.498
   92   1HG   LYS  13          HG2       LYS  13   3.421  -0.706   8.616
   93   2HG   LYS  13          HG1       LYS  13   4.780  -1.746   8.186
   94   1HD   LYS  13          HD2       LYS  13   5.413   0.132   9.724
   95   2HD   LYS  13          HD1       LYS  13   6.304   0.144   8.201
   96   1HE   LYS  13          HE2       LYS  13   5.384   2.399   8.947
   97   2HE   LYS  13          HE1       LYS  13   4.944   1.903   7.313
   98   1HZ   LYS  13          HZ1       LYS  13   3.100   2.773   8.796
   99   2HZ   LYS  13          HZ2       LYS  13   3.221   1.303   9.639
  100   3HZ   LYS  13          HZ3       LYS  13   2.808   1.309   7.992
  101    H    GLU  14           HN       GLU  14   1.207  -1.057   6.127
  102    HA   GLU  14           HA       GLU  14   0.563  -2.618   8.466
  103   1HB   GLU  14          HB2       GLU  14  -0.585  -0.466   7.241
  104   2HB   GLU  14          HB1       GLU  14  -1.681  -1.738   6.709
  105   1HG   GLU  14          HG2       GLU  14  -0.906  -1.166   9.590
  106   2HG   GLU  14          HG1       GLU  14  -2.441  -0.740   8.838
  107    H    VAL  15           HN       VAL  15   0.084  -3.111   4.993
  108    HA   VAL  15           HA       VAL  15  -1.532  -5.472   5.342
  109    HB   VAL  15           HB       VAL  15  -0.016  -4.287   3.022
  110   1HG1  VAL  15          HG11      VAL  15   0.285  -6.530   2.438
  111   2HG1  VAL  15          HG12      VAL  15  -1.308  -6.208   1.735
  112   3HG1  VAL  15          HG13      VAL  15  -1.179  -7.052   3.275
  113   1HG2  VAL  15          HG21      VAL  15  -2.949  -4.932   3.466
  114   2HG2  VAL  15          HG22      VAL  15  -2.269  -4.029   2.111
  115   3HG2  VAL  15          HG23      VAL  15  -2.217  -3.350   3.738
  116    H    THR  16           HN       THR  16   2.004  -5.066   4.743
  117    HA   THR  16           HA       THR  16   2.424  -7.872   4.568
  118    HB   THR  16           HB       THR  16   4.691  -7.554   4.738
  119    HG1  THR  16           HG1      THR  16   5.362  -6.579   6.449
  120   1HG2  THR  16          HG21      THR  16   4.548  -4.735   4.078
  121   2HG2  THR  16          HG22      THR  16   3.274  -5.623   3.246
  122   3HG2  THR  16          HG23      THR  16   4.957  -6.091   3.033
  123    H    LYS  17           HN       LYS  17   2.276  -5.739   7.426
  124    HA   LYS  17           HA       LYS  17   3.192  -7.750   9.235
  125   1HB   LYS  17          HB2       LYS  17   3.073  -5.583  10.186
  126   2HB   LYS  17          HB1       LYS  17   1.427  -5.323   9.606
  127   1HG   LYS  17          HG2       LYS  17   0.476  -6.653  11.281
  128   2HG   LYS  17          HG1       LYS  17   1.944  -7.594  11.517
  129   1HD   LYS  17          HD2       LYS  17   3.013  -5.577  12.537
  130   2HD   LYS  17          HD1       LYS  17   1.465  -4.737  12.406
  131   1HE   LYS  17          HE2       LYS  17   0.392  -6.299  13.878
  132   2HE   LYS  17          HE1       LYS  17   1.772  -7.396  13.830
  133   1HZ   LYS  17          HZ1       LYS  17   3.097  -5.551  14.834
  134   2HZ   LYS  17          HZ2       LYS  17   1.893  -6.190  15.848
  135   3HZ   LYS  17          HZ3       LYS  17   1.648  -4.701  15.067
  136    H    LEU  18           HN       LEU  18   0.152  -7.013   7.711
  137    HA   LEU  18           HA       LEU  18  -1.477  -8.885   9.229
  138   1HB   LEU  18          HB2       LEU  18  -1.831  -7.498   6.555
  139   2HB   LEU  18          HB1       LEU  18  -3.033  -8.545   7.223
  140    HG   LEU  18           HG       LEU  18  -2.646  -5.734   7.718
  141   1HD1  LEU  18          HD11      LEU  18  -4.806  -6.890   7.408
  142   2HD1  LEU  18          HD12      LEU  18  -4.778  -5.917   8.882
  143   3HD1  LEU  18          HD13      LEU  18  -4.601  -7.660   8.981
  144   1HD2  LEU  18          HD21      LEU  18  -2.622  -5.549  10.108
  145   2HD2  LEU  18          HD22      LEU  18  -1.210  -6.490   9.673
  146   3HD2  LEU  18          HD23      LEU  18  -2.639  -7.293  10.323
  147    H    ILE  19           HN       ILE  19   0.467  -9.018   6.318
  148    HA   ILE  19           HA       ILE  19  -0.339 -11.710   5.580
  149    HB   ILE  19           HB       ILE  19   2.133 -10.076   4.858
  150   1HG1  ILE  19          HG12      ILE  19  -0.416 -10.674   3.310
  151   2HG1  ILE  19          HG11      ILE  19  -0.048  -9.148   4.086
  152   1HG2  ILE  19          HG21      ILE  19   1.074 -12.659   3.663
  153   2HG2  ILE  19          HG22      ILE  19   2.566 -12.482   4.587
  154   3HG2  ILE  19          HG23      ILE  19   2.410 -11.709   3.015
  155   1HD1  ILE  19          HD11      ILE  19   2.127  -9.190   2.660
  156   2HD1  ILE  19          HD12      ILE  19   0.610  -8.777   1.865
  157   3HD1  ILE  19          HD13      ILE  19   1.279 -10.398   1.696
  158    H    ASP  20           HN       ASP  20   2.100 -10.198   7.586
  159    HA   ASP  20           HA       ASP  20   3.607 -12.629   8.103
  160   1HB   ASP  20          HB2       ASP  20   3.524 -10.062   9.709
  161   2HB   ASP  20          HB1       ASP  20   4.788 -11.291   9.741
  162    H    ASN  21           HN       ASN  21   0.703 -11.208   9.470
  163    HA   ASN  21           HA       ASN  21   1.001 -12.888  11.883
  164   1HB   ASN  21          HB2       ASN  21   0.041 -10.604  12.168
  165   2HB   ASN  21          HB1       ASN  21  -1.289 -11.039  11.092
  166   1HD2  ASN  21          HD21      ASN  21  -2.633 -10.507  13.121
  167   2HD2  ASN  21          HD22      ASN  21  -2.859 -11.746  14.259
  168    H    ASN  22           HN       ASN  22   0.143 -13.517   8.822
  169    HA   ASN  22           HA       ASN  22  -0.661 -15.551   7.980
  170   1HB   ASN  22          HB2       ASN  22  -0.168 -16.300  10.462
  171   2HB   ASN  22          HB1       ASN  22  -1.926 -16.340  10.588
  172   1HD2  ASN  22          HD21      ASN  22  -2.687 -18.413  10.192
  173   2HD2  ASN  22          HD22      ASN  22  -2.049 -19.488   9.043
  174    H    LYS  23           HN       LYS  23  -2.300 -13.187   7.747
  175    HA   LYS  23           HA       LYS  23  -5.066 -14.152   8.277
  176   1HB   LYS  23          HB2       LYS  23  -4.323 -11.554   7.041
  177   2HB   LYS  23          HB1       LYS  23  -5.800 -11.961   7.898
  178   1HG   LYS  23          HG2       LYS  23  -3.647 -12.425   9.741
  179   2HG   LYS  23          HG1       LYS  23  -3.322 -10.872   8.988
  180   1HD   LYS  23          HD2       LYS  23  -5.467  -9.995   9.694
  181   2HD   LYS  23          HD1       LYS  23  -5.998 -11.597  10.212
  182   1HE   LYS  23          HE2       LYS  23  -4.137 -11.619  11.885
  183   2HE   LYS  23          HE1       LYS  23  -3.767  -9.955  11.432
  184   1HZ   LYS  23          HZ1       LYS  23  -6.516 -10.662  12.183
  185   2HZ   LYS  23          HZ2       LYS  23  -5.705  -9.177  12.332
  186   3HZ   LYS  23          HZ3       LYS  23  -5.359 -10.448  13.405
  187    H    THR  24           HN       THR  24  -6.578 -14.396   6.519
  188    HA   THR  24           HA       THR  24  -5.395 -15.288   3.984
  189    HB   THR  24           HB       THR  24  -7.477 -16.200   3.502
  190    HG1  THR  24           HG1      THR  24  -8.691 -14.375   3.422
  191   1HG2  THR  24          HG21      THR  24  -6.691 -17.035   5.719
  192   2HG2  THR  24          HG22      THR  24  -8.444 -17.091   5.532
  193   3HG2  THR  24          HG23      THR  24  -7.701 -15.815   6.493
  194    H    GLU  25           HN       GLU  25  -6.476 -14.564   1.909
  195    HA   GLU  25           HA       GLU  25  -6.042 -11.747   1.502
  196   1HB   GLU  25          HB2       GLU  25  -5.983 -13.644  -0.254
  197   2HB   GLU  25          HB1       GLU  25  -7.742 -13.516  -0.281
  198   1HG   GLU  25          HG2       GLU  25  -7.343 -10.983  -0.685
  199   2HG   GLU  25          HG1       GLU  25  -5.693 -11.457  -1.092
  200    H    LYS  26           HN       LYS  26  -8.999 -13.703   1.821
  201    HA   LYS  26           HA       LYS  26 -10.911 -11.668   1.461
  202   1HB   LYS  26          HB2       LYS  26 -11.329 -14.163   1.687
  203   2HB   LYS  26          HB1       LYS  26 -11.192 -13.937   3.426
  204   1HG   LYS  26          HG2       LYS  26 -13.494 -13.695   3.150
  205   2HG   LYS  26          HG1       LYS  26 -12.978 -12.016   3.016
  206   1HD   LYS  26          HD2       LYS  26 -12.981 -12.194   0.560
  207   2HD   LYS  26          HD1       LYS  26 -13.439 -13.892   0.674
  208   1HE   LYS  26          HE2       LYS  26 -15.067 -11.499   1.568
  209   2HE   LYS  26          HE1       LYS  26 -15.447 -12.614   0.256
  210   1HZ   LYS  26          HZ1       LYS  26 -16.701 -13.152   2.240
  211   2HZ   LYS  26          HZ2       LYS  26 -15.267 -13.315   3.136
  212   3HZ   LYS  26          HZ3       LYS  26 -15.614 -14.402   1.877
  213    H    GLU  27           HN       GLU  27  -9.004 -12.397   4.323
  214    HA   GLU  27           HA       GLU  27 -10.570 -10.633   6.048
  215   1HB   GLU  27          HB2       GLU  27  -7.917 -12.029   6.335
  216   2HB   GLU  27          HB1       GLU  27  -8.488 -10.876   7.537
  217   1HG   GLU  27          HG2       GLU  27 -10.151 -13.227   6.620
  218   2HG   GLU  27          HG1       GLU  27  -9.073 -13.305   8.010
  219    H    ILE  28           HN       ILE  28  -7.576 -10.265   4.130
  220    HA   ILE  28           HA       ILE  28  -6.851  -7.717   5.227
  221    HB   ILE  28           HB       ILE  28  -6.336  -8.610   2.381
  222   1HG1  ILE  28          HG12      ILE  28  -5.557  -9.909   4.896
  223   2HG1  ILE  28          HG11      ILE  28  -5.458 -10.517   3.272
  224   1HG2  ILE  28          HG21      ILE  28  -4.268  -7.354   2.617
  225   2HG2  ILE  28          HG22      ILE  28  -4.636  -7.007   4.307
  226   3HG2  ILE  28          HG23      ILE  28  -5.637  -6.328   3.028
  227   1HD1  ILE  28          HD11      ILE  28  -3.333  -9.291   2.945
  228   2HD1  ILE  28          HD12      ILE  28  -3.248 -10.444   4.281
  229   3HD1  ILE  28          HD13      ILE  28  -3.430  -8.723   4.614
  230    H    LEU  29           HN       LEU  29  -8.965  -8.662   2.531
  231    HA   LEU  29           HA       LEU  29  -9.513  -5.925   1.753
  232   1HB   LEU  29          HB2       LEU  29 -11.148  -8.422   1.215
  233   2HB   LEU  29          HB1       LEU  29 -11.197  -6.909   0.306
  234    HG   LEU  29           HG       LEU  29  -8.748  -8.690   0.579
  235   1HD1  LEU  29          HD11      LEU  29  -9.224  -9.032  -1.922
  236   2HD1  LEU  29          HD12      LEU  29 -10.828  -8.373  -1.601
  237   3HD1  LEU  29          HD13      LEU  29 -10.308  -9.857  -0.803
  238   1HD2  LEU  29          HD21      LEU  29  -7.936  -6.514   0.171
  239   2HD2  LEU  29          HD22      LEU  29  -9.323  -6.072  -0.825
  240   3HD2  LEU  29          HD23      LEU  29  -8.094  -7.165  -1.458
  241    H    ASP  30           HN       ASP  30 -10.849  -8.181   4.055
  242    HA   ASP  30           HA       ASP  30 -13.331  -6.751   4.550
  243   1HB   ASP  30          HB2       ASP  30 -12.898  -9.137   5.247
  244   2HB   ASP  30          HB1       ASP  30 -11.783  -8.524   6.469
  245    H    ALA  31           HN       ALA  31 -10.121  -6.727   6.101
  246    HA   ALA  31           HA       ALA  31 -10.803  -4.765   8.083
  247   1HB   ALA  31          HB1       ALA  31  -8.039  -5.253   6.963
  248   2HB   ALA  31          HB2       ALA  31  -8.821  -6.373   8.077
  249   3HB   ALA  31          HB3       ALA  31  -8.474  -4.723   8.589
  250    H    PHE  32           HN       PHE  32  -9.870  -4.461   4.710
  251    HA   PHE  32           HA       PHE  32  -8.872  -1.810   4.632
  252   1HB   PHE  32          HB2       PHE  32 -10.543  -3.482   2.773
  253   2HB   PHE  32          HB1       PHE  32 -10.202  -1.811   2.368
  254    HD1  PHE  32           HD1      PHE  32  -9.106  -2.812   0.335
  255    HD2  PHE  32           HD2      PHE  32  -7.535  -3.485   4.294
  256    HE1  PHE  32           HE1      PHE  32  -6.909  -3.430  -0.623
  257    HE2  PHE  32           HE2      PHE  32  -5.357  -4.072   3.324
  258    HZ   PHE  32           HZ       PHE  32  -5.037  -4.063   0.870
  259    H    ASP  33           HN       ASP  33 -11.865  -2.903   5.802
  260    HA   ASP  33           HA       ASP  33 -13.390  -0.508   5.046
  261   1HB   ASP  33          HB2       ASP  33 -14.490  -2.714   5.252
  262   2HB   ASP  33          HB1       ASP  33 -14.079  -2.748   6.967
  263    H    LYS  34           HN       LYS  34 -11.330  -1.456   7.679
  264    HA   LYS  34           HA       LYS  34 -12.108   1.055   9.114
  265   1HB   LYS  34          HB2       LYS  34 -11.796  -0.065  11.256
  266   2HB   LYS  34          HB1       LYS  34 -13.017  -0.922  10.318
  267   1HG   LYS  34          HG2       LYS  34 -11.244  -2.523   9.568
  268   2HG   LYS  34          HG1       LYS  34 -10.109  -1.712  10.650
  269   1HD   LYS  34          HD2       LYS  34 -11.805  -2.154  12.519
  270   2HD   LYS  34          HD1       LYS  34 -12.607  -3.245  11.389
  271   1HE   LYS  34          HE2       LYS  34 -10.590  -4.583  11.172
  272   2HE   LYS  34          HE1       LYS  34  -9.685  -3.444  12.168
  273   1HZ   LYS  34          HZ1       LYS  34 -12.135  -4.638  13.252
  274   2HZ   LYS  34          HZ2       LYS  34 -10.737  -4.114  14.063
  275   3HZ   LYS  34          HZ3       LYS  34 -10.726  -5.581  13.206
  276    H    MET  35           HN       MET  35  -9.796  -0.162   7.281
  277    HA   MET  35           HA       MET  35  -7.478   0.222   9.034
  278   1HB   MET  35          HB2       MET  35  -7.903  -1.073   6.608
  279   2HB   MET  35          HB1       MET  35  -6.927   0.303   6.128
  280   1HG   MET  35          HG2       MET  35  -5.389  -0.354   8.080
  281   2HG   MET  35          HG1       MET  35  -6.268  -1.880   8.096
  282   1HE   MET  35          HE1       MET  35  -4.605  -3.958   5.618
  283   2HE   MET  35          HE2       MET  35  -6.234  -3.666   6.227
  284   3HE   MET  35          HE3       MET  35  -4.871  -3.672   7.342
  285    H    CYS  36           HN       CYS  36  -9.086   2.156   6.410
  286    HA   CYS  36           HA       CYS  36  -7.120   4.239   6.628
  287   1HB   CYS  36          HB2       CYS  36  -9.057   3.936   4.827
  288   2HB   CYS  36          HB1       CYS  36  -9.980   4.926   5.950
  289    H    SER  37           HN       SER  37  -9.210   2.995   8.820
  290    HA   SER  37           HA       SER  37  -9.982   5.515  10.139
  291   1HB   SER  37          HB2       SER  37 -10.111   2.783  11.407
  292   2HB   SER  37          HB1       SER  37 -11.142   4.180  11.696
  293    HG   SER  37           HG       SER  37 -11.161   3.479   9.089
  294    H    LYS  38           HN       LYS  38  -7.025   4.362   9.810
  295    HA   LYS  38           HA       LYS  38  -6.236   4.866  12.671
  296   1HB   LYS  38          HB2       LYS  38  -5.088   3.004  10.588
  297   2HB   LYS  38          HB1       LYS  38  -4.112   3.560  11.948
  298   1HG   LYS  38          HG2       LYS  38  -5.847   2.710  13.509
  299   2HG   LYS  38          HG1       LYS  38  -6.766   2.103  12.130
  300   1HD   LYS  38          HD2       LYS  38  -4.756   0.736  11.480
  301   2HD   LYS  38          HD1       LYS  38  -3.991   1.239  12.988
  302   1HE   LYS  38          HE2       LYS  38  -6.648  -0.211  12.794
  303   2HE   LYS  38          HE1       LYS  38  -5.110  -0.971  13.205
  304   1HZ   LYS  38          HZ1       LYS  38  -6.766   0.849  14.780
  305   2HZ   LYS  38          HZ2       LYS  38  -5.081   0.973  14.958
  306   3HZ   LYS  38          HZ3       LYS  38  -5.866  -0.500  15.276
  307    H    LEU  39           HN       LEU  39  -6.408   6.431   9.834
  308    HA   LEU  39           HA       LEU  39  -3.773   7.832  10.181
  309   1HB   LEU  39          HB2       LEU  39  -5.582   7.726   7.744
  310   2HB   LEU  39          HB1       LEU  39  -4.028   8.542   7.822
  311    HG   LEU  39           HG       LEU  39  -4.427   5.567   8.219
  312   1HD1  LEU  39          HD11      LEU  39  -3.640   5.264   5.997
  313   2HD1  LEU  39          HD12      LEU  39  -3.153   6.950   5.864
  314   3HD1  LEU  39          HD13      LEU  39  -4.863   6.529   5.885
  315   1HD2  LEU  39          HD21      LEU  39  -2.012   7.382   8.158
  316   2HD2  LEU  39          HD22      LEU  39  -1.868   5.675   7.758
  317   3HD2  LEU  39          HD23      LEU  39  -2.428   6.156   9.355
  318    HA   PRO  40           HA       PRO  40  -6.044  11.350  11.659
  319   1HB   PRO  40          HB2       PRO  40  -4.535  13.164   9.875
  320   2HB   PRO  40          HB1       PRO  40  -4.550  13.104  11.645
  321   1HG   PRO  40          HG2       PRO  40  -2.478  12.142   9.925
  322   2HG   PRO  40          HG1       PRO  40  -2.588  11.921  11.678
  323   1HD   PRO  40          HD2       PRO  40  -2.898   9.913   9.648
  324   2HD   PRO  40          HD1       PRO  40  -3.066   9.701  11.396
  325    H    LYS  41           HN       LYS  41  -7.703  12.943  10.778
  326    HA   LYS  41           HA       LYS  41  -9.091  11.821   8.518
  327   1HB   LYS  41          HB2       LYS  41 -10.130  13.182  10.388
  328   2HB   LYS  41          HB1       LYS  41  -9.430  14.607   9.623
  329   1HG   LYS  41          HG2       LYS  41 -10.724  14.313   7.642
  330   2HG   LYS  41          HG1       LYS  41 -11.197  12.679   8.102
  331   1HD   LYS  41          HD2       LYS  41 -13.056  14.221   8.497
  332   2HD   LYS  41          HD1       LYS  41 -12.451  13.606  10.035
  333   1HE   LYS  41          HE2       LYS  41 -11.391  16.192   8.900
  334   2HE   LYS  41          HE1       LYS  41 -12.896  16.161   9.818
  335   1HZ   LYS  41          HZ1       LYS  41 -11.737  16.072  11.681
  336   2HZ   LYS  41          HZ2       LYS  41 -10.287  16.145  10.799
  337   3HZ   LYS  41          HZ3       LYS  41 -10.977  14.640  11.182
  338    H    SER  42           HN       SER  42  -6.467  14.023   8.616
  339    HA   SER  42           HA       SER  42  -7.194  15.434   6.206
  340   1HB   SER  42          HB2       SER  42  -5.661  16.541   7.684
  341   2HB   SER  42          HB1       SER  42  -4.567  15.161   7.685
  342    HG   SER  42           HG       SER  42  -4.084  17.038   6.248
  343    H    LEU  43           HN       LEU  43  -5.992  12.309   6.565
  344    HA   LEU  43           HA       LEU  43  -5.125  12.306   3.674
  345   1HB   LEU  43          HB2       LEU  43  -4.440  10.179   5.706
  346   2HB   LEU  43          HB1       LEU  43  -3.725  10.430   4.116
  347    HG   LEU  43           HG       LEU  43  -3.443  12.203   6.532
  348   1HD1  LEU  43          HD11      LEU  43  -1.987  10.370   6.778
  349   2HD1  LEU  43          HD12      LEU  43  -0.980  11.645   6.099
  350   3HD1  LEU  43          HD13      LEU  43  -1.585  10.354   5.062
  351   1HD2  LEU  43          HD21      LEU  43  -3.500  13.684   4.653
  352   2HD2  LEU  43          HD22      LEU  43  -2.562  12.567   3.667
  353   3HD2  LEU  43          HD23      LEU  43  -1.793  13.428   4.998
  354    H    SER  44           HN       SER  44  -7.675  11.561   5.664
  355    HA   SER  44           HA       SER  44  -8.594   9.025   5.258
  356   1HB   SER  44          HB2       SER  44 -10.034  10.647   6.310
  357   2HB   SER  44          HB1       SER  44 -10.133  11.603   4.834
  358    HG   SER  44           HG       SER  44 -11.767   9.740   5.568
  359    H    GLU  45           HN       GLU  45  -9.514  11.518   2.946
  360    HA   GLU  45           HA       GLU  45 -10.613   9.992   1.004
  361   1HB   GLU  45          HB2       GLU  45  -9.093  12.576   0.703
  362   2HB   GLU  45          HB1       GLU  45 -10.262  11.939  -0.457
  363   1HG   GLU  45          HG2       GLU  45 -10.924  12.483   2.451
  364   2HG   GLU  45          HG1       GLU  45 -11.230  13.629   1.147
  365    H    GLU  46           HN       GLU  46  -7.278  11.208   0.727
  366    HA   GLU  46           HA       GLU  46  -6.760  10.057  -1.800
  367   1HB   GLU  46          HB2       GLU  46  -4.699  10.286   0.392
  368   2HB   GLU  46          HB1       GLU  46  -4.464  10.444  -1.343
  369   1HG   GLU  46          HG2       GLU  46  -4.508  12.696  -0.805
  370   2HG   GLU  46          HG1       GLU  46  -6.236  12.448  -1.031
  371    H    CYS  47           HN       CYS  47  -7.042   8.552   1.324
  372    HA   CYS  47           HA       CYS  47  -5.594   6.146   0.490
  373   1HB   CYS  47          HB2       CYS  47  -5.916   5.422   2.680
  374   2HB   CYS  47          HB1       CYS  47  -6.185   7.145   2.942
  375    H    GLN  48           HN       GLN  48  -8.977   7.145   0.870
  376    HA   GLN  48           HA       GLN  48 -10.220   4.713   0.200
  377   1HB   GLN  48          HB2       GLN  48 -11.366   6.874   0.897
  378   2HB   GLN  48          HB1       GLN  48 -11.168   7.424  -0.767
  379   1HG   GLN  48          HG2       GLN  48 -13.361   6.453  -0.620
  380   2HG   GLN  48          HG1       GLN  48 -12.353   5.300  -1.495
  381   1HE2  GLN  48          HE21      GLN  48 -13.266   6.027   1.928
  382   2HE2  GLN  48          HE22      GLN  48 -13.385   4.399   2.391
  383    H    GLU  49           HN       GLU  49  -8.991   7.264  -1.973
  384    HA   GLU  49           HA       GLU  49  -9.785   5.932  -4.382
  385   1HB   GLU  49          HB2       GLU  49  -7.667   8.024  -3.830
  386   2HB   GLU  49          HB1       GLU  49  -8.102   7.478  -5.450
  387   1HG   GLU  49          HG2       GLU  49 -10.129   8.560  -3.479
  388   2HG   GLU  49          HG1       GLU  49  -9.301   9.575  -4.662
  389    H    VAL  50           HN       VAL  50  -6.757   5.899  -2.496
  390    HA   VAL  50           HA       VAL  50  -5.325   4.287  -4.393
  391    HB   VAL  50           HB       VAL  50  -4.858   4.526  -1.413
  392   1HG1  VAL  50          HG11      VAL  50  -3.747   2.575  -2.265
  393   2HG1  VAL  50          HG12      VAL  50  -2.532   3.835  -2.062
  394   3HG1  VAL  50          HG13      VAL  50  -3.154   3.465  -3.668
  395   1HG2  VAL  50          HG21      VAL  50  -3.189   5.922  -3.489
  396   2HG2  VAL  50          HG22      VAL  50  -3.538   6.406  -1.830
  397   3HG2  VAL  50          HG23      VAL  50  -4.752   6.622  -3.087
  398    H    VAL  51           HN       VAL  51  -6.923   3.472  -1.281
  399    HA   VAL  51           HA       VAL  51  -6.500   0.696  -1.560
  400    HB   VAL  51           HB       VAL  51  -8.735   2.117  -0.057
  401   1HG1  VAL  51          HG11      VAL  51  -8.584   0.106   1.432
  402   2HG1  VAL  51          HG12      VAL  51  -7.513  -0.631   0.241
  403   3HG1  VAL  51          HG13      VAL  51  -9.182  -0.250  -0.188
  404   1HG2  VAL  51          HG21      VAL  51  -7.237   2.179   1.841
  405   2HG2  VAL  51          HG22      VAL  51  -6.387   2.886   0.468
  406   3HG2  VAL  51          HG23      VAL  51  -6.027   1.236   0.971
  407    H    ASP  52           HN       ASP  52  -9.419   2.558  -2.336
  408    HA   ASP  52           HA       ASP  52 -10.924   0.371  -3.325
  409   1HB   ASP  52          HB2       ASP  52 -11.120   3.290  -4.101
  410   2HB   ASP  52          HB1       ASP  52 -12.367   2.066  -4.335
  411    H    THR  53           HN       THR  53  -8.837   2.665  -5.096
  412    HA   THR  53           HA       THR  53  -9.416   1.329  -7.655
  413    HB   THR  53           HB       THR  53  -7.363   3.465  -7.078
  414    HG1  THR  53           HG1      THR  53  -9.028   4.899  -7.673
  415   1HG2  THR  53          HG21      THR  53  -7.205   2.273  -9.252
  416   2HG2  THR  53          HG22      THR  53  -7.650   3.968  -9.456
  417   3HG2  THR  53          HG23      THR  53  -8.880   2.710  -9.590
  418    H    TYR  54           HN       TYR  54  -6.651   1.564  -5.412
  419    HA   TYR  54           HA       TYR  54  -5.277  -0.490  -7.114
  420   1HB   TYR  54          HB2       TYR  54  -4.175   1.516  -5.160
  421   2HB   TYR  54          HB1       TYR  54  -3.213   0.276  -5.957
  422    HD1  TYR  54           HD1      TYR  54  -2.763   0.382  -8.370
  423    HD2  TYR  54           HD2      TYR  54  -5.134   3.364  -6.418
  424    HE1  TYR  54           HE1      TYR  54  -2.564   1.848 -10.361
  425    HE2  TYR  54           HE2      TYR  54  -4.942   4.836  -8.385
  426    HH   TYR  54           HH       TYR  54  -4.403   4.113 -11.165
  427    H    GLY  55           HN       GLY  55  -7.308  -1.150  -5.087
  428   1HA   GLY  55          HA2       GLY  55  -5.856  -2.193  -2.786
  429   2HA   GLY  55          HA1       GLY  55  -7.566  -2.431  -3.121
  430    H    SER  56           HN       SER  56  -7.714  -3.842  -5.423
  431    HA   SER  56           HA       SER  56  -6.793  -6.404  -4.590
  432   1HB   SER  56          HB2       SER  56  -7.479  -5.840  -7.466
  433   2HB   SER  56          HB1       SER  56  -7.817  -7.277  -6.500
  434    HG   SER  56           HG       SER  56  -8.928  -5.102  -5.369
  435    H    SER  57           HN       SER  57  -5.450  -3.934  -6.636
  436    HA   SER  57           HA       SER  57  -3.543  -5.715  -7.865
  437   1HB   SER  57          HB2       SER  57  -2.504  -3.639  -8.792
  438   2HB   SER  57          HB1       SER  57  -4.244  -3.688  -9.064
  439    HG   SER  57           HG       SER  57  -2.799  -2.249  -7.093
  440    H    ILE  58           HN       ILE  58  -3.227  -3.287  -5.263
  441    HA   ILE  58           HA       ILE  58  -0.431  -3.681  -4.775
  442    HB   ILE  58           HB       ILE  58  -2.735  -2.924  -2.954
  443   1HG1  ILE  58          HG12      ILE  58  -0.363  -1.348  -4.016
  444   2HG1  ILE  58          HG11      ILE  58  -1.981  -1.287  -4.698
  445   1HG2  ILE  58          HG21      ILE  58  -1.213  -3.940  -1.449
  446   2HG2  ILE  58          HG22      ILE  58  -0.772  -2.238  -1.375
  447   3HG2  ILE  58          HG23      ILE  58   0.194  -3.359  -2.333
  448   1HD1  ILE  58          HD11      ILE  58  -2.642  -0.707  -2.168
  449   2HD1  ILE  58          HD12      ILE  58  -2.084   0.550  -3.270
  450   3HD1  ILE  58          HD13      ILE  58  -0.961  -0.170  -2.114
  451    H    LEU  59           HN       LEU  59  -3.237  -5.081  -3.217
  452    HA   LEU  59           HA       LEU  59  -1.921  -7.019  -1.626
  453   1HB   LEU  59          HB2       LEU  59  -4.229  -6.390  -1.229
  454   2HB   LEU  59          HB1       LEU  59  -4.706  -6.955  -2.826
  455    HG   LEU  59           HG       LEU  59  -4.219  -9.256  -2.222
  456   1HD1  LEU  59          HD11      LEU  59  -3.635  -9.649   0.293
  457   2HD1  LEU  59          HD12      LEU  59  -3.101  -7.969   0.277
  458   3HD1  LEU  59          HD13      LEU  59  -2.336  -9.149  -0.784
  459   1HD2  LEU  59          HD21      LEU  59  -5.963  -7.646  -0.359
  460   2HD2  LEU  59          HD22      LEU  59  -5.764  -9.370  -0.075
  461   3HD2  LEU  59          HD23      LEU  59  -6.428  -8.804  -1.604
  462    H    SER  60           HN       SER  60  -2.673  -7.042  -5.078
  463    HA   SER  60           HA       SER  60  -2.447  -9.918  -5.198
  464   1HB   SER  60          HB2       SER  60  -2.603  -7.751  -7.276
  465   2HB   SER  60          HB1       SER  60  -2.296  -9.417  -7.757
  466    HG   SER  60           HG       SER  60  -4.233 -10.014  -6.855
  467    H    ILE  61           HN       ILE  61  -0.318  -7.165  -5.796
  468    HA   ILE  61           HA       ILE  61   1.878  -8.607  -6.991
  469    HB   ILE  61           HB       ILE  61   2.104  -6.070  -5.362
  470   1HG1  ILE  61          HG12      ILE  61   0.452  -6.506  -7.740
  471   2HG1  ILE  61          HG11      ILE  61   0.639  -5.051  -6.773
  472   1HG2  ILE  61          HG21      ILE  61   3.600  -7.055  -7.806
  473   2HG2  ILE  61          HG22      ILE  61   4.163  -7.191  -6.143
  474   3HG2  ILE  61          HG23      ILE  61   3.956  -5.601  -6.869
  475   1HD1  ILE  61          HD11      ILE  61   2.459  -5.899  -9.043
  476   2HD1  ILE  61          HD12      ILE  61   2.660  -4.453  -8.050
  477   3HD1  ILE  61          HD13      ILE  61   1.251  -4.618  -9.094
  478    H    LEU  62           HN       LEU  62   1.248  -7.510  -3.656
  479    HA   LEU  62           HA       LEU  62   3.594  -8.226  -2.398
  480   1HB   LEU  62          HB2       LEU  62   0.720  -8.411  -1.514
  481   2HB   LEU  62          HB1       LEU  62   2.023  -8.863  -0.417
  482    HG   LEU  62           HG       LEU  62   2.368  -6.244  -1.831
  483   1HD1  LEU  62          HD11      LEU  62   0.109  -5.850  -1.363
  484   2HD1  LEU  62          HD12      LEU  62   0.909  -5.206   0.069
  485   3HD1  LEU  62          HD13      LEU  62   0.149  -6.797   0.116
  486   1HD2  LEU  62          HD21      LEU  62   3.988  -7.054  -0.160
  487   2HD2  LEU  62          HD22      LEU  62   2.705  -7.166   1.043
  488   3HD2  LEU  62          HD23      LEU  62   3.185  -5.593   0.415
  489    H    LEU  63           HN       LEU  63   1.012 -10.410  -3.472
  490    HA   LEU  63           HA       LEU  63   2.165 -12.741  -2.146
  491   1HB   LEU  63          HB2       LEU  63   0.149 -12.737  -4.399
  492   2HB   LEU  63          HB1       LEU  63   0.401 -13.980  -3.174
  493    HG   LEU  63           HG       LEU  63  -0.665 -11.178  -2.725
  494   1HD1  LEU  63          HD11      LEU  63  -1.860 -13.952  -2.552
  495   2HD1  LEU  63          HD12      LEU  63  -2.390 -12.607  -3.563
  496   3HD1  LEU  63          HD13      LEU  63  -2.622 -12.542  -1.815
  497   1HD2  LEU  63          HD21      LEU  63  -0.970 -12.135  -0.331
  498   2HD2  LEU  63          HD22      LEU  63   0.645 -11.608  -0.804
  499   3HD2  LEU  63          HD23      LEU  63   0.243 -13.326  -0.805
  500    H    GLU  64           HN       GLU  64   2.926 -11.088  -5.050
  501    HA   GLU  64           HA       GLU  64   4.010 -13.522  -6.313
  502   1HB   GLU  64          HB2       GLU  64   3.857 -10.615  -7.117
  503   2HB   GLU  64          HB1       GLU  64   4.933 -11.719  -7.973
  504   1HG   GLU  64          HG2       GLU  64   1.985 -12.261  -7.565
  505   2HG   GLU  64          HG1       GLU  64   2.637 -11.480  -9.003
  506    H    GLU  65           HN       GLU  65   4.948 -12.660  -3.724
  507    HA   GLU  65           HA       GLU  65   7.005 -12.459  -2.537
  508   1HB   GLU  65          HB2       GLU  65   7.826 -13.792  -5.109
  509   2HB   GLU  65          HB1       GLU  65   8.875 -13.632  -3.701
  510   1HG   GLU  65          HG2       GLU  65   7.291 -14.875  -2.326
  511   2HG   GLU  65          HG1       GLU  65   6.147 -14.954  -3.667
  512    H    VAL  66           HN       VAL  66   6.286 -10.128  -4.333
  513    HA   VAL  66           HA       VAL  66   8.930  -9.169  -5.286
  514    HB   VAL  66           HB       VAL  66   6.066  -8.356  -5.598
  515   1HG1  VAL  66          HG11      VAL  66   6.881  -6.159  -6.617
  516   2HG1  VAL  66          HG12      VAL  66   8.395  -6.439  -5.756
  517   3HG1  VAL  66          HG13      VAL  66   6.892  -6.241  -4.855
  518   1HG2  VAL  66          HG21      VAL  66   8.320  -8.178  -7.599
  519   2HG2  VAL  66          HG22      VAL  66   6.593  -8.354  -7.908
  520   3HG2  VAL  66          HG23      VAL  66   7.515  -9.706  -7.249
  521    H    SER  67           HN       SER  67   9.999  -7.383  -4.260
  522    HA   SER  67           HA       SER  67   9.784  -7.158  -1.473
  523   1HB   SER  67          HB2       SER  67  10.757  -4.806  -3.072
  524   2HB   SER  67          HB1       SER  67  11.414  -5.488  -1.587
  525    HG   SER  67           HG       SER  67  11.375  -6.849  -4.077
  526    HA   PRO  68           HA       PRO  68   6.146  -4.680  -0.904
  527   1HB   PRO  68          HB2       PRO  68   7.115  -3.234   1.397
  528   2HB   PRO  68          HB1       PRO  68   6.075  -4.657   1.382
  529   1HG   PRO  68          HG2       PRO  68   8.890  -4.497   2.107
  530   2HG   PRO  68          HG1       PRO  68   7.791  -5.880   2.249
  531   1HD   PRO  68          HD2       PRO  68   9.914  -5.563   0.345
  532   2HD   PRO  68          HD1       PRO  68   8.700  -6.860   0.409
  533    H    GLU  69           HN       GLU  69   9.285  -2.977  -0.739
  534    HA   GLU  69           HA       GLU  69   8.080  -0.364  -1.183
  535   1HB   GLU  69          HB2       GLU  69  10.159  -0.418  -0.011
  536   2HB   GLU  69          HB1       GLU  69  10.922  -1.396  -1.261
  537   1HG   GLU  69          HG2       GLU  69  11.550   1.062  -1.290
  538   2HG   GLU  69          HG1       GLU  69  10.922   0.440  -2.814
  539    H    LEU  70           HN       LEU  70   9.083  -2.945  -3.232
  540    HA   LEU  70           HA       LEU  70   9.504  -1.289  -5.572
  541   1HB   LEU  70          HB2       LEU  70   9.043  -4.257  -5.206
  542   2HB   LEU  70          HB1       LEU  70   9.172  -3.554  -6.804
  543    HG   LEU  70           HG       LEU  70  11.254  -3.169  -4.678
  544   1HD1  LEU  70          HD11      LEU  70  12.538  -4.962  -5.654
  545   2HD1  LEU  70          HD12      LEU  70  11.366  -5.152  -6.956
  546   3HD1  LEU  70          HD13      LEU  70  10.931  -5.598  -5.308
  547   1HD2  LEU  70          HD21      LEU  70  12.651  -2.843  -6.892
  548   2HD2  LEU  70          HD22      LEU  70  11.673  -1.519  -6.275
  549   3HD2  LEU  70          HD23      LEU  70  11.075  -2.511  -7.599
  550    H    VAL  71           HN       VAL  71   6.801  -2.312  -3.830
  551    HA   VAL  71           HA       VAL  71   4.881  -2.448  -5.945
  552    HB   VAL  71           HB       VAL  71   4.694  -2.022  -2.964
  553   1HG1  VAL  71          HG11      VAL  71   2.445  -1.633  -4.934
  554   2HG1  VAL  71          HG12      VAL  71   2.869  -0.630  -3.546
  555   3HG1  VAL  71          HG13      VAL  71   2.130  -2.205  -3.295
  556   1HG2  VAL  71          HG21      VAL  71   3.387  -4.142  -3.126
  557   2HG2  VAL  71          HG22      VAL  71   5.022  -4.291  -3.768
  558   3HG2  VAL  71          HG23      VAL  71   3.655  -4.132  -4.869
  559    H    CYS  72           HN       CYS  72   5.489   0.352  -3.719
  560    HA   CYS  72           HA       CYS  72   3.672   1.955  -5.191
  561   1HB   CYS  72          HB2       CYS  72   6.074   3.015  -3.646
  562   2HB   CYS  72          HB1       CYS  72   4.550   3.839  -3.933
  563    H    SER  73           HN       SER  73   7.026   1.117  -5.743
  564    HA   SER  73           HA       SER  73   7.486   3.229  -7.738
  565   1HB   SER  73          HB2       SER  73   9.260   1.895  -6.362
  566   2HB   SER  73          HB1       SER  73   9.085   0.687  -7.632
  567    HG   SER  73           HG       SER  73  10.186   1.936  -8.903
  568    H    MET  74           HN       MET  74   6.530  -0.209  -7.981
  569    HA   MET  74           HA       MET  74   6.620  -0.216 -10.907
  570   1HB   MET  74          HB2       MET  74   5.774  -2.093  -8.766
  571   2HB   MET  74          HB1       MET  74   4.905  -2.265 -10.288
  572   1HG   MET  74          HG2       MET  74   7.268  -2.289 -11.384
  573   2HG   MET  74          HG1       MET  74   7.851  -2.609  -9.756
  574   1HE   MET  74          HE1       MET  74   6.341  -4.273  -8.230
  575   2HE   MET  74          HE2       MET  74   5.588  -5.738  -8.847
  576   3HE   MET  74          HE3       MET  74   4.766  -4.192  -9.030
  577    H    LEU  75           HN       LEU  75   3.964   0.305  -8.558
  578    HA   LEU  75           HA       LEU  75   1.977   0.455 -10.663
  579   1HB   LEU  75          HB2       LEU  75   1.809   1.626  -7.871
  580   2HB   LEU  75          HB1       LEU  75   0.459   1.256  -8.939
  581    HG   LEU  75           HG       LEU  75   2.360  -0.718  -7.653
  582   1HD1  LEU  75          HD11      LEU  75   0.188  -1.620  -6.742
  583   2HD1  LEU  75          HD12      LEU  75  -0.594  -0.177  -7.382
  584   3HD1  LEU  75          HD13      LEU  75   0.643  -0.029  -6.134
  585   1HD2  LEU  75          HD21      LEU  75   2.003  -1.698  -9.760
  586   2HD2  LEU  75          HD22      LEU  75   0.367  -1.048  -9.888
  587   3HD2  LEU  75          HD23      LEU  75   0.701  -2.388  -8.794
  588    H    HIS  76           HN       HIS  76   4.472   2.324 -10.602
  589    HA   HIS  76           HA       HIS  76   4.943   4.570 -11.115
  590   1HB   HIS  76          HB2       HIS  76   2.303   4.208 -12.576
  591   2HB   HIS  76          HB1       HIS  76   3.423   5.545 -12.843
  592    HD1  HIS  76           HD1      HIS  76   3.095   4.013 -15.297
  593    HD2  HIS  76           HD2      HIS  76   5.730   2.693 -12.348
  594    HE1  HIS  76           HE1      HIS  76   4.727   2.451 -16.442
  595    H    LEU  77           HN       LEU  77   3.121   3.944  -8.687
  596    HA   LEU  77           HA       LEU  77   1.482   6.370  -8.509
  597   1HB   LEU  77          HB2       LEU  77   1.527   3.824  -7.238
  598   2HB   LEU  77          HB1       LEU  77   1.879   4.980  -5.972
  599    HG   LEU  77           HG       LEU  77  -0.154   6.138  -6.348
  600   1HD1  LEU  77          HD11      LEU  77  -0.830   6.322  -8.522
  601   2HD1  LEU  77          HD12      LEU  77  -1.741   4.854  -8.191
  602   3HD1  LEU  77          HD13      LEU  77  -0.160   4.755  -8.960
  603   1HD2  LEU  77          HD21      LEU  77  -1.708   4.523  -5.626
  604   2HD2  LEU  77          HD22      LEU  77  -0.148   3.855  -5.158
  605   3HD2  LEU  77          HD23      LEU  77  -0.969   3.262  -6.597
  606    H    CYS  78           HN       CYS  78   4.712   5.504  -7.982
  607    HA   CYS  78           HA       CYS  78   5.195   8.076  -6.508
  608   1HB   CYS  78          HB2       CYS  78   6.394   5.343  -6.044
  609   2HB   CYS  78          HB1       CYS  78   7.254   6.803  -5.567
  610    H    SER  79           HN       SER  79   5.501   8.867  -8.782
  611    HA   SER  79           HA       SER  79   7.208   7.713 -10.618
  612   1HB   SER  79          HB2       SER  79   5.938   9.585 -11.373
  613   2HB   SER  79          HB1       SER  79   6.576  10.630 -10.105
  614    HG   SER  79           HG       SER  79   7.869  11.188 -11.699
  615    H    GLY  80           HN       GLY  80   9.441   8.866 -11.363
  616   1HA   GLY  80          HA2       GLY  80  11.192   8.962  -8.922
  617   2HA   GLY  80          HA1       GLY  80  11.700   8.296 -10.474
  618    H    LEU  81           HN       LEU  81  13.488   9.936 -10.218
  619    HA   LEU  81           HA       LEU  81  12.790  12.754 -10.440
  620   1HB   LEU  81          HB2       LEU  81  15.014  11.535  -9.567
  621   2HB   LEU  81          HB1       LEU  81  15.509  11.740 -11.243
  622    HG   LEU  81           HG       LEU  81  14.501  13.989  -9.466
  623   1HD1  LEU  81          HD11      LEU  81  16.857  14.698  -9.381
  624   2HD1  LEU  81          HD12      LEU  81  17.325  13.274 -10.310
  625   3HD1  LEU  81          HD13      LEU  81  16.665  13.089  -8.685
  626   1HD2  LEU  81          HD21      LEU  81  15.535  15.387 -11.296
  627   2HD2  LEU  81          HD22      LEU  81  14.126  14.464 -11.815
  628   3HD2  LEU  81          HD23      LEU  81  15.748  13.909 -12.232
  629    H    VAL  82           HN       VAL  82  11.325  11.658 -12.347
  630    HA   VAL  82           HA       VAL  82  11.924  10.961 -14.855
  631    HB   VAL  82           HB       VAL  82  10.269  12.844 -15.637
  632   1HG1  VAL  82          HG11      VAL  82   9.537  10.790 -13.525
  633   2HG1  VAL  82          HG12      VAL  82   9.600  10.516 -15.266
  634   3HG1  VAL  82          HG13      VAL  82   8.386  11.600 -14.588
  635   1HG2  VAL  82          HG21      VAL  82  10.832  14.201 -13.524
  636   2HG2  VAL  82          HG22      VAL  82   9.872  13.018 -12.640
  637   3HG2  VAL  82          HG23      VAL  82   9.120  14.003 -13.895
  638    HA   PRO  83           HA       PRO  83  15.129  14.165 -15.657
  639   1HB   PRO  83          HB2       PRO  83  16.410  12.481 -17.593
  640   2HB   PRO  83          HB1       PRO  83  16.947  12.795 -15.937
  641   1HG   PRO  83          HG2       PRO  83  15.831  10.338 -16.994
  642   2HG   PRO  83          HG1       PRO  83  16.399  10.651 -15.348
  643   1HD   PRO  83          HD2       PRO  83  13.648  10.457 -16.302
  644   2HD   PRO  83          HD1       PRO  83  14.220  10.621 -14.631
  645    H    ARG  84           HN       ARG  84  12.667  12.746 -17.417
  646    HA   ARG  84           HA       ARG  84  12.547  14.934 -19.308
  647   1HB   ARG  84          HB2       ARG  84  14.316  13.510 -20.352
  648   2HB   ARG  84          HB1       ARG  84  13.166  12.179 -20.427
  649   1HG   ARG  84          HG2       ARG  84  12.197  14.742 -21.616
  650   2HG   ARG  84          HG1       ARG  84  13.544  13.991 -22.464
  651   1HD   ARG  84          HD2       ARG  84  10.969  12.557 -21.743
  652   2HD   ARG  84          HD1       ARG  84  11.328  13.241 -23.326
  653    HE   ARG  84           HE       ARG  84  13.484  11.577 -22.823
  654   1HH1  ARG  84          HH21      ARG  84  10.048  11.291 -22.814
  655   2HH1  ARG  84          HH22      ARG  84  10.053   9.623 -23.283
  656   1HH2  ARG  84          HH11      ARG  84  13.511   9.402 -23.435
  657   2HH2  ARG  84          HH12      ARG  84  12.014   8.554 -23.634
  Start of MODEL    2
    1   1H    SER   1          HT1       SER   1   5.268  18.268  -2.140
    2   2H    SER   1          HT2       SER   1   6.061  16.771  -2.011
    3   3H    SER   1          HT3       SER   1   6.558  18.083  -1.054
    4    HA   SER   1           HA       SER   1   5.334  16.852   0.443
    5   1HB   SER   1          HB2       SER   1   4.512  19.132   0.461
    6   2HB   SER   1          HB1       SER   1   3.466  18.814  -0.921
    7    HG   SER   1           HG       SER   1   2.803  16.997   0.768
    8    H    ASP   2           HN       ASP   2   5.420  15.313  -1.967
    9    HA   ASP   2           HA       ASP   2   2.885  14.480  -2.929
   10   1HB   ASP   2          HB2       ASP   2   5.374  12.781  -2.716
   11   2HB   ASP   2          HB1       ASP   2   4.073  12.624  -3.896
   12    H    VAL   3           HN       VAL   3   1.376  14.022  -1.427
   13    HA   VAL   3           HA       VAL   3   1.816  12.405   0.946
   14    HB   VAL   3           HB       VAL   3  -0.433  12.804   1.427
   15   1HG1  VAL   3          HG11      VAL   3   0.978  14.855   1.294
   16   2HG1  VAL   3          HG12      VAL   3  -0.733  15.177   1.006
   17   3HG1  VAL   3          HG13      VAL   3   0.393  15.113  -0.350
   18   1HG2  VAL   3          HG21      VAL   3  -2.028  13.670  -0.378
   19   2HG2  VAL   3          HG22      VAL   3  -1.591  11.964  -0.492
   20   3HG2  VAL   3          HG23      VAL   3  -0.827  13.146  -1.559
   21    H    TYR   4           HN       TYR   4   1.172  11.548  -2.414
   22    HA   TYR   4           HA       TYR   4  -0.404   9.255  -1.717
   23   1HB   TYR   4          HB2       TYR   4   1.042  10.107  -4.238
   24   2HB   TYR   4          HB1       TYR   4   0.360   8.488  -4.147
   25    HD1  TYR   4           HD1      TYR   4  -2.096   8.218  -3.655
   26    HD2  TYR   4           HD2      TYR   4  -0.343  12.001  -4.645
   27    HE1  TYR   4           HE1      TYR   4  -4.325   9.073  -4.279
   28    HE2  TYR   4           HE2      TYR   4  -2.583  12.877  -5.250
   29    HH   TYR   4           HH       TYR   4  -5.229  11.931  -4.358
   30    H    CYS   5           HN       CYS   5   3.040   9.641  -2.391
   31    HA   CYS   5           HA       CYS   5   3.761   6.888  -2.204
   32   1HB   CYS   5          HB2       CYS   5   5.275   9.425  -1.497
   33   2HB   CYS   5          HB1       CYS   5   6.006   7.821  -1.430
   34    H    GLU   6           HN       GLU   6   3.392   9.345   0.355
   35    HA   GLU   6           HA       GLU   6   4.275   7.717   2.507
   36   1HB   GLU   6          HB2       GLU   6   3.809  10.191   2.592
   37   2HB   GLU   6          HB1       GLU   6   2.092   9.807   2.650
   38   1HG   GLU   6          HG2       GLU   6   2.831  10.095   4.924
   39   2HG   GLU   6          HG1       GLU   6   2.576   8.368   4.676
   40    H    VAL   7           HN       VAL   7   0.982   8.087   1.144
   41    HA   VAL   7           HA       VAL   7  -0.181   6.243   3.071
   42    HB   VAL   7           HB       VAL   7  -1.214   7.186   0.366
   43   1HG1  VAL   7          HG11      VAL   7  -2.412   5.213   0.848
   44   2HG1  VAL   7          HG12      VAL   7  -3.446   6.496   1.475
   45   3HG1  VAL   7          HG13      VAL   7  -2.448   5.549   2.578
   46   1HG2  VAL   7          HG21      VAL   7  -2.769   8.514   2.041
   47   2HG2  VAL   7          HG22      VAL   7  -1.159   9.130   1.680
   48   3HG2  VAL   7          HG23      VAL   7  -1.449   8.251   3.182
   49    H    CYS   8           HN       CYS   8   1.030   5.753  -0.272
   50    HA   CYS   8           HA       CYS   8   0.129   3.078  -0.549
   51   1HB   CYS   8          HB2       CYS   8   1.583   2.971  -2.375
   52   2HB   CYS   8          HB1       CYS   8   1.309   4.703  -2.231
   53    H    GLU   9           HN       GLU   9   3.193   4.340   0.785
   54    HA   GLU   9           HA       GLU   9   4.213   1.752   1.443
   55   1HB   GLU   9          HB2       GLU   9   4.834   4.495   2.582
   56   2HB   GLU   9          HB1       GLU   9   5.748   3.037   2.973
   57   1HG   GLU   9          HG2       GLU   9   6.096   2.744   0.459
   58   2HG   GLU   9          HG1       GLU   9   5.471   4.382   0.278
   59    H    PHE  10           HN       PHE  10   1.971   3.962   3.119
   60    HA   PHE  10           HA       PHE  10   2.265   2.664   5.655
   61   1HB   PHE  10          HB2       PHE  10   1.224   4.885   5.495
   62   2HB   PHE  10          HB1       PHE  10  -0.102   4.202   4.548
   63    HD1  PHE  10           HD1      PHE  10  -1.827   2.873   5.567
   64    HD2  PHE  10           HD2      PHE  10   1.517   4.256   7.872
   65    HE1  PHE  10           HE1      PHE  10  -2.973   2.161   7.657
   66    HE2  PHE  10           HE2      PHE  10   0.377   3.557   9.960
   67    HZ   PHE  10           HZ       PHE  10  -1.867   2.508   9.850
   68    H    LEU  11           HN       LEU  11  -0.110   2.222   2.994
   69    HA   LEU  11           HA       LEU  11  -1.530   0.068   4.274
   70   1HB   LEU  11          HB2       LEU  11  -1.140   0.585   1.308
   71   2HB   LEU  11          HB1       LEU  11  -2.297  -0.556   2.001
   72    HG   LEU  11           HG       LEU  11  -2.296   2.369   2.795
   73   1HD1  LEU  11          HD11      LEU  11  -2.550   2.433   0.404
   74   2HD1  LEU  11          HD12      LEU  11  -4.164   2.609   1.094
   75   3HD1  LEU  11          HD13      LEU  11  -3.655   1.058   0.425
   76   1HD2  LEU  11          HD21      LEU  11  -4.767   1.785   3.133
   77   2HD2  LEU  11          HD22      LEU  11  -3.643   1.011   4.247
   78   3HD2  LEU  11          HD23      LEU  11  -4.312   0.100   2.893
   79    H    VAL  12           HN       VAL  12   1.278   0.046   2.003
   80    HA   VAL  12           HA       VAL  12   1.514  -2.766   1.846
   81    HB   VAL  12           HB       VAL  12   3.457  -0.459   1.617
   82   1HG1  VAL  12          HG11      VAL  12   4.883  -2.205   2.443
   83   2HG1  VAL  12          HG12      VAL  12   5.087  -2.169   0.696
   84   3HG1  VAL  12          HG13      VAL  12   4.080  -3.415   1.440
   85   1HG2  VAL  12          HG21      VAL  12   3.406  -1.015  -0.726
   86   2HG2  VAL  12          HG22      VAL  12   1.735  -0.999  -0.164
   87   3HG2  VAL  12          HG23      VAL  12   2.570  -2.534  -0.406
   88    H    LYS  13           HN       LYS  13   3.059  -0.470   4.154
   89    HA   LYS  13           HA       LYS  13   4.474  -2.415   5.666
   90   1HB   LYS  13          HB2       LYS  13   5.012  -0.129   6.055
   91   2HB   LYS  13          HB1       LYS  13   3.333   0.295   6.380
   92   1HG   LYS  13          HG2       LYS  13   3.360  -0.653   8.524
   93   2HG   LYS  13          HG1       LYS  13   4.713  -1.720   8.145
   94   1HD   LYS  13          HD2       LYS  13   5.344   0.181   9.652
   95   2HD   LYS  13          HD1       LYS  13   6.261   0.154   8.145
   96   1HE   LYS  13          HE2       LYS  13   5.347   2.431   8.841
   97   2HE   LYS  13          HE1       LYS  13   4.944   1.914   7.204
   98   1HZ   LYS  13          HZ1       LYS  13   2.793   1.247   7.908
   99   2HZ   LYS  13          HZ2       LYS  13   3.045   2.818   8.504
  100   3HZ   LYS  13          HZ3       LYS  13   3.175   1.480   9.544
  101    H    GLU  14           HN       GLU  14   1.190  -1.143   6.042
  102    HA   GLU  14           HA       GLU  14   0.599  -2.710   8.398
  103   1HB   GLU  14          HB2       GLU  14  -0.611  -0.588   7.142
  104   2HB   GLU  14          HB1       GLU  14  -1.692  -1.896   6.676
  105   1HG   GLU  14          HG2       GLU  14  -0.849  -1.246   9.521
  106   2HG   GLU  14          HG1       GLU  14  -2.403  -0.834   8.800
  107    H    VAL  15           HN       VAL  15   0.121  -3.232   4.911
  108    HA   VAL  15           HA       VAL  15  -1.454  -5.609   5.289
  109    HB   VAL  15           HB       VAL  15   0.077  -4.449   2.955
  110   1HG1  VAL  15          HG11      VAL  15   0.459  -6.813   2.651
  111   2HG1  VAL  15          HG12      VAL  15  -0.876  -6.365   1.587
  112   3HG1  VAL  15          HG13      VAL  15  -1.203  -7.193   3.109
  113   1HG2  VAL  15          HG21      VAL  15  -2.157  -3.563   3.525
  114   2HG2  VAL  15          HG22      VAL  15  -2.833  -5.188   3.404
  115   3HG2  VAL  15          HG23      VAL  15  -2.184  -4.393   1.969
  116    H    THR  16           HN       THR  16   2.097  -5.132   4.878
  117    HA   THR  16           HA       THR  16   2.564  -7.933   4.734
  118    HB   THR  16           HB       THR  16   4.806  -7.583   4.903
  119    HG1  THR  16           HG1      THR  16   4.064  -5.599   6.740
  120   1HG2  THR  16          HG21      THR  16   4.550  -4.713   4.375
  121   2HG2  THR  16          HG22      THR  16   3.431  -5.678   3.415
  122   3HG2  THR  16          HG23      THR  16   5.160  -5.986   3.325
  123    H    LYS  17           HN       LYS  17   2.359  -5.789   7.576
  124    HA   LYS  17           HA       LYS  17   3.202  -7.784   9.435
  125   1HB   LYS  17          HB2       LYS  17   2.999  -5.592  10.334
  126   2HB   LYS  17          HB1       LYS  17   1.352  -5.406   9.728
  127   1HG   LYS  17          HG2       LYS  17   0.440  -6.802  11.380
  128   2HG   LYS  17          HG1       LYS  17   1.967  -7.629  11.670
  129   1HD   LYS  17          HD2       LYS  17   2.858  -5.530  12.687
  130   2HD   LYS  17          HD1       LYS  17   1.261  -4.800  12.491
  131   1HE   LYS  17          HE2       LYS  17   0.248  -6.387  13.970
  132   2HE   LYS  17          HE1       LYS  17   1.679  -7.418  13.965
  133   1HZ   LYS  17          HZ1       LYS  17   1.998  -4.646  14.846
  134   2HZ   LYS  17          HZ2       LYS  17   2.783  -6.054  15.382
  135   3HZ   LYS  17          HZ3       LYS  17   1.201  -5.712  15.896
  136    H    LEU  18           HN       LEU  18   0.215  -7.084   7.786
  137    HA   LEU  18           HA       LEU  18  -1.445  -8.960   9.256
  138   1HB   LEU  18          HB2       LEU  18  -1.734  -7.569   6.582
  139   2HB   LEU  18          HB1       LEU  18  -2.951  -8.623   7.217
  140    HG   LEU  18           HG       LEU  18  -2.571  -5.807   7.739
  141   1HD1  LEU  18          HD11      LEU  18  -4.722  -6.942   7.342
  142   2HD1  LEU  18          HD12      LEU  18  -4.742  -5.999   8.836
  143   3HD1  LEU  18          HD13      LEU  18  -4.574  -7.744   8.905
  144   1HD2  LEU  18          HD21      LEU  18  -2.660  -7.392  10.327
  145   2HD2  LEU  18          HD22      LEU  18  -2.630  -5.647  10.130
  146   3HD2  LEU  18          HD23      LEU  18  -1.207  -6.588   9.735
  147    H    ILE  19           HN       ILE  19   0.514  -9.072   6.334
  148    HA   ILE  19           HA       ILE  19  -0.273 -11.768   5.601
  149    HB   ILE  19           HB       ILE  19   2.152 -10.079   4.850
  150   1HG1  ILE  19          HG12      ILE  19  -0.336 -10.813   3.264
  151   2HG1  ILE  19          HG11      ILE  19  -0.119  -9.284   4.091
  152   1HG2  ILE  19          HG21      ILE  19   2.415 -11.730   2.990
  153   2HG2  ILE  19          HG22      ILE  19   1.201 -12.744   3.770
  154   3HG2  ILE  19          HG23      ILE  19   2.731 -12.415   4.581
  155   1HD1  ILE  19          HD11      ILE  19   1.597 -10.371   1.848
  156   2HD1  ILE  19          HD12      ILE  19   1.950  -8.897   2.739
  157   3HD1  ILE  19          HD13      ILE  19   0.493  -9.000   1.756
  158    H    ASP  20           HN       ASP  20   2.150 -10.238   7.609
  159    HA   ASP  20           HA       ASP  20   3.688 -12.661   8.097
  160   1HB   ASP  20          HB2       ASP  20   3.610 -10.089   9.696
  161   2HB   ASP  20          HB1       ASP  20   4.878 -11.317   9.724
  162    H    ASN  21           HN       ASN  21   0.785 -11.259   9.484
  163    HA   ASN  21           HA       ASN  21   1.115 -12.937  11.898
  164   1HB   ASN  21          HB2       ASN  21   0.137 -10.629  12.138
  165   2HB   ASN  21          HB1       ASN  21  -1.234 -11.146  11.153
  166   1HD2  ASN  21          HD21      ASN  21  -2.585 -12.969  12.064
  167   2HD2  ASN  21          HD22      ASN  21  -2.662 -13.169  13.748
  168    H    ASN  22           HN       ASN  22   0.239 -13.574   8.843
  169    HA   ASN  22           HA       ASN  22  -0.564 -15.614   8.012
  170   1HB   ASN  22          HB2       ASN  22  -0.055 -16.353  10.493
  171   2HB   ASN  22          HB1       ASN  22  -1.812 -16.397  10.629
  172   1HD2  ASN  22          HD21      ASN  22   0.819 -18.313   9.822
  173   2HD2  ASN  22          HD22      ASN  22   0.026 -19.459   8.852
  174    H    LYS  23           HN       LYS  23  -2.219 -13.263   7.760
  175    HA   LYS  23           HA       LYS  23  -4.975 -14.247   8.318
  176   1HB   LYS  23          HB2       LYS  23  -4.270 -11.649   7.055
  177   2HB   LYS  23          HB1       LYS  23  -5.737 -12.070   7.922
  178   1HG   LYS  23          HG2       LYS  23  -3.576 -12.495   9.763
  179   2HG   LYS  23          HG1       LYS  23  -3.260 -10.947   8.992
  180   1HD   LYS  23          HD2       LYS  23  -5.390 -10.062   9.707
  181   2HD   LYS  23          HD1       LYS  23  -5.940 -11.661  10.215
  182   1HE   LYS  23          HE2       LYS  23  -4.097 -11.709  11.904
  183   2HE   LYS  23          HE1       LYS  23  -3.702 -10.049  11.459
  184   1HZ   LYS  23          HZ1       LYS  23  -6.336  -9.878  11.874
  185   2HZ   LYS  23          HZ2       LYS  23  -5.163  -9.547  13.058
  186   3HZ   LYS  23          HZ3       LYS  23  -5.921 -11.068  13.009
  187    H    THR  24           HN       THR  24  -6.480 -14.569   6.582
  188    HA   THR  24           HA       THR  24  -5.320 -15.455   4.039
  189    HB   THR  24           HB       THR  24  -7.409 -16.355   3.571
  190    HG1  THR  24           HG1      THR  24  -8.506 -14.390   3.516
  191   1HG2  THR  24          HG21      THR  24  -7.664 -15.931   6.553
  192   2HG2  THR  24          HG22      THR  24  -6.639 -17.159   5.813
  193   3HG2  THR  24          HG23      THR  24  -8.389 -17.221   5.599
  194    H    GLU  25           HN       GLU  25  -6.539 -14.734   1.980
  195    HA   GLU  25           HA       GLU  25  -6.008 -11.922   1.569
  196   1HB   GLU  25          HB2       GLU  25  -6.003 -13.847  -0.173
  197   2HB   GLU  25          HB1       GLU  25  -7.754 -13.646  -0.212
  198   1HG   GLU  25          HG2       GLU  25  -7.282 -11.152  -0.638
  199   2HG   GLU  25          HG1       GLU  25  -5.626 -11.651  -0.985
  200    H    LYS  26           HN       LYS  26  -9.002 -13.830   1.886
  201    HA   LYS  26           HA       LYS  26 -10.864 -11.749   1.529
  202   1HB   LYS  26          HB2       LYS  26 -11.295 -14.266   1.767
  203   2HB   LYS  26          HB1       LYS  26 -11.289 -13.975   3.503
  204   1HG   LYS  26          HG2       LYS  26 -13.068 -12.295   3.248
  205   2HG   LYS  26          HG1       LYS  26 -13.073 -12.549   1.505
  206   1HD   LYS  26          HD2       LYS  26 -13.488 -14.908   3.332
  207   2HD   LYS  26          HD1       LYS  26 -14.828 -13.806   3.033
  208   1HE   LYS  26          HE2       LYS  26 -13.228 -15.141   0.830
  209   2HE   LYS  26          HE1       LYS  26 -14.756 -15.759   1.452
  210   1HZ   LYS  26          HZ1       LYS  26 -14.910 -14.311  -0.570
  211   2HZ   LYS  26          HZ2       LYS  26 -14.441 -13.004   0.410
  212   3HZ   LYS  26          HZ3       LYS  26 -15.885 -13.838   0.735
  213    H    GLU  27           HN       GLU  27  -8.992 -12.525   4.391
  214    HA   GLU  27           HA       GLU  27 -10.550 -10.760   6.120
  215   1HB   GLU  27          HB2       GLU  27  -7.885 -12.137   6.402
  216   2HB   GLU  27          HB1       GLU  27  -8.472 -10.996   7.608
  217   1HG   GLU  27          HG2       GLU  27 -10.094 -13.371   6.676
  218   2HG   GLU  27          HG1       GLU  27  -9.027 -13.427   8.077
  219    H    ILE  28           HN       ILE  28  -7.585 -10.396   4.169
  220    HA   ILE  28           HA       ILE  28  -6.846  -7.847   5.254
  221    HB   ILE  28           HB       ILE  28  -6.381  -8.763   2.404
  222   1HG1  ILE  28          HG12      ILE  28  -5.570 -10.066   4.886
  223   2HG1  ILE  28          HG11      ILE  28  -5.388 -10.624   3.253
  224   1HG2  ILE  28          HG21      ILE  28  -4.690  -7.076   4.263
  225   2HG2  ILE  28          HG22      ILE  28  -5.695  -6.475   2.947
  226   3HG2  ILE  28          HG23      ILE  28  -4.305  -7.489   2.592
  227   1HD1  ILE  28          HD11      ILE  28  -3.228 -10.480   4.373
  228   2HD1  ILE  28          HD12      ILE  28  -3.490  -8.764   4.682
  229   3HD1  ILE  28          HD13      ILE  28  -3.307  -9.341   3.026
  230    H    LEU  29           HN       LEU  29  -8.982  -8.794   2.574
  231    HA   LEU  29           HA       LEU  29  -9.538  -6.077   1.769
  232   1HB   LEU  29          HB2       LEU  29 -11.220  -8.564   1.351
  233   2HB   LEU  29          HB1       LEU  29 -11.290  -7.071   0.411
  234    HG   LEU  29           HG       LEU  29  -8.857  -8.878   0.630
  235   1HD1  LEU  29          HD11      LEU  29 -10.635  -8.434  -1.785
  236   2HD1  LEU  29          HD12      LEU  29 -10.913  -9.754  -0.650
  237   3HD1  LEU  29          HD13      LEU  29  -9.403  -9.673  -1.559
  238   1HD2  LEU  29          HD21      LEU  29  -8.004  -6.738   0.143
  239   2HD2  LEU  29          HD22      LEU  29  -9.436  -6.260  -0.770
  240   3HD2  LEU  29          HD23      LEU  29  -8.278  -7.388  -1.473
  241    H    ASP  30           HN       ASP  30 -10.915  -8.285   4.113
  242    HA   ASP  30           HA       ASP  30 -13.343  -6.780   4.620
  243   1HB   ASP  30          HB2       ASP  30 -12.993  -9.168   5.321
  244   2HB   ASP  30          HB1       ASP  30 -11.835  -8.600   6.525
  245    H    ALA  31           HN       ALA  31 -10.122  -6.823   6.142
  246    HA   ALA  31           HA       ALA  31 -10.748  -4.857   8.135
  247   1HB   ALA  31          HB1       ALA  31  -8.420  -4.858   8.623
  248   2HB   ALA  31          HB2       ALA  31  -7.999  -5.353   6.983
  249   3HB   ALA  31          HB3       ALA  31  -8.777  -6.495   8.077
  250    H    PHE  32           HN       PHE  32  -9.893  -4.551   4.741
  251    HA   PHE  32           HA       PHE  32  -8.846  -1.915   4.663
  252   1HB   PHE  32          HB2       PHE  32 -10.560  -3.541   2.808
  253   2HB   PHE  32          HB1       PHE  32 -10.199  -1.873   2.417
  254    HD1  PHE  32           HD1      PHE  32  -9.142  -2.846   0.362
  255    HD2  PHE  32           HD2      PHE  32  -7.541  -3.620   4.292
  256    HE1  PHE  32           HE1      PHE  32  -6.972  -3.500  -0.632
  257    HE2  PHE  32           HE2      PHE  32  -5.388  -4.237   3.285
  258    HZ   PHE  32           HZ       PHE  32  -5.101  -4.200   0.826
  259    H    ASP  33           HN       ASP  33 -11.924  -3.006   5.702
  260    HA   ASP  33           HA       ASP  33 -13.377  -0.564   5.038
  261   1HB   ASP  33          HB2       ASP  33 -14.102  -2.799   6.951
  262   2HB   ASP  33          HB1       ASP  33 -15.199  -1.565   6.334
  263    H    LYS  34           HN       LYS  34 -11.336  -1.575   7.675
  264    HA   LYS  34           HA       LYS  34 -12.092   0.931   9.138
  265   1HB   LYS  34          HB2       LYS  34 -11.500  -0.336  11.258
  266   2HB   LYS  34          HB1       LYS  34 -13.001  -0.827  10.478
  267   1HG   LYS  34          HG2       LYS  34 -11.950  -2.763   9.505
  268   2HG   LYS  34          HG1       LYS  34 -10.353  -2.218  10.015
  269   1HD   LYS  34          HD2       LYS  34 -11.096  -3.925  11.569
  270   2HD   LYS  34          HD1       LYS  34 -11.125  -2.369  12.398
  271   1HE   LYS  34          HE2       LYS  34 -13.478  -2.221  12.296
  272   2HE   LYS  34          HE1       LYS  34 -13.591  -3.431  11.017
  273   1HZ   LYS  34          HZ1       LYS  34 -12.614  -4.015  13.755
  274   2HZ   LYS  34          HZ2       LYS  34 -12.974  -5.135  12.529
  275   3HZ   LYS  34          HZ3       LYS  34 -14.220  -4.242  13.262
  276    H    MET  35           HN       MET  35  -9.775  -0.256   7.274
  277    HA   MET  35           HA       MET  35  -7.462   0.173   9.038
  278   1HB   MET  35          HB2       MET  35  -7.862  -1.183   6.632
  279   2HB   MET  35          HB1       MET  35  -6.884   0.186   6.138
  280   1HG   MET  35          HG2       MET  35  -5.385  -0.440   8.149
  281   2HG   MET  35          HG1       MET  35  -6.240  -1.980   8.124
  282   1HE   MET  35          HE1       MET  35  -6.212  -3.683   6.339
  283   2HE   MET  35          HE2       MET  35  -4.723  -3.802   7.273
  284   3HE   MET  35          HE3       MET  35  -4.671  -3.993   5.524
  285    H    CYS  36           HN       CYS  36  -9.099   1.986   6.371
  286    HA   CYS  36           HA       CYS  36  -7.205   4.146   6.515
  287   1HB   CYS  36          HB2       CYS  36 -10.008   3.861   5.429
  288   2HB   CYS  36          HB1       CYS  36  -9.323   5.479   5.597
  289    H    SER  37           HN       SER  37  -9.214   2.899   8.778
  290    HA   SER  37           HA       SER  37 -10.034   5.464  10.006
  291   1HB   SER  37          HB2       SER  37 -11.348   3.270  10.149
  292   2HB   SER  37          HB1       SER  37 -10.128   2.735  11.301
  293    HG   SER  37           HG       SER  37 -11.238   5.261  11.676
  294    H    LYS  38           HN       LYS  38  -7.065   4.359   9.681
  295    HA   LYS  38           HA       LYS  38  -6.270   4.933  12.526
  296   1HB   LYS  38          HB2       LYS  38  -5.121   3.007  10.505
  297   2HB   LYS  38          HB1       LYS  38  -4.148   3.605  11.850
  298   1HG   LYS  38          HG2       LYS  38  -5.836   2.787  13.445
  299   2HG   LYS  38          HG1       LYS  38  -6.827   2.204  12.106
  300   1HD   LYS  38          HD2       LYS  38  -4.865   0.776  11.395
  301   2HD   LYS  38          HD1       LYS  38  -4.069   1.234  12.901
  302   1HE   LYS  38          HE2       LYS  38  -6.718  -0.216  12.627
  303   2HE   LYS  38          HE1       LYS  38  -5.206  -0.894  13.231
  304   1HZ   LYS  38          HZ1       LYS  38  -6.667  -0.254  15.041
  305   2HZ   LYS  38          HZ2       LYS  38  -6.720   1.345  14.466
  306   3HZ   LYS  38          HZ3       LYS  38  -5.262   0.695  15.050
  307    H    LEU  39           HN       LEU  39  -6.562   6.642   9.908
  308    HA   LEU  39           HA       LEU  39  -3.873   7.960  10.144
  309   1HB   LEU  39          HB2       LEU  39  -5.646   7.796   7.686
  310   2HB   LEU  39          HB1       LEU  39  -4.102   8.630   7.767
  311    HG   LEU  39           HG       LEU  39  -4.465   5.662   8.237
  312   1HD1  LEU  39          HD11      LEU  39  -3.290   7.066   5.839
  313   2HD1  LEU  39          HD12      LEU  39  -4.947   6.472   5.901
  314   3HD1  LEU  39          HD13      LEU  39  -3.602   5.340   6.019
  315   1HD2  LEU  39          HD21      LEU  39  -2.071   7.501   8.093
  316   2HD2  LEU  39          HD22      LEU  39  -1.915   5.779   7.764
  317   3HD2  LEU  39          HD23      LEU  39  -2.465   6.322   9.344
  318    HA   PRO  40           HA       PRO  40  -6.140  11.505  11.535
  319   1HB   PRO  40          HB2       PRO  40  -4.609  13.296   9.749
  320   2HB   PRO  40          HB1       PRO  40  -4.636  13.249  11.519
  321   1HG   PRO  40          HG2       PRO  40  -2.559  12.265   9.817
  322   2HG   PRO  40          HG1       PRO  40  -2.677  12.063  11.571
  323   1HD   PRO  40          HD2       PRO  40  -2.985  10.035   9.563
  324   2HD   PRO  40          HD1       PRO  40  -3.162   9.843  11.313
  325    H    LYS  41           HN       LYS  41  -7.782  13.106  10.638
  326    HA   LYS  41           HA       LYS  41  -9.160  11.983   8.367
  327   1HB   LYS  41          HB2       LYS  41 -10.115  13.421  10.293
  328   2HB   LYS  41          HB1       LYS  41  -9.548  14.800   9.352
  329   1HG   LYS  41          HG2       LYS  41 -10.898  14.105   7.440
  330   2HG   LYS  41          HG1       LYS  41 -11.399  12.642   8.286
  331   1HD   LYS  41          HD2       LYS  41 -12.503  14.015  10.012
  332   2HD   LYS  41          HD1       LYS  41 -11.997  15.481   9.172
  333   1HE   LYS  41          HE2       LYS  41 -13.851  13.335   8.102
  334   2HE   LYS  41          HE1       LYS  41 -14.294  14.982   8.547
  335   1HZ   LYS  41          HZ1       LYS  41 -12.310  15.423   6.818
  336   2HZ   LYS  41          HZ2       LYS  41 -13.951  15.369   6.380
  337   3HZ   LYS  41          HZ3       LYS  41 -12.967  14.001   6.167
  338    H    SER  42           HN       SER  42  -6.520  14.178   8.453
  339    HA   SER  42           HA       SER  42  -7.260  15.596   6.060
  340   1HB   SER  42          HB2       SER  42  -5.079  16.583   6.131
  341   2HB   SER  42          HB1       SER  42  -5.570  16.374   7.809
  342    HG   SER  42           HG       SER  42  -3.791  15.274   7.976
  343    H    LEU  43           HN       LEU  43  -6.009  12.464   6.407
  344    HA   LEU  43           HA       LEU  43  -5.342  12.432   3.453
  345   1HB   LEU  43          HB2       LEU  43  -4.418  10.241   5.300
  346   2HB   LEU  43          HB1       LEU  43  -3.712  10.796   3.788
  347    HG   LEU  43           HG       LEU  43  -3.662  12.282   6.411
  348   1HD1  LEU  43          HD11      LEU  43  -2.176  10.449   6.603
  349   2HD1  LEU  43          HD12      LEU  43  -1.160  11.816   6.154
  350   3HD1  LEU  43          HD13      LEU  43  -1.624  10.626   4.938
  351   1HD2  LEU  43          HD21      LEU  43  -2.149  13.837   5.266
  352   2HD2  LEU  43          HD22      LEU  43  -3.665  13.756   4.378
  353   3HD2  LEU  43          HD23      LEU  43  -2.255  12.881   3.790
  354    H    SER  44           HN       SER  44  -7.723  11.617   5.631
  355    HA   SER  44           HA       SER  44  -8.600   9.056   5.280
  356   1HB   SER  44          HB2       SER  44 -10.075  10.596   6.355
  357   2HB   SER  44          HB1       SER  44 -10.174  11.616   4.924
  358    HG   SER  44           HG       SER  44 -11.673   9.503   5.603
  359    H    GLU  45           HN       GLU  45  -9.100  11.649   2.964
  360    HA   GLU  45           HA       GLU  45 -10.417  10.295   0.973
  361   1HB   GLU  45          HB2       GLU  45 -10.283  12.728   1.323
  362   2HB   GLU  45          HB1       GLU  45  -8.613  12.704   0.747
  363   1HG   GLU  45          HG2       GLU  45  -9.241  12.147  -1.443
  364   2HG   GLU  45          HG1       GLU  45 -10.831  11.566  -0.950
  365    H    GLU  46           HN       GLU  46  -6.961  11.200   0.797
  366    HA   GLU  46           HA       GLU  46  -6.546  10.043  -1.759
  367   1HB   GLU  46          HB2       GLU  46  -4.466  10.177   0.426
  368   2HB   GLU  46          HB1       GLU  46  -4.230  10.334  -1.311
  369   1HG   GLU  46          HG2       GLU  46  -5.628  12.310   0.510
  370   2HG   GLU  46          HG1       GLU  46  -4.109  12.548  -0.341
  371    H    CYS  47           HN       CYS  47  -6.855   8.583   1.382
  372    HA   CYS  47           HA       CYS  47  -5.557   6.100   0.552
  373   1HB   CYS  47          HB2       CYS  47  -5.908   5.408   2.750
  374   2HB   CYS  47          HB1       CYS  47  -6.093   7.143   2.999
  375    H    GLN  48           HN       GLN  48  -8.892   7.240   0.943
  376    HA   GLN  48           HA       GLN  48 -10.214   4.849   0.268
  377   1HB   GLN  48          HB2       GLN  48 -11.092   7.310   0.885
  378   2HB   GLN  48          HB1       GLN  48 -11.277   7.430  -0.862
  379   1HG   GLN  48          HG2       GLN  48 -12.529   5.369   0.977
  380   2HG   GLN  48          HG1       GLN  48 -13.363   6.614   0.048
  381   1HE2  GLN  48          HE21      GLN  48 -12.044   6.353  -2.454
  382   2HE2  GLN  48          HE22      GLN  48 -12.384   4.820  -3.098
  383    H    GLU  49           HN       GLU  49  -8.898   7.364  -1.897
  384    HA   GLU  49           HA       GLU  49  -9.741   6.068  -4.315
  385   1HB   GLU  49          HB2       GLU  49  -9.177   8.436  -4.301
  386   2HB   GLU  49          HB1       GLU  49  -7.528   8.073  -3.791
  387   1HG   GLU  49          HG2       GLU  49  -7.022   6.998  -5.870
  388   2HG   GLU  49          HG1       GLU  49  -8.719   6.989  -6.352
  389    H    VAL  50           HN       VAL  50  -6.705   5.943  -2.437
  390    HA   VAL  50           HA       VAL  50  -5.330   4.312  -4.356
  391    HB   VAL  50           HB       VAL  50  -4.815   4.494  -1.380
  392   1HG1  VAL  50          HG11      VAL  50  -2.517   3.797  -2.047
  393   2HG1  VAL  50          HG12      VAL  50  -3.107   3.545  -3.687
  394   3HG1  VAL  50          HG13      VAL  50  -3.735   2.562  -2.364
  395   1HG2  VAL  50          HG21      VAL  50  -3.104   5.952  -3.358
  396   2HG2  VAL  50          HG22      VAL  50  -3.606   6.440  -1.741
  397   3HG2  VAL  50          HG23      VAL  50  -4.712   6.621  -3.100
  398    H    VAL  51           HN       VAL  51  -6.957   3.508  -1.248
  399    HA   VAL  51           HA       VAL  51  -6.574   0.725  -1.544
  400    HB   VAL  51           HB       VAL  51  -8.824   2.140  -0.060
  401   1HG1  VAL  51          HG11      VAL  51  -8.798   0.138   1.382
  402   2HG1  VAL  51          HG12      VAL  51  -7.571  -0.585   0.344
  403   3HG1  VAL  51          HG13      VAL  51  -9.190  -0.273  -0.286
  404   1HG2  VAL  51          HG21      VAL  51  -6.439   2.873   0.490
  405   2HG2  VAL  51          HG22      VAL  51  -6.179   1.235   1.084
  406   3HG2  VAL  51          HG23      VAL  51  -7.390   2.266   1.846
  407    H    ASP  52           HN       ASP  52  -9.443   2.648  -2.337
  408    HA   ASP  52           HA       ASP  52 -10.984   0.499  -3.350
  409   1HB   ASP  52          HB2       ASP  52 -11.890   2.704  -2.730
  410   2HB   ASP  52          HB1       ASP  52 -11.115   3.414  -4.145
  411    H    THR  53           HN       THR  53  -8.820   2.748  -5.092
  412    HA   THR  53           HA       THR  53  -9.414   1.426  -7.654
  413    HB   THR  53           HB       THR  53  -7.365   3.558  -7.038
  414    HG1  THR  53           HG1      THR  53  -9.784   3.864  -6.615
  415   1HG2  THR  53          HG21      THR  53  -7.572   4.046  -9.434
  416   2HG2  THR  53          HG22      THR  53  -8.759   2.754  -9.605
  417   3HG2  THR  53          HG23      THR  53  -7.089   2.367  -9.192
  418    H    TYR  54           HN       TYR  54  -6.652   1.618  -5.401
  419    HA   TYR  54           HA       TYR  54  -5.289  -0.445  -7.103
  420   1HB   TYR  54          HB2       TYR  54  -4.181   1.533  -5.122
  421   2HB   TYR  54          HB1       TYR  54  -3.225   0.288  -5.921
  422    HD1  TYR  54           HD1      TYR  54  -2.704   0.433  -8.307
  423    HD2  TYR  54           HD2      TYR  54  -5.140   3.387  -6.389
  424    HE1  TYR  54           HE1      TYR  54  -2.460   1.921 -10.278
  425    HE2  TYR  54           HE2      TYR  54  -4.903   4.879  -8.336
  426    HH   TYR  54           HH       TYR  54  -3.211   3.796 -11.270
  427    H    GLY  55           HN       GLY  55  -7.344  -1.081  -5.082
  428   1HA   GLY  55          HA2       GLY  55  -5.910  -2.162  -2.787
  429   2HA   GLY  55          HA1       GLY  55  -7.624  -2.364  -3.122
  430    H    SER  56           HN       SER  56  -7.732  -3.716  -5.488
  431    HA   SER  56           HA       SER  56  -6.928  -6.328  -4.661
  432   1HB   SER  56          HB2       SER  56  -7.580  -5.661  -7.527
  433   2HB   SER  56          HB1       SER  56  -7.937  -7.132  -6.621
  434    HG   SER  56           HG       SER  56  -8.982  -4.698  -5.711
  435    H    SER  57           HN       SER  57  -5.468  -3.890  -6.673
  436    HA   SER  57           HA       SER  57  -3.620  -5.737  -7.905
  437   1HB   SER  57          HB2       SER  57  -2.537  -3.720  -8.861
  438   2HB   SER  57          HB1       SER  57  -4.284  -3.668  -9.075
  439    HG   SER  57           HG       SER  57  -2.874  -2.463  -6.923
  440    H    ILE  58           HN       ILE  58  -3.212  -3.307  -5.307
  441    HA   ILE  58           HA       ILE  58  -0.427  -3.728  -4.837
  442    HB   ILE  58           HB       ILE  58  -2.706  -3.043  -2.957
  443   1HG1  ILE  58          HG12      ILE  58  -0.419  -1.359  -4.033
  444   2HG1  ILE  58          HG11      ILE  58  -2.030  -1.382  -4.738
  445   1HG2  ILE  58          HG21      ILE  58   0.258  -3.366  -2.448
  446   2HG2  ILE  58          HG22      ILE  58  -1.086  -4.021  -1.519
  447   3HG2  ILE  58          HG23      ILE  58  -0.723  -2.299  -1.442
  448   1HD1  ILE  58          HD11      ILE  58  -2.099   0.482  -3.275
  449   2HD1  ILE  58          HD12      ILE  58  -1.168  -0.362  -2.034
  450   3HD1  ILE  58          HD13      ILE  58  -2.850  -0.803  -2.328
  451    H    LEU  59           HN       LEU  59  -3.231  -5.208  -3.321
  452    HA   LEU  59           HA       LEU  59  -1.816  -7.080  -1.740
  453   1HB   LEU  59          HB2       LEU  59  -4.043  -6.681  -1.113
  454   2HB   LEU  59          HB1       LEU  59  -4.644  -6.888  -2.749
  455    HG   LEU  59           HG       LEU  59  -4.246  -9.319  -2.611
  456   1HD1  LEU  59          HD11      LEU  59  -3.489  -8.902   0.300
  457   2HD1  LEU  59          HD12      LEU  59  -2.287  -9.122  -0.960
  458   3HD1  LEU  59          HD13      LEU  59  -3.434 -10.404  -0.618
  459   1HD2  LEU  59          HD21      LEU  59  -6.384  -9.229  -1.876
  460   2HD2  LEU  59          HD22      LEU  59  -6.075  -7.830  -0.851
  461   3HD2  LEU  59          HD23      LEU  59  -5.749  -9.449  -0.250
  462    H    SER  60           HN       SER  60  -2.664  -7.122  -5.162
  463    HA   SER  60           HA       SER  60  -2.418  -9.979  -5.308
  464   1HB   SER  60          HB2       SER  60  -2.648  -7.782  -7.343
  465   2HB   SER  60          HB1       SER  60  -2.255  -9.411  -7.886
  466    HG   SER  60           HG       SER  60  -4.184 -10.111  -7.223
  467    H    ILE  61           HN       ILE  61  -0.352  -7.197  -5.896
  468    HA   ILE  61           HA       ILE  61   1.878  -8.558  -7.106
  469    HB   ILE  61           HB       ILE  61   1.965  -6.011  -5.477
  470   1HG1  ILE  61          HG12      ILE  61   0.425  -6.543  -7.898
  471   2HG1  ILE  61          HG11      ILE  61   0.529  -5.060  -6.962
  472   1HG2  ILE  61          HG21      ILE  61   4.116  -7.008  -6.151
  473   2HG2  ILE  61          HG22      ILE  61   3.845  -5.454  -6.924
  474   3HG2  ILE  61          HG23      ILE  61   3.616  -6.945  -7.839
  475   1HD1  ILE  61          HD11      ILE  61   1.194  -4.671  -9.284
  476   2HD1  ILE  61          HD12      ILE  61   2.459  -5.888  -9.150
  477   3HD1  ILE  61          HD13      ILE  61   2.555  -4.403  -8.197
  478    H    LEU  62           HN       LEU  62   1.303  -7.437  -3.759
  479    HA   LEU  62           HA       LEU  62   3.759  -8.263  -2.685
  480   1HB   LEU  62          HB2       LEU  62   1.237  -7.325  -1.699
  481   2HB   LEU  62          HB1       LEU  62   1.689  -8.707  -0.707
  482    HG   LEU  62           HG       LEU  62   3.507  -6.351  -1.308
  483   1HD1  LEU  62          HD11      LEU  62   2.884  -5.357   0.681
  484   2HD1  LEU  62          HD12      LEU  62   2.397  -6.877   1.418
  485   3HD1  LEU  62          HD13      LEU  62   1.345  -6.091   0.246
  486   1HD2  LEU  62          HD21      LEU  62   5.017  -8.016  -0.757
  487   2HD2  LEU  62          HD22      LEU  62   3.834  -8.949   0.157
  488   3HD2  LEU  62          HD23      LEU  62   4.581  -7.529   0.876
  489    H    LEU  63           HN       LEU  63   0.820 -10.140  -3.239
  490    HA   LEU  63           HA       LEU  63   1.753 -12.567  -1.930
  491   1HB   LEU  63          HB2       LEU  63  -0.463 -11.872  -3.855
  492   2HB   LEU  63          HB1       LEU  63  -0.102 -13.559  -3.502
  493    HG   LEU  63           HG       LEU  63  -0.683 -13.323  -1.217
  494   1HD1  LEU  63          HD11      LEU  63   0.464 -11.369  -0.530
  495   2HD1  LEU  63          HD12      LEU  63  -1.235 -11.043  -0.247
  496   3HD1  LEU  63          HD13      LEU  63  -0.431 -10.357  -1.654
  497   1HD2  LEU  63          HD21      LEU  63  -2.943 -12.590  -1.281
  498   2HD2  LEU  63          HD22      LEU  63  -2.580 -13.145  -2.915
  499   3HD2  LEU  63          HD23      LEU  63  -2.600 -11.419  -2.555
  500    H    GLU  64           HN       GLU  64   2.712 -11.100  -4.850
  501    HA   GLU  64           HA       GLU  64   3.435 -13.683  -6.080
  502   1HB   GLU  64          HB2       GLU  64   3.762 -10.797  -6.933
  503   2HB   GLU  64          HB1       GLU  64   4.528 -12.118  -7.814
  504   1HG   GLU  64          HG2       GLU  64   1.563 -12.031  -7.211
  505   2HG   GLU  64          HG1       GLU  64   2.263 -11.420  -8.709
  506    H    GLU  65           HN       GLU  65   4.670 -11.882  -3.636
  507    HA   GLU  65           HA       GLU  65   6.753 -12.290  -2.464
  508   1HB   GLU  65          HB2       GLU  65   6.712 -14.397  -4.105
  509   2HB   GLU  65          HB1       GLU  65   8.050 -13.527  -4.854
  510   1HG   GLU  65          HG2       GLU  65   9.072 -13.321  -2.553
  511   2HG   GLU  65          HG1       GLU  65   7.812 -14.408  -1.970
  512    H    VAL  66           HN       VAL  66   6.121  -9.981  -4.343
  513    HA   VAL  66           HA       VAL  66   8.809  -9.179  -5.318
  514    HB   VAL  66           HB       VAL  66   6.000  -8.150  -5.574
  515   1HG1  VAL  66          HG11      VAL  66   7.087  -6.124  -6.782
  516   2HG1  VAL  66          HG12      VAL  66   8.518  -6.517  -5.828
  517   3HG1  VAL  66          HG13      VAL  66   7.008  -6.090  -5.020
  518   1HG2  VAL  66          HG21      VAL  66   6.426  -8.320  -7.907
  519   2HG2  VAL  66          HG22      VAL  66   7.209  -9.737  -7.207
  520   3HG2  VAL  66          HG23      VAL  66   8.172  -8.335  -7.666
  521    H    SER  67           HN       SER  67   9.980  -7.463  -4.267
  522    HA   SER  67           HA       SER  67   9.786  -7.201  -1.497
  523   1HB   SER  67          HB2       SER  67  10.725  -4.816  -3.067
  524   2HB   SER  67          HB1       SER  67  11.441  -5.565  -1.645
  525    HG   SER  67           HG       SER  67  12.354  -5.907  -3.925
  526    HA   PRO  68           HA       PRO  68   6.186  -4.706  -0.865
  527   1HB   PRO  68          HB2       PRO  68   7.099  -3.185   1.367
  528   2HB   PRO  68          HB1       PRO  68   6.270  -4.740   1.431
  529   1HG   PRO  68          HG2       PRO  68   9.127  -4.153   1.875
  530   2HG   PRO  68          HG1       PRO  68   8.200  -5.589   2.338
  531   1HD   PRO  68          HD2       PRO  68  10.064  -5.443   0.214
  532   2HD   PRO  68          HD1       PRO  68   8.874  -6.737   0.480
  533    H    GLU  69           HN       GLU  69   9.307  -2.978  -0.786
  534    HA   GLU  69           HA       GLU  69   8.102  -0.379  -1.270
  535   1HB   GLU  69          HB2       GLU  69  10.169  -0.422  -0.095
  536   2HB   GLU  69          HB1       GLU  69  10.938  -1.415  -1.329
  537   1HG   GLU  69          HG2       GLU  69  11.573   1.038  -1.385
  538   2HG   GLU  69          HG1       GLU  69  10.945   0.404  -2.905
  539    H    LEU  70           HN       LEU  70   9.021  -2.984  -3.350
  540    HA   LEU  70           HA       LEU  70   9.478  -1.281  -5.665
  541   1HB   LEU  70          HB2       LEU  70   8.878  -4.237  -5.434
  542   2HB   LEU  70          HB1       LEU  70   9.028  -3.448  -6.994
  543    HG   LEU  70           HG       LEU  70  11.200  -3.127  -4.954
  544   1HD1  LEU  70          HD11      LEU  70  10.705  -5.605  -5.289
  545   2HD1  LEU  70          HD12      LEU  70  12.336  -5.101  -5.714
  546   3HD1  LEU  70          HD13      LEU  70  11.139  -5.369  -6.979
  547   1HD2  LEU  70          HD21      LEU  70  12.601  -2.953  -7.004
  548   2HD2  LEU  70          HD22      LEU  70  11.345  -1.724  -6.937
  549   3HD2  LEU  70          HD23      LEU  70  11.145  -3.134  -7.974
  550    H    VAL  71           HN       VAL  71   6.772  -2.252  -3.892
  551    HA   VAL  71           HA       VAL  71   4.837  -2.313  -5.987
  552    HB   VAL  71           HB       VAL  71   4.688  -1.880  -3.000
  553   1HG1  VAL  71          HG11      VAL  71   2.108  -2.021  -3.319
  554   2HG1  VAL  71          HG12      VAL  71   2.431  -1.450  -4.956
  555   3HG1  VAL  71          HG13      VAL  71   2.881  -0.458  -3.569
  556   1HG2  VAL  71          HG21      VAL  71   4.955  -4.159  -3.721
  557   2HG2  VAL  71          HG22      VAL  71   3.643  -3.996  -4.892
  558   3HG2  VAL  71          HG23      VAL  71   3.293  -3.964  -3.164
  559    H    CYS  72           HN       CYS  72   5.549   0.442  -3.743
  560    HA   CYS  72           HA       CYS  72   3.794   2.113  -5.192
  561   1HB   CYS  72          HB2       CYS  72   6.245   2.989  -3.606
  562   2HB   CYS  72          HB1       CYS  72   4.858   3.987  -4.008
  563    H    SER  73           HN       SER  73   7.106   1.165  -5.760
  564    HA   SER  73           HA       SER  73   7.635   3.265  -7.749
  565   1HB   SER  73          HB2       SER  73   9.127   0.661  -7.523
  566   2HB   SER  73          HB1       SER  73   9.732   2.213  -8.090
  567    HG   SER  73           HG       SER  73  10.375   1.720  -5.928
  568    H    MET  74           HN       MET  74   6.682  -0.177  -7.954
  569    HA   MET  74           HA       MET  74   6.751  -0.229 -10.870
  570   1HB   MET  74          HB2       MET  74   5.837  -2.039  -8.693
  571   2HB   MET  74          HB1       MET  74   5.091  -2.276 -10.267
  572   1HG   MET  74          HG2       MET  74   7.056  -3.032 -11.223
  573   2HG   MET  74          HG1       MET  74   8.071  -2.014 -10.213
  574   1HE   MET  74          HE1       MET  74   5.849  -5.720  -8.719
  575   2HE   MET  74          HE2       MET  74   5.275  -4.475  -9.813
  576   3HE   MET  74          HE3       MET  74   5.376  -4.143  -8.087
  577    H    LEU  75           HN       LEU  75   4.105   0.313  -8.508
  578    HA   LEU  75           HA       LEU  75   2.096   0.466 -10.601
  579   1HB   LEU  75          HB2       LEU  75   1.939   1.602  -7.794
  580   2HB   LEU  75          HB1       LEU  75   0.588   1.247  -8.868
  581    HG   LEU  75           HG       LEU  75   2.455  -0.739  -7.557
  582   1HD1  LEU  75          HD11      LEU  75   0.260  -1.670  -6.755
  583   2HD1  LEU  75          HD12      LEU  75  -0.515  -0.236  -7.427
  584   3HD1  LEU  75          HD13      LEU  75   0.658  -0.075  -6.120
  585   1HD2  LEU  75          HD21      LEU  75   0.913  -2.431  -8.773
  586   2HD2  LEU  75          HD22      LEU  75   2.203  -1.680  -9.707
  587   3HD2  LEU  75          HD23      LEU  75   0.544  -1.094  -9.860
  588    H    HIS  76           HN       HIS  76   4.585   2.320 -10.560
  589    HA   HIS  76           HA       HIS  76   5.074   4.573 -11.037
  590   1HB   HIS  76          HB2       HIS  76   3.795   5.509 -12.845
  591   2HB   HIS  76          HB1       HIS  76   3.864   3.768 -13.109
  592    HD1  HIS  76           HD1      HIS  76   1.519   6.400 -11.676
  593    HD2  HIS  76           HD2      HIS  76   1.373   2.548 -13.262
  594    HE1  HIS  76           HE1      HIS  76  -0.934   5.802 -11.881
  595    H    LEU  77           HN       LEU  77   3.201   3.937  -8.641
  596    HA   LEU  77           HA       LEU  77   1.591   6.372  -8.444
  597   1HB   LEU  77          HB2       LEU  77   1.715   3.831  -7.111
  598   2HB   LEU  77          HB1       LEU  77   1.953   5.065  -5.886
  599    HG   LEU  77           HG       LEU  77  -0.105   6.136  -6.472
  600   1HD1  LEU  77          HD11      LEU  77  -1.514   4.566  -8.268
  601   2HD1  LEU  77          HD12      LEU  77   0.111   4.562  -8.951
  602   3HD1  LEU  77          HD13      LEU  77  -0.716   6.085  -8.656
  603   1HD2  LEU  77          HD21      LEU  77  -0.079   4.010  -5.041
  604   2HD2  LEU  77          HD22      LEU  77  -0.763   3.203  -6.448
  605   3HD2  LEU  77          HD23      LEU  77  -1.639   4.516  -5.680
  606    H    CYS  78           HN       CYS  78   4.851   5.575  -7.959
  607    HA   CYS  78           HA       CYS  78   5.271   8.162  -6.488
  608   1HB   CYS  78          HB2       CYS  78   6.578   5.476  -6.042
  609   2HB   CYS  78          HB1       CYS  78   7.378   6.972  -5.567
  610    H    SER  79           HN       SER  79   6.376   5.760  -8.761
  611    HA   SER  79           HA       SER  79   7.690   5.875 -10.635
  612   1HB   SER  79          HB2       SER  79   6.409   8.125 -10.875
  613   2HB   SER  79          HB1       SER  79   7.902   8.873 -10.314
  614    HG   SER  79           HG       SER  79   8.943   7.653 -12.042
  615    H    GLY  80           HN       GLY  80   8.687   6.757  -7.614
  616   1HA   GLY  80          HA2       GLY  80  10.881   6.264  -6.753
  617   2HA   GLY  80          HA1       GLY  80  11.539   6.423  -8.382
  618    H    LEU  81           HN       LEU  81  13.084   7.999  -8.005
  619    HA   LEU  81           HA       LEU  81  13.918  10.163  -7.784
  620   1HB   LEU  81          HB2       LEU  81  11.076  11.160  -7.538
  621   2HB   LEU  81          HB1       LEU  81  12.493  12.028  -8.108
  622    HG   LEU  81           HG       LEU  81  11.090   9.732  -9.503
  623   1HD1  LEU  81          HD11      LEU  81  11.535  12.655 -10.155
  624   2HD1  LEU  81          HD12      LEU  81   9.995  11.852  -9.852
  625   3HD1  LEU  81          HD13      LEU  81  10.912  11.478 -11.311
  626   1HD2  LEU  81          HD21      LEU  81  13.396   9.331  -9.912
  627   2HD2  LEU  81          HD22      LEU  81  13.766  11.054  -9.994
  628   3HD2  LEU  81          HD23      LEU  81  12.870  10.280 -11.303
  629    H    VAL  82           HN       VAL  82  12.012   8.608  -5.534
  630    HA   VAL  82           HA       VAL  82  12.361  10.641  -3.397
  631    HB   VAL  82           HB       VAL  82  10.925   8.968  -2.059
  632   1HG1  VAL  82          HG11      VAL  82   8.872   9.825  -3.076
  633   2HG1  VAL  82          HG12      VAL  82   9.751  10.250  -4.544
  634   3HG1  VAL  82          HG13      VAL  82  10.093  11.097  -3.035
  635   1HG2  VAL  82          HG21      VAL  82  11.242   7.017  -3.530
  636   2HG2  VAL  82          HG22      VAL  82  10.524   7.897  -4.875
  637   3HG2  VAL  82          HG23      VAL  82   9.542   7.473  -3.478
  638    HA   PRO  83           HA       PRO  83  15.895   8.116  -2.028
  639   1HB   PRO  83          HB2       PRO  83  16.118   9.572   0.458
  640   2HB   PRO  83          HB1       PRO  83  17.106   9.786  -0.995
  641   1HG   PRO  83          HG2       PRO  83  15.045  11.554   0.050
  642   2HG   PRO  83          HG1       PRO  83  16.119  11.820  -1.332
  643   1HD   PRO  83          HD2       PRO  83  13.304  11.201  -1.395
  644   2HD   PRO  83          HD1       PRO  83  14.401  11.411  -2.780
  645    H    ARG  84           HN       ARG  84  16.026   6.352  -0.392
  646    HA   ARG  84           HA       ARG  84  13.415   5.628   0.694
  647   1HB   ARG  84          HB2       ARG  84  16.104   4.302   1.148
  648   2HB   ARG  84          HB1       ARG  84  14.513   3.583   1.404
  649   1HG   ARG  84          HG2       ARG  84  14.019   3.717  -0.977
  650   2HG   ARG  84          HG1       ARG  84  15.532   4.572  -1.276
  651   1HD   ARG  84          HD2       ARG  84  16.835   2.645  -0.660
  652   2HD   ARG  84          HD1       ARG  84  15.407   1.801  -0.061
  653    HE   ARG  84           HE       ARG  84  14.809   2.302  -2.719
  654   1HH1  ARG  84          HH21      ARG  84  17.407   0.862  -0.968
  655   2HH1  ARG  84          HH22      ARG  84  17.817  -0.252  -2.230
  656   1HH2  ARG  84          HH11      ARG  84  15.330   0.856  -4.377
  657   2HH2  ARG  84          HH12      ARG  84  16.641  -0.254  -4.159
  Start of MODEL    3
    1   1H    SER   1          HT1       SER   1   6.632  17.531  -1.648
    2   2H    SER   1          HT2       SER   1   6.154  16.060  -2.352
    3   3H    SER   1          HT3       SER   1   7.331  16.077  -1.126
    4    HA   SER   1           HA       SER   1   5.786  15.867   0.424
    5   1HB   SER   1          HB2       SER   1   4.208  17.667   0.802
    6   2HB   SER   1          HB1       SER   1   5.726  18.378   0.257
    7    HG   SER   1           HG       SER   1   3.890  19.219  -0.849
    8    H    ASP   2           HN       ASP   2   5.475  14.429  -2.069
    9    HA   ASP   2           HA       ASP   2   2.697  14.414  -2.867
   10   1HB   ASP   2          HB2       ASP   2   4.367  13.618  -4.415
   11   2HB   ASP   2          HB1       ASP   2   4.931  12.414  -3.260
   12    H    VAL   3           HN       VAL   3   1.299  14.045  -1.221
   13    HA   VAL   3           HA       VAL   3   1.623  12.302   0.993
   14    HB   VAL   3           HB       VAL   3  -0.631  12.695   1.456
   15   1HG1  VAL   3          HG11      VAL   3   0.818  14.768   1.178
   16   2HG1  VAL   3          HG12      VAL   3  -0.925  15.033   1.110
   17   3HG1  VAL   3          HG13      VAL   3   0.022  15.005  -0.378
   18   1HG2  VAL   3          HG21      VAL   3  -1.019  12.983  -1.538
   19   2HG2  VAL   3          HG22      VAL   3  -2.241  13.486  -0.367
   20   3HG2  VAL   3          HG23      VAL   3  -1.754  11.795  -0.460
   21    H    TYR   4           HN       TYR   4   1.103  11.436  -2.367
   22    HA   TYR   4           HA       TYR   4  -0.463   9.117  -1.692
   23   1HB   TYR   4          HB2       TYR   4   0.923  10.064  -4.203
   24   2HB   TYR   4          HB1       TYR   4   0.421   8.379  -4.141
   25    HD1  TYR   4           HD1      TYR   4  -2.087   8.129  -3.052
   26    HD2  TYR   4           HD2      TYR   4  -0.588  11.504  -5.245
   27    HE1  TYR   4           HE1      TYR   4  -4.392   8.733  -3.703
   28    HE2  TYR   4           HE2      TYR   4  -2.901  12.118  -5.876
   29    HH   TYR   4           HH       TYR   4  -5.046  11.363  -5.962
   30    H    CYS   5           HN       CYS   5   2.965   9.548  -2.442
   31    HA   CYS   5           HA       CYS   5   3.756   6.824  -2.222
   32   1HB   CYS   5          HB2       CYS   5   5.198   9.409  -1.545
   33   2HB   CYS   5          HB1       CYS   5   5.977   7.828  -1.443
   34    H    GLU   6           HN       GLU   6   3.284   9.282   0.301
   35    HA   GLU   6           HA       GLU   6   4.208   7.719   2.484
   36   1HB   GLU   6          HB2       GLU   6   3.767  10.079   2.788
   37   2HB   GLU   6          HB1       GLU   6   2.072   9.868   2.349
   38   1HG   GLU   6          HG2       GLU   6   1.591   8.674   4.346
   39   2HG   GLU   6          HG1       GLU   6   3.301   8.430   4.705
   40    H    VAL   7           HN       VAL   7   0.938   7.916   1.053
   41    HA   VAL   7           HA       VAL   7  -0.180   6.026   2.966
   42    HB   VAL   7           HB       VAL   7  -1.184   6.887   0.226
   43   1HG1  VAL   7          HG11      VAL   7  -2.303   4.870   0.721
   44   2HG1  VAL   7          HG12      VAL   7  -3.408   6.115   1.297
   45   3HG1  VAL   7          HG13      VAL   7  -2.397   5.238   2.443
   46   1HG2  VAL   7          HG21      VAL   7  -1.545   7.970   3.018
   47   2HG2  VAL   7          HG22      VAL   7  -2.820   8.182   1.819
   48   3HG2  VAL   7          HG23      VAL   7  -1.216   8.843   1.524
   49    H    CYS   8           HN       CYS   8   1.151   5.578  -0.345
   50    HA   CYS   8           HA       CYS   8   0.336   2.883  -0.622
   51   1HB   CYS   8          HB2       CYS   8   1.815   2.817  -2.422
   52   2HB   CYS   8          HB1       CYS   8   1.562   4.550  -2.261
   53    H    GLU   9           HN       GLU   9   3.313   4.230   0.831
   54    HA   GLU   9           HA       GLU   9   4.350   1.656   1.517
   55   1HB   GLU   9          HB2       GLU   9   4.941   4.468   2.440
   56   2HB   GLU   9          HB1       GLU   9   5.729   3.090   3.209
   57   1HG   GLU   9          HG2       GLU   9   5.741   3.510   0.213
   58   2HG   GLU   9          HG1       GLU   9   7.003   4.143   1.269
   59    H    PHE  10           HN       PHE  10   2.072   3.879   3.162
   60    HA   PHE  10           HA       PHE  10   2.305   2.557   5.699
   61   1HB   PHE  10          HB2       PHE  10   1.301   4.805   5.503
   62   2HB   PHE  10          HB1       PHE  10  -0.038   4.117   4.578
   63    HD1  PHE  10           HD1      PHE  10  -1.803   2.899   5.643
   64    HD2  PHE  10           HD2      PHE  10   1.651   4.124   7.881
   65    HE1  PHE  10           HE1      PHE  10  -2.936   2.243   7.755
   66    HE2  PHE  10           HE2      PHE  10   0.520   3.476   9.990
   67    HZ   PHE  10           HZ       PHE  10  -1.773   2.534   9.926
   68    H    LEU  11           HN       LEU  11  -0.035   2.175   2.998
   69    HA   LEU  11           HA       LEU  11  -1.493   0.032   4.251
   70   1HB   LEU  11          HB2       LEU  11  -1.073   0.564   1.290
   71   2HB   LEU  11          HB1       LEU  11  -2.251  -0.564   1.966
   72    HG   LEU  11           HG       LEU  11  -2.211   2.357   2.766
   73   1HD1  LEU  11          HD11      LEU  11  -3.618   1.065   0.415
   74   2HD1  LEU  11          HD12      LEU  11  -2.458   2.392   0.366
   75   3HD1  LEU  11          HD13      LEU  11  -4.057   2.643   1.068
   76   1HD2  LEU  11          HD21      LEU  11  -4.243   0.107   2.890
   77   2HD2  LEU  11          HD22      LEU  11  -4.696   1.796   3.101
   78   3HD2  LEU  11          HD23      LEU  11  -3.574   1.040   4.228
   79    H    VAL  12           HN       VAL  12   1.325   0.001   1.996
   80    HA   VAL  12           HA       VAL  12   1.559  -2.814   1.836
   81    HB   VAL  12           HB       VAL  12   3.535  -0.528   1.654
   82   1HG1  VAL  12          HG11      VAL  12   4.054  -3.494   1.380
   83   2HG1  VAL  12          HG12      VAL  12   4.910  -2.338   2.404
   84   3HG1  VAL  12          HG13      VAL  12   5.094  -2.267   0.655
   85   1HG2  VAL  12          HG21      VAL  12   1.816  -0.888  -0.136
   86   2HG2  VAL  12          HG22      VAL  12   2.498  -2.490  -0.411
   87   3HG2  VAL  12          HG23      VAL  12   3.472  -1.051  -0.717
   88    H    LYS  13           HN       LYS  13   3.117  -0.511   4.133
   89    HA   LYS  13           HA       LYS  13   4.500  -2.478   5.651
   90   1HB   LYS  13          HB2       LYS  13   5.093  -0.207   6.040
   91   2HB   LYS  13          HB1       LYS  13   3.422   0.265   6.346
   92   1HG   LYS  13          HG2       LYS  13   3.408  -0.656   8.498
   93   2HG   LYS  13          HG1       LYS  13   4.723  -1.776   8.141
   94   1HD   LYS  13          HD2       LYS  13   5.409   0.120   9.635
   95   2HD   LYS  13          HD1       LYS  13   6.340   0.035   8.140
   96   1HE   LYS  13          HE2       LYS  13   5.484   2.356   8.820
   97   2HE   LYS  13          HE1       LYS  13   5.141   1.846   7.167
   98   1HZ   LYS  13          HZ1       LYS  13   3.184   1.166   9.226
   99   2HZ   LYS  13          HZ2       LYS  13   2.946   1.584   7.597
  100   3HZ   LYS  13          HZ3       LYS  13   3.275   2.791   8.747
  101    H    GLU  14           HN       GLU  14   1.259  -1.103   6.026
  102    HA   GLU  14           HA       GLU  14   0.597  -2.645   8.369
  103   1HB   GLU  14          HB2       GLU  14  -0.512  -0.477   7.252
  104   2HB   GLU  14          HB1       GLU  14  -1.550  -1.681   6.496
  105   1HG   GLU  14          HG2       GLU  14  -2.104  -2.594   8.725
  106   2HG   GLU  14          HG1       GLU  14  -1.071  -1.374   9.474
  107    H    VAL  15           HN       VAL  15   0.097  -3.151   4.895
  108    HA   VAL  15           HA       VAL  15  -1.527  -5.506   5.264
  109    HB   VAL  15           HB       VAL  15   0.002  -4.341   2.941
  110   1HG1  VAL  15          HG11      VAL  15  -1.133  -7.118   3.204
  111   2HG1  VAL  15          HG12      VAL  15   0.343  -6.590   2.394
  112   3HG1  VAL  15          HG13      VAL  15  -1.234  -6.289   1.651
  113   1HG2  VAL  15          HG21      VAL  15  -2.926  -5.014   3.382
  114   2HG2  VAL  15          HG22      VAL  15  -2.255  -4.154   1.995
  115   3HG2  VAL  15          HG23      VAL  15  -2.211  -3.415   3.596
  116    H    THR  16           HN       THR  16   2.012  -5.115   4.693
  117    HA   THR  16           HA       THR  16   2.435  -7.919   4.540
  118    HB   THR  16           HB       THR  16   4.701  -7.602   4.733
  119    HG1  THR  16           HG1      THR  16   5.135  -5.264   5.778
  120   1HG2  THR  16          HG21      THR  16   4.586  -4.794   4.044
  121   2HG2  THR  16          HG22      THR  16   3.295  -5.666   3.222
  122   3HG2  THR  16          HG23      THR  16   4.968  -6.163   3.007
  123    H    LYS  17           HN       LYS  17   2.290  -5.776   7.392
  124    HA   LYS  17           HA       LYS  17   3.188  -7.783   9.212
  125   1HB   LYS  17          HB2       LYS  17   3.079  -5.605  10.141
  126   2HB   LYS  17          HB1       LYS  17   1.431  -5.348   9.567
  127   1HG   LYS  17          HG2       LYS  17   0.491  -6.701  11.240
  128   2HG   LYS  17          HG1       LYS  17   1.990  -7.583  11.513
  129   1HD   LYS  17          HD2       LYS  17   2.979  -5.522  12.504
  130   2HD   LYS  17          HD1       LYS  17   1.418  -4.717  12.314
  131   1HE   LYS  17          HE2       LYS  17   0.343  -6.244  13.814
  132   2HE   LYS  17          HE1       LYS  17   1.735  -7.328  13.819
  133   1HZ   LYS  17          HZ1       LYS  17   2.931  -5.934  15.161
  134   2HZ   LYS  17          HZ2       LYS  17   1.365  -5.638  15.748
  135   3HZ   LYS  17          HZ3       LYS  17   2.095  -4.540  14.675
  136    H    LEU  18           HN       LEU  18   0.149  -7.035   7.690
  137    HA   LEU  18           HA       LEU  18  -1.489  -8.895   9.219
  138   1HB   LEU  18          HB2       LEU  18  -1.845  -7.533   6.529
  139   2HB   LEU  18          HB1       LEU  18  -3.056  -8.552   7.234
  140    HG   LEU  18           HG       LEU  18  -2.620  -5.733   7.672
  141   1HD1  LEU  18          HD11      LEU  18  -4.576  -7.620   8.989
  142   2HD1  LEU  18          HD12      LEU  18  -4.803  -6.837   7.427
  143   3HD1  LEU  18          HD13      LEU  18  -4.725  -5.872   8.903
  144   1HD2  LEU  18          HD21      LEU  18  -2.566  -5.514  10.065
  145   2HD2  LEU  18          HD22      LEU  18  -1.160  -6.455   9.612
  146   3HD2  LEU  18          HD23      LEU  18  -2.573  -7.254  10.300
  147    H    ILE  19           HN       ILE  19   0.455  -9.045   6.314
  148    HA   ILE  19           HA       ILE  19  -0.369 -11.731   5.577
  149    HB   ILE  19           HB       ILE  19   2.105 -10.100   4.856
  150   1HG1  ILE  19          HG12      ILE  19  -0.431 -10.739   3.302
  151   2HG1  ILE  19          HG11      ILE  19  -0.082  -9.201   4.061
  152   1HG2  ILE  19          HG21      ILE  19   2.578 -12.491   4.609
  153   2HG2  ILE  19          HG22      ILE  19   2.388 -11.757   3.022
  154   3HG2  ILE  19          HG23      ILE  19   1.078 -12.717   3.710
  155   1HD1  ILE  19          HD11      ILE  19   1.261 -10.464   1.689
  156   2HD1  ILE  19          HD12      ILE  19   2.100  -9.240   2.642
  157   3HD1  ILE  19          HD13      ILE  19   0.581  -8.846   1.841
  158    H    ASP  20           HN       ASP  20   2.044 -10.228   7.614
  159    HA   ASP  20           HA       ASP  20   3.536 -12.669   8.135
  160   1HB   ASP  20          HB2       ASP  20   3.482 -10.103   9.744
  161   2HB   ASP  20          HB1       ASP  20   4.738 -11.341   9.761
  162    H    ASN  21           HN       ASN  21   0.673 -11.163   9.518
  163    HA   ASN  21           HA       ASN  21   0.926 -12.847  11.928
  164   1HB   ASN  21          HB2       ASN  21  -0.015 -10.522  12.144
  165   2HB   ASN  21          HB1       ASN  21  -1.380 -11.015  11.140
  166   1HD2  ASN  21          HD21      ASN  21  -0.210 -13.540  13.173
  167   2HD2  ASN  21          HD22      ASN  21  -1.400 -13.425  14.378
  168    H    ASN  22           HN       ASN  22   0.118 -13.509   8.891
  169    HA   ASN  22           HA       ASN  22  -0.724 -15.521   8.039
  170   1HB   ASN  22          HB2       ASN  22  -1.921 -16.279  10.691
  171   2HB   ASN  22          HB1       ASN  22  -1.250 -17.303   9.428
  172   1HD2  ASN  22          HD21      ASN  22   1.245 -16.263   8.936
  173   2HD2  ASN  22          HD22      ASN  22   2.191 -16.268  10.346
  174    H    LYS  23           HN       LYS  23  -2.395 -13.135   7.866
  175    HA   LYS  23           HA       LYS  23  -5.137 -14.140   8.424
  176   1HB   LYS  23          HB2       LYS  23  -4.508 -11.531   7.165
  177   2HB   LYS  23          HB1       LYS  23  -5.918 -11.970   8.113
  178   1HG   LYS  23          HG2       LYS  23  -3.733 -12.394   9.860
  179   2HG   LYS  23          HG1       LYS  23  -3.339 -10.896   9.030
  180   1HD   LYS  23          HD2       LYS  23  -5.469  -9.908   9.746
  181   2HD   LYS  23          HD1       LYS  23  -5.959 -11.447  10.461
  182   1HE   LYS  23          HE2       LYS  23  -5.107 -10.000  12.215
  183   2HE   LYS  23          HE1       LYS  23  -3.979 -11.333  11.968
  184   1HZ   LYS  23          HZ1       LYS  23  -3.083  -9.497  10.222
  185   2HZ   LYS  23          HZ2       LYS  23  -2.470  -9.714  11.791
  186   3HZ   LYS  23          HZ3       LYS  23  -3.628  -8.509  11.489
  187    H    THR  24           HN       THR  24  -6.661 -14.416   6.683
  188    HA   THR  24           HA       THR  24  -5.478 -15.307   4.155
  189    HB   THR  24           HB       THR  24  -7.522 -16.310   3.743
  190    HG1  THR  24           HG1      THR  24  -9.413 -15.311   4.049
  191   1HG2  THR  24          HG21      THR  24  -6.741 -16.899   6.079
  192   2HG2  THR  24          HG22      THR  24  -8.463 -17.138   5.781
  193   3HG2  THR  24          HG23      THR  24  -7.912 -15.727   6.681
  194    H    GLU  25           HN       GLU  25  -6.295 -14.562   2.062
  195    HA   GLU  25           HA       GLU  25  -5.975 -11.772   1.648
  196   1HB   GLU  25          HB2       GLU  25  -5.924 -13.669  -0.102
  197   2HB   GLU  25          HB1       GLU  25  -7.685 -13.559  -0.114
  198   1HG   GLU  25          HG2       GLU  25  -7.304 -11.020  -0.535
  199   2HG   GLU  25          HG1       GLU  25  -5.661 -11.496  -0.972
  200    H    LYS  26           HN       LYS  26  -8.937 -13.712   1.988
  201    HA   LYS  26           HA       LYS  26 -10.861 -11.687   1.635
  202   1HB   LYS  26          HB2       LYS  26 -11.426 -14.074   1.813
  203   2HB   LYS  26          HB1       LYS  26 -10.983 -14.048   3.519
  204   1HG   LYS  26          HG2       LYS  26 -12.773 -12.573   4.068
  205   2HG   LYS  26          HG1       LYS  26 -13.070 -12.186   2.374
  206   1HD   LYS  26          HD2       LYS  26 -13.707 -14.580   1.992
  207   2HD   LYS  26          HD1       LYS  26 -13.543 -14.859   3.726
  208   1HE   LYS  26          HE2       LYS  26 -15.526 -13.075   2.305
  209   2HE   LYS  26          HE1       LYS  26 -15.857 -14.423   3.394
  210   1HZ   LYS  26          HZ1       LYS  26 -16.062 -12.805   4.909
  211   2HZ   LYS  26          HZ2       LYS  26 -15.174 -11.678   4.001
  212   3HZ   LYS  26          HZ3       LYS  26 -14.367 -12.837   4.945
  213    H    GLU  27           HN       GLU  27  -8.912 -12.384   4.492
  214    HA   GLU  27           HA       GLU  27 -10.486 -10.631   6.207
  215   1HB   GLU  27          HB2       GLU  27  -7.757 -11.894   6.502
  216   2HB   GLU  27          HB1       GLU  27  -8.438 -10.810   7.711
  217   1HG   GLU  27          HG2       GLU  27 -10.346 -12.277   8.020
  218   2HG   GLU  27          HG1       GLU  27  -9.774 -13.336   6.733
  219    H    ILE  28           HN       ILE  28  -7.549 -10.233   4.237
  220    HA   ILE  28           HA       ILE  28  -6.845  -7.666   5.299
  221    HB   ILE  28           HB       ILE  28  -6.308  -8.604   2.469
  222   1HG1  ILE  28          HG12      ILE  28  -5.497  -9.774   5.068
  223   2HG1  ILE  28          HG11      ILE  28  -5.639 -10.544   3.518
  224   1HG2  ILE  28          HG21      ILE  28  -4.235  -7.380   2.722
  225   2HG2  ILE  28          HG22      ILE  28  -4.579  -7.064   4.422
  226   3HG2  ILE  28          HG23      ILE  28  -5.569  -6.324   3.168
  227   1HD1  ILE  28          HD11      ILE  28  -3.328 -10.598   4.217
  228   2HD1  ILE  28          HD12      ILE  28  -3.326  -8.859   4.502
  229   3HD1  ILE  28          HD13      ILE  28  -3.464  -9.481   2.856
  230    H    LEU  29           HN       LEU  29  -8.938  -8.655   2.600
  231    HA   LEU  29           HA       LEU  29  -9.500  -5.941   1.785
  232   1HB   LEU  29          HB2       LEU  29 -11.144  -8.446   1.320
  233   2HB   LEU  29          HB1       LEU  29 -11.190  -6.957   0.370
  234    HG   LEU  29           HG       LEU  29  -8.750  -8.747   0.684
  235   1HD1  LEU  29          HD11      LEU  29 -10.780  -8.421  -1.551
  236   2HD1  LEU  29          HD12      LEU  29 -10.390  -9.894  -0.667
  237   3HD1  LEU  29          HD13      LEU  29  -9.213  -9.195  -1.777
  238   1HD2  LEU  29          HD21      LEU  29  -7.915  -6.589   0.230
  239   2HD2  LEU  29          HD22      LEU  29  -9.303  -6.149  -0.766
  240   3HD2  LEU  29          HD23      LEU  29  -8.089  -7.265  -1.388
  241    H    ASP  30           HN       ASP  30 -10.869  -8.157   4.122
  242    HA   ASP  30           HA       ASP  30 -13.326  -6.679   4.599
  243   1HB   ASP  30          HB2       ASP  30 -12.929  -9.066   5.318
  244   2HB   ASP  30          HB1       ASP  30 -11.821  -8.455   6.548
  245    H    ALA  31           HN       ALA  31 -10.132  -6.686   6.186
  246    HA   ALA  31           HA       ALA  31 -10.806  -4.709   8.152
  247   1HB   ALA  31          HB1       ALA  31  -8.043  -5.215   7.036
  248   2HB   ALA  31          HB2       ALA  31  -8.831  -6.322   8.157
  249   3HB   ALA  31          HB3       ALA  31  -8.476  -4.671   8.658
  250    H    PHE  32           HN       PHE  32  -9.885  -4.409   4.777
  251    HA   PHE  32           HA       PHE  32  -8.873  -1.759   4.699
  252   1HB   PHE  32          HB2       PHE  32 -10.556  -3.417   2.838
  253   2HB   PHE  32          HB1       PHE  32 -10.187  -1.754   2.434
  254    HD1  PHE  32           HD1      PHE  32  -9.113  -2.811   0.404
  255    HD2  PHE  32           HD2      PHE  32  -7.537  -3.430   4.371
  256    HE1  PHE  32           HE1      PHE  32  -6.926  -3.470  -0.549
  257    HE2  PHE  32           HE2      PHE  32  -5.368  -4.057   3.404
  258    HZ   PHE  32           HZ       PHE  32  -5.057  -4.095   0.948
  259    H    ASP  33           HN       ASP  33 -11.894  -2.848   5.834
  260    HA   ASP  33           HA       ASP  33 -13.398  -0.446   5.077
  261   1HB   ASP  33          HB2       ASP  33 -14.084  -2.702   6.982
  262   2HB   ASP  33          HB1       ASP  33 -15.202  -1.455   6.429
  263    H    LYS  34           HN       LYS  34 -11.343  -1.372   7.719
  264    HA   LYS  34           HA       LYS  34 -12.121   1.153   9.129
  265   1HB   LYS  34          HB2       LYS  34 -11.781   0.038  11.291
  266   2HB   LYS  34          HB1       LYS  34 -13.062  -0.754  10.379
  267   1HG   LYS  34          HG2       LYS  34 -11.449  -2.479   9.628
  268   2HG   LYS  34          HG1       LYS  34 -10.186  -1.694  10.579
  269   1HD   LYS  34          HD2       LYS  34 -11.708  -1.970  12.603
  270   2HD   LYS  34          HD1       LYS  34 -12.712  -3.013  11.598
  271   1HE   LYS  34          HE2       LYS  34 -10.904  -4.570  11.275
  272   2HE   LYS  34          HE1       LYS  34  -9.748  -3.472  12.027
  273   1HZ   LYS  34          HZ1       LYS  34 -10.821  -5.402  13.384
  274   2HZ   LYS  34          HZ2       LYS  34 -12.110  -4.308  13.553
  275   3HZ   LYS  34          HZ3       LYS  34 -10.558  -3.890  14.105
  276    H    MET  35           HN       MET  35  -9.808  -0.109   7.329
  277    HA   MET  35           HA       MET  35  -7.498   0.288   9.088
  278   1HB   MET  35          HB2       MET  35  -7.911  -1.044   6.687
  279   2HB   MET  35          HB1       MET  35  -6.944   0.328   6.178
  280   1HG   MET  35          HG2       MET  35  -5.408  -0.289   8.153
  281   2HG   MET  35          HG1       MET  35  -6.269  -1.825   8.171
  282   1HE   MET  35          HE1       MET  35  -4.843  -3.622   7.398
  283   2HE   MET  35          HE2       MET  35  -4.638  -3.895   5.670
  284   3HE   MET  35          HE3       MET  35  -6.247  -3.588   6.324
  285    H    CYS  36           HN       CYS  36  -9.088   2.196   6.438
  286    HA   CYS  36           HA       CYS  36  -7.114   4.266   6.627
  287   1HB   CYS  36          HB2       CYS  36  -9.024   3.966   4.820
  288   2HB   CYS  36          HB1       CYS  36  -9.984   4.921   5.942
  289    H    SER  37           HN       SER  37  -9.126   3.072   8.888
  290    HA   SER  37           HA       SER  37  -9.977   5.583  10.138
  291   1HB   SER  37          HB2       SER  37 -11.094   3.274  10.368
  292   2HB   SER  37          HB1       SER  37  -9.814   2.905  11.521
  293    HG   SER  37           HG       SER  37 -10.464   4.816  12.658
  294    H    LYS  38           HN       LYS  38  -6.958   4.051   9.980
  295    HA   LYS  38           HA       LYS  38  -6.145   4.979  12.702
  296   1HB   LYS  38          HB2       LYS  38  -4.927   3.112  10.673
  297   2HB   LYS  38          HB1       LYS  38  -3.925   3.815  11.942
  298   1HG   LYS  38          HG2       LYS  38  -4.776   1.653  12.680
  299   2HG   LYS  38          HG1       LYS  38  -5.515   2.931  13.642
  300   1HD   LYS  38          HD2       LYS  38  -7.576   2.770  12.484
  301   2HD   LYS  38          HD1       LYS  38  -6.857   1.854  11.159
  302   1HE   LYS  38          HE2       LYS  38  -8.235   0.492  12.816
  303   2HE   LYS  38          HE1       LYS  38  -6.597  -0.093  12.525
  304   1HZ   LYS  38          HZ1       LYS  38  -6.615   1.830  14.604
  305   2HZ   LYS  38          HZ2       LYS  38  -6.090   0.214  14.644
  306   3HZ   LYS  38          HZ3       LYS  38  -7.718   0.589  14.953
  307    H    LEU  39           HN       LEU  39  -6.309   6.312   9.660
  308    HA   LEU  39           HA       LEU  39  -3.801   7.919   9.988
  309   1HB   LEU  39          HB2       LEU  39  -5.685   7.749   7.625
  310   2HB   LEU  39          HB1       LEU  39  -4.134   8.581   7.657
  311    HG   LEU  39           HG       LEU  39  -4.508   5.604   8.091
  312   1HD1  LEU  39          HD11      LEU  39  -3.781   5.267   5.870
  313   2HD1  LEU  39          HD12      LEU  39  -3.216   6.926   5.714
  314   3HD1  LEU  39          HD13      LEU  39  -4.943   6.586   5.747
  315   1HD2  LEU  39          HD21      LEU  39  -2.503   6.174   9.209
  316   2HD2  LEU  39          HD22      LEU  39  -2.105   7.432   8.045
  317   3HD2  LEU  39          HD23      LEU  39  -1.938   5.739   7.600
  318    HA   PRO  40           HA       PRO  40  -6.154  11.302  11.670
  319   1HB   PRO  40          HB2       PRO  40  -4.811  13.170   9.784
  320   2HB   PRO  40          HB1       PRO  40  -4.768  13.155  11.553
  321   1HG   PRO  40          HG2       PRO  40  -2.697  12.271   9.816
  322   2HG   PRO  40          HG1       PRO  40  -2.776  12.015  11.565
  323   1HD   PRO  40          HD2       PRO  40  -3.046  10.039   9.486
  324   2HD   PRO  40          HD1       PRO  40  -3.142   9.781  11.237
  325    H    LYS  41           HN       LYS  41  -7.934  12.777  10.949
  326    HA   LYS  41           HA       LYS  41  -9.447  11.635   8.785
  327   1HB   LYS  41          HB2       LYS  41 -10.419  12.866  10.783
  328   2HB   LYS  41          HB1       LYS  41  -9.907  14.364  10.004
  329   1HG   LYS  41          HG2       LYS  41 -11.296  13.932   8.083
  330   2HG   LYS  41          HG1       LYS  41 -11.661  12.299   8.639
  331   1HD   LYS  41          HD2       LYS  41 -12.777  13.266  10.647
  332   2HD   LYS  41          HD1       LYS  41 -12.485  14.882  10.001
  333   1HE   LYS  41          HE2       LYS  41 -14.782  13.999   9.489
  334   2HE   LYS  41          HE1       LYS  41 -13.848  14.414   8.052
  335   1HZ   LYS  41          HZ1       LYS  41 -15.075  12.087   8.362
  336   2HZ   LYS  41          HZ2       LYS  41 -13.565  11.691   9.030
  337   3HZ   LYS  41          HZ3       LYS  41 -13.667  12.270   7.436
  338    H    SER  42           HN       SER  42  -7.095  14.161   8.768
  339    HA   SER  42           HA       SER  42  -8.118  15.417   6.387
  340   1HB   SER  42          HB2       SER  42  -5.349  15.575   7.596
  341   2HB   SER  42          HB1       SER  42  -6.006  16.671   6.384
  342    HG   SER  42           HG       SER  42  -7.478  16.238   8.718
  343    H    LEU  43           HN       LEU  43  -6.613  12.539   6.772
  344    HA   LEU  43           HA       LEU  43  -5.413  12.536   4.049
  345   1HB   LEU  43          HB2       LEU  43  -4.447  11.780   6.638
  346   2HB   LEU  43          HB1       LEU  43  -4.688  10.272   5.770
  347    HG   LEU  43           HG       LEU  43  -3.263  10.987   4.026
  348   1HD1  LEU  43          HD11      LEU  43  -1.955  13.323   4.708
  349   2HD1  LEU  43          HD12      LEU  43  -3.608  13.675   5.205
  350   3HD1  LEU  43          HD13      LEU  43  -3.265  13.223   3.538
  351   1HD2  LEU  43          HD21      LEU  43  -2.167  11.367   6.794
  352   2HD2  LEU  43          HD22      LEU  43  -1.114  11.442   5.384
  353   3HD2  LEU  43          HD23      LEU  43  -2.012   9.970   5.732
  354    H    SER  44           HN       SER  44  -8.020  11.626   5.849
  355    HA   SER  44           HA       SER  44  -8.765   9.045   5.413
  356   1HB   SER  44          HB2       SER  44 -10.292  10.624   6.426
  357   2HB   SER  44          HB1       SER  44 -10.456  11.506   4.909
  358    HG   SER  44           HG       SER  44 -11.137   9.287   4.108
  359    H    GLU  45           HN       GLU  45  -9.614  11.565   3.077
  360    HA   GLU  45           HA       GLU  45 -10.686  10.086   1.077
  361   1HB   GLU  45          HB2       GLU  45  -9.118  12.652   0.877
  362   2HB   GLU  45          HB1       GLU  45 -10.279  12.066  -0.317
  363   1HG   GLU  45          HG2       GLU  45 -12.070  12.108   1.375
  364   2HG   GLU  45          HG1       GLU  45 -10.921  12.669   2.588
  365    H    GLU  46           HN       GLU  46  -7.378  11.365   0.823
  366    HA   GLU  46           HA       GLU  46  -6.816  10.248  -1.708
  367   1HB   GLU  46          HB2       GLU  46  -4.452  10.498  -1.072
  368   2HB   GLU  46          HB1       GLU  46  -5.381  11.919  -0.599
  369   1HG   GLU  46          HG2       GLU  46  -5.628  10.914   1.682
  370   2HG   GLU  46          HG1       GLU  46  -4.533   9.627   1.182
  371    H    CYS  47           HN       CYS  47  -7.127   8.692   1.366
  372    HA   CYS  47           HA       CYS  47  -5.597   6.337   0.526
  373   1HB   CYS  47          HB2       CYS  47  -5.877   5.636   2.719
  374   2HB   CYS  47          HB1       CYS  47  -6.270   7.339   2.974
  375    H    GLN  48           HN       GLN  48  -9.007   7.246   0.887
  376    HA   GLN  48           HA       GLN  48 -10.174   4.776   0.216
  377   1HB   GLN  48          HB2       GLN  48 -11.496   6.747   0.912
  378   2HB   GLN  48          HB1       GLN  48 -11.119   7.540  -0.619
  379   1HG   GLN  48          HG2       GLN  48 -12.302   5.847  -1.870
  380   2HG   GLN  48          HG1       GLN  48 -12.522   4.862  -0.423
  381   1HE2  GLN  48          HE21      GLN  48 -14.486   6.403  -2.321
  382   2HE2  GLN  48          HE22      GLN  48 -15.484   7.242  -1.234
  383    H    GLU  49           HN       GLU  49  -8.894   7.306  -1.947
  384    HA   GLU  49           HA       GLU  49  -9.696   5.992  -4.365
  385   1HB   GLU  49          HB2       GLU  49  -7.634   8.104  -3.727
  386   2HB   GLU  49          HB1       GLU  49  -7.865   7.495  -5.366
  387   1HG   GLU  49          HG2       GLU  49  -9.201   9.554  -4.910
  388   2HG   GLU  49          HG1       GLU  49 -10.209   8.169  -5.329
  389    H    VAL  50           HN       VAL  50  -6.671   5.899  -2.468
  390    HA   VAL  50           HA       VAL  50  -5.269   4.269  -4.374
  391    HB   VAL  50           HB       VAL  50  -4.774   4.413  -1.392
  392   1HG1  VAL  50          HG11      VAL  50  -3.043   3.568  -3.723
  393   2HG1  VAL  50          HG12      VAL  50  -3.657   2.531  -2.436
  394   3HG1  VAL  50          HG13      VAL  50  -2.464   3.777  -2.072
  395   1HG2  VAL  50          HG21      VAL  50  -3.427   6.301  -1.746
  396   2HG2  VAL  50          HG22      VAL  50  -4.753   6.609  -2.860
  397   3HG2  VAL  50          HG23      VAL  50  -3.234   5.967  -3.467
  398    H    VAL  51           HN       VAL  51  -6.892   3.468  -1.275
  399    HA   VAL  51           HA       VAL  51  -6.498   0.687  -1.559
  400    HB   VAL  51           HB       VAL  51  -8.739   2.111  -0.070
  401   1HG1  VAL  51          HG11      VAL  51  -8.575   0.100   1.425
  402   2HG1  VAL  51          HG12      VAL  51  -7.505  -0.632   0.230
  403   3HG1  VAL  51          HG13      VAL  51  -9.177  -0.256  -0.195
  404   1HG2  VAL  51          HG21      VAL  51  -6.485   2.957   0.533
  405   2HG2  VAL  51          HG22      VAL  51  -5.978   1.306   0.889
  406   3HG2  VAL  51          HG23      VAL  51  -7.227   2.074   1.869
  407    H    ASP  52           HN       ASP  52  -9.382   2.587  -2.355
  408    HA   ASP  52           HA       ASP  52 -10.902   0.416  -3.354
  409   1HB   ASP  52          HB2       ASP  52 -11.063   3.339  -4.124
  410   2HB   ASP  52          HB1       ASP  52 -12.321   2.128  -4.375
  411    H    THR  53           HN       THR  53  -8.772   2.687  -5.111
  412    HA   THR  53           HA       THR  53  -9.355   1.355  -7.671
  413    HB   THR  53           HB       THR  53  -7.313   3.497  -7.065
  414    HG1  THR  53           HG1      THR  53  -9.057   4.844  -7.922
  415   1HG2  THR  53          HG21      THR  53  -7.542   3.982  -9.461
  416   2HG2  THR  53          HG22      THR  53  -8.727   2.684  -9.620
  417   3HG2  THR  53          HG23      THR  53  -7.052   2.305  -9.219
  418    H    TYR  54           HN       TYR  54  -6.588   1.578  -5.426
  419    HA   TYR  54           HA       TYR  54  -5.222  -0.484  -7.127
  420   1HB   TYR  54          HB2       TYR  54  -4.111   1.510  -5.164
  421   2HB   TYR  54          HB1       TYR  54  -3.155   0.274  -5.976
  422    HD1  TYR  54           HD1      TYR  54  -5.083   3.366  -6.410
  423    HD2  TYR  54           HD2      TYR  54  -2.702   0.406  -8.384
  424    HE1  TYR  54           HE1      TYR  54  -4.896   4.853  -8.366
  425    HE2  TYR  54           HE2      TYR  54  -2.508   1.888 -10.364
  426    HH   TYR  54           HH       TYR  54  -3.631   3.746 -11.386
  427    H    GLY  55           HN       GLY  55  -7.261  -1.134  -5.108
  428   1HA   GLY  55          HA2       GLY  55  -5.824  -2.191  -2.804
  429   2HA   GLY  55          HA1       GLY  55  -7.535  -2.411  -3.144
  430    H    SER  56           HN       SER  56  -7.637  -3.790  -5.495
  431    HA   SER  56           HA       SER  56  -6.773  -6.377  -4.645
  432   1HB   SER  56          HB2       SER  56  -7.451  -5.798  -7.519
  433   2HB   SER  56          HB1       SER  56  -7.800  -7.236  -6.559
  434    HG   SER  56           HG       SER  56  -8.951  -4.650  -6.281
  435    H    SER  57           HN       SER  57  -5.392  -3.932  -6.696
  436    HA   SER  57           HA       SER  57  -3.513  -5.746  -7.923
  437   1HB   SER  57          HB2       SER  57  -2.467  -3.719  -8.894
  438   2HB   SER  57          HB1       SER  57  -4.217  -3.677  -9.088
  439    HG   SER  57           HG       SER  57  -3.819  -1.747  -8.229
  440    H    ILE  58           HN       ILE  58  -3.154  -3.314  -5.329
  441    HA   ILE  58           HA       ILE  58  -0.367  -3.734  -4.841
  442    HB   ILE  58           HB       ILE  58  -2.665  -3.006  -3.003
  443   1HG1  ILE  58          HG12      ILE  58  -0.329  -1.377  -4.055
  444   2HG1  ILE  58          HG11      ILE  58  -1.936  -1.366  -4.769
  445   1HG2  ILE  58          HG21      ILE  58  -1.120  -3.987  -1.509
  446   2HG2  ILE  58          HG22      ILE  58  -0.676  -2.285  -1.461
  447   3HG2  ILE  58          HG23      ILE  58   0.273  -3.416  -2.422
  448   1HD1  ILE  58          HD11      ILE  58  -1.076  -0.372  -2.055
  449   2HD1  ILE  58          HD12      ILE  58  -2.766  -0.753  -2.382
  450   3HD1  ILE  58          HD13      ILE  58  -1.953   0.505  -3.311
  451    H    LEU  59           HN       LEU  59  -3.184  -5.125  -3.308
  452    HA   LEU  59           HA       LEU  59  -1.881  -7.064  -1.711
  453   1HB   LEU  59          HB2       LEU  59  -4.184  -6.414  -1.322
  454   2HB   LEU  59          HB1       LEU  59  -4.664  -6.981  -2.917
  455    HG   LEU  59           HG       LEU  59  -4.200  -9.282  -2.307
  456   1HD1  LEU  59          HD11      LEU  59  -2.314  -9.193  -0.873
  457   2HD1  LEU  59          HD12      LEU  59  -3.614  -9.676   0.209
  458   3HD1  LEU  59          HD13      LEU  59  -3.063  -8.001   0.187
  459   1HD2  LEU  59          HD21      LEU  59  -5.952  -7.638  -0.489
  460   2HD2  LEU  59          HD22      LEU  59  -5.733  -9.343  -0.120
  461   3HD2  LEU  59          HD23      LEU  59  -6.400  -8.861  -1.676
  462    H    SER  60           HN       SER  60  -2.615  -7.073  -5.163
  463    HA   SER  60           HA       SER  60  -2.407  -9.947  -5.294
  464   1HB   SER  60          HB2       SER  60  -2.539  -7.777  -7.372
  465   2HB   SER  60          HB1       SER  60  -2.258  -9.448  -7.848
  466    HG   SER  60           HG       SER  60  -4.318  -9.734  -7.602
  467    H    ILE  61           HN       ILE  61  -0.269  -7.199  -5.893
  468    HA   ILE  61           HA       ILE  61   1.922  -8.650  -7.083
  469    HB   ILE  61           HB       ILE  61   2.158  -6.105  -5.466
  470   1HG1  ILE  61          HG12      ILE  61   0.525  -6.561  -7.865
  471   2HG1  ILE  61          HG11      ILE  61   0.664  -5.117  -6.871
  472   1HG2  ILE  61          HG21      ILE  61   3.643  -7.079  -7.920
  473   2HG2  ILE  61          HG22      ILE  61   4.209  -7.250  -6.261
  474   3HG2  ILE  61          HG23      ILE  61   4.013  -5.645  -6.957
  475   1HD1  ILE  61          HD11      ILE  61   2.720  -4.474  -8.102
  476   2HD1  ILE  61          HD12      ILE  61   1.312  -4.599  -9.155
  477   3HD1  ILE  61          HD13      ILE  61   2.515  -5.884  -9.144
  478    H    LEU  62           HN       LEU  62   1.282  -7.562  -3.750
  479    HA   LEU  62           HA       LEU  62   3.654  -8.288  -2.521
  480   1HB   LEU  62          HB2       LEU  62   0.789  -8.338  -1.606
  481   2HB   LEU  62          HB1       LEU  62   2.050  -8.908  -0.517
  482    HG   LEU  62           HG       LEU  62   2.623  -6.293  -1.854
  483   1HD1  LEU  62          HD11      LEU  62   0.330  -6.681   0.053
  484   2HD1  LEU  62          HD12      LEU  62   0.355  -5.786  -1.460
  485   3HD1  LEU  62          HD13      LEU  62   1.187  -5.144  -0.044
  486   1HD2  LEU  62          HD21      LEU  62   3.372  -5.744   0.454
  487   2HD2  LEU  62          HD22      LEU  62   4.119  -7.225  -0.145
  488   3HD2  LEU  62          HD23      LEU  62   2.786  -7.309   1.005
  489    H    LEU  63           HN       LEU  63   1.013 -10.438  -3.519
  490    HA   LEU  63           HA       LEU  63   2.156 -12.773  -2.195
  491   1HB   LEU  63          HB2       LEU  63   0.123 -12.747  -4.436
  492   2HB   LEU  63          HB1       LEU  63   0.390 -14.014  -3.240
  493    HG   LEU  63           HG       LEU  63  -0.683 -11.226  -2.726
  494   1HD1  LEU  63          HD11      LEU  63  -2.622 -12.613  -1.819
  495   2HD1  LEU  63          HD12      LEU  63  -1.860 -14.010  -2.580
  496   3HD1  LEU  63          HD13      LEU  63  -2.407 -12.657  -3.569
  497   1HD2  LEU  63          HD21      LEU  63   0.269 -13.397  -0.854
  498   2HD2  LEU  63          HD22      LEU  63  -0.956 -12.234  -0.345
  499   3HD2  LEU  63          HD23      LEU  63   0.644 -11.673  -0.823
  500    H    GLU  64           HN       GLU  64   2.929 -11.139  -5.101
  501    HA   GLU  64           HA       GLU  64   3.986 -13.583  -6.361
  502   1HB   GLU  64          HB2       GLU  64   3.931 -10.667  -7.163
  503   2HB   GLU  64          HB1       GLU  64   4.915 -11.838  -8.042
  504   1HG   GLU  64          HG2       GLU  64   2.841 -13.229  -8.354
  505   2HG   GLU  64          HG1       GLU  64   1.916 -11.897  -7.661
  506    H    GLU  65           HN       GLU  65   4.929 -12.740  -3.774
  507    HA   GLU  65           HA       GLU  65   6.992 -12.552  -2.589
  508   1HB   GLU  65          HB2       GLU  65   7.850 -13.860  -5.165
  509   2HB   GLU  65          HB1       GLU  65   8.822 -13.784  -3.696
  510   1HG   GLU  65          HG2       GLU  65   6.031 -14.954  -3.769
  511   2HG   GLU  65          HG1       GLU  65   7.489 -15.924  -3.984
  512    H    VAL  66           HN       VAL  66   6.284 -10.229  -4.412
  513    HA   VAL  66           HA       VAL  66   8.937  -9.290  -5.364
  514    HB   VAL  66           HB       VAL  66   6.082  -8.429  -5.665
  515   1HG1  VAL  66          HG11      VAL  66   8.457  -6.567  -5.849
  516   2HG1  VAL  66          HG12      VAL  66   6.957  -6.326  -4.953
  517   3HG1  VAL  66          HG13      VAL  66   6.951  -6.262  -6.715
  518   1HG2  VAL  66          HG21      VAL  66   7.488  -9.830  -7.316
  519   2HG2  VAL  66          HG22      VAL  66   8.321  -8.323  -7.687
  520   3HG2  VAL  66          HG23      VAL  66   6.589  -8.465  -7.979
  521    H    SER  67           HN       SER  67  10.019  -7.523  -4.341
  522    HA   SER  67           HA       SER  67   9.811  -7.293  -1.558
  523   1HB   SER  67          HB2       SER  67  10.800  -4.959  -3.168
  524   2HB   SER  67          HB1       SER  67  11.459  -5.642  -1.685
  525    HG   SER  67           HG       SER  67  11.347  -7.182  -4.036
  526    HA   PRO  68           HA       PRO  68   6.225  -4.765  -0.955
  527   1HB   PRO  68          HB2       PRO  68   7.192  -3.280   1.307
  528   2HB   PRO  68          HB1       PRO  68   6.213  -4.743   1.328
  529   1HG   PRO  68          HG2       PRO  68   9.043  -4.462   1.973
  530   2HG   PRO  68          HG1       PRO  68   7.990  -5.869   2.198
  531   1HD   PRO  68          HD2       PRO  68  10.041  -5.565   0.218
  532   2HD   PRO  68          HD1       PRO  68   8.860  -6.885   0.361
  533    H    GLU  69           HN       GLU  69   9.340  -2.937  -0.772
  534    HA   GLU  69           HA       GLU  69   7.966  -0.430  -1.348
  535   1HB   GLU  69          HB2       GLU  69  10.285   0.499  -1.608
  536   2HB   GLU  69          HB1       GLU  69   9.990  -0.294  -0.066
  537   1HG   GLU  69          HG2       GLU  69  12.090  -1.131  -0.712
  538   2HG   GLU  69          HG1       GLU  69  10.984  -2.410  -1.194
  539    H    LEU  70           HN       LEU  70   9.102  -2.997  -3.317
  540    HA   LEU  70           HA       LEU  70   9.607  -1.354  -5.652
  541   1HB   LEU  70          HB2       LEU  70   9.086  -4.319  -5.286
  542   2HB   LEU  70          HB1       LEU  70   9.237  -3.624  -6.885
  543    HG   LEU  70           HG       LEU  70  11.311  -3.299  -4.744
  544   1HD1  LEU  70          HD11      LEU  70  12.569  -5.085  -5.758
  545   2HD1  LEU  70          HD12      LEU  70  11.403  -5.223  -7.071
  546   3HD1  LEU  70          HD13      LEU  70  10.949  -5.702  -5.437
  547   1HD2  LEU  70          HD21      LEU  70  12.713  -2.950  -6.970
  548   2HD2  LEU  70          HD22      LEU  70  11.796  -1.619  -6.276
  549   3HD2  LEU  70          HD23      LEU  70  11.139  -2.526  -7.632
  550    H    VAL  71           HN       VAL  71   6.861  -2.352  -3.959
  551    HA   VAL  71           HA       VAL  71   4.963  -2.439  -6.091
  552    HB   VAL  71           HB       VAL  71   4.749  -1.984  -3.113
  553   1HG1  VAL  71          HG11      VAL  71   2.512  -1.646  -5.114
  554   2HG1  VAL  71          HG12      VAL  71   2.954  -0.573  -3.786
  555   3HG1  VAL  71          HG13      VAL  71   2.198  -2.123  -3.444
  556   1HG2  VAL  71          HG21      VAL  71   5.059  -4.267  -3.833
  557   2HG2  VAL  71          HG22      VAL  71   3.753  -4.119  -5.010
  558   3HG2  VAL  71          HG23      VAL  71   3.394  -4.087  -3.284
  559    H    CYS  72           HN       CYS  72   5.634   0.326  -3.848
  560    HA   CYS  72           HA       CYS  72   3.860   2.005  -5.227
  561   1HB   CYS  72          HB2       CYS  72   6.378   2.888  -3.756
  562   2HB   CYS  72          HB1       CYS  72   4.950   3.864  -4.067
  563    H    SER  73           HN       SER  73   7.175   1.101  -5.889
  564    HA   SER  73           HA       SER  73   7.635   3.211  -7.880
  565   1HB   SER  73          HB2       SER  73   9.421   1.902  -6.523
  566   2HB   SER  73          HB1       SER  73   9.205   0.640  -7.735
  567    HG   SER  73           HG       SER  73   9.452   3.164  -8.778
  568    H    MET  74           HN       MET  74   6.663  -0.226  -8.102
  569    HA   MET  74           HA       MET  74   6.738  -0.252 -11.020
  570   1HB   MET  74          HB2       MET  74   5.864  -2.104  -8.868
  571   2HB   MET  74          HB1       MET  74   5.002  -2.281 -10.394
  572   1HG   MET  74          HG2       MET  74   7.373  -2.340 -11.473
  573   2HG   MET  74          HG1       MET  74   7.940  -2.656  -9.838
  574   1HE   MET  74          HE1       MET  74   5.630  -5.752  -8.926
  575   2HE   MET  74          HE2       MET  74   4.832  -4.195  -9.116
  576   3HE   MET  74          HE3       MET  74   6.396  -4.284  -8.311
  577    H    LEU  75           HN       LEU  75   4.102   0.312  -8.657
  578    HA   LEU  75           HA       LEU  75   2.109   0.501 -10.758
  579   1HB   LEU  75          HB2       LEU  75   1.967   1.647  -7.953
  580   2HB   LEU  75          HB1       LEU  75   0.608   1.311  -9.022
  581    HG   LEU  75           HG       LEU  75   2.468  -0.704  -7.741
  582   1HD1  LEU  75          HD11      LEU  75   0.754  -0.023  -6.228
  583   2HD1  LEU  75          HD12      LEU  75   0.251  -1.581  -6.882
  584   3HD1  LEU  75          HD13      LEU  75  -0.476  -0.096  -7.491
  585   1HD2  LEU  75          HD21      LEU  75   0.486  -0.993  -9.994
  586   2HD2  LEU  75          HD22      LEU  75   0.809  -2.346  -8.912
  587   3HD2  LEU  75          HD23      LEU  75   2.117  -1.654  -9.868
  588    H    HIS  76           HN       HIS  76   4.645   2.338 -10.640
  589    HA   HIS  76           HA       HIS  76   5.144   4.585 -11.135
  590   1HB   HIS  76          HB2       HIS  76   2.486   4.336 -12.587
  591   2HB   HIS  76          HB1       HIS  76   3.708   5.572 -12.885
  592    HD1  HIS  76           HD1      HIS  76   6.251   3.849 -12.816
  593    HD2  HIS  76           HD2      HIS  76   2.781   2.735 -14.839
  594    HE1  HIS  76           HE1      HIS  76   6.961   2.190 -14.594
  595    H    LEU  77           HN       LEU  77   3.343   3.963  -8.710
  596    HA   LEU  77           HA       LEU  77   1.686   6.374  -8.523
  597   1HB   LEU  77          HB2       LEU  77   1.729   3.832  -7.256
  598   2HB   LEU  77          HB1       LEU  77   2.107   4.977  -5.986
  599    HG   LEU  77           HG       LEU  77   0.084   6.187  -6.387
  600   1HD1  LEU  77          HD11      LEU  77  -0.631   6.283  -8.548
  601   2HD1  LEU  77          HD12      LEU  77  -1.543   4.833  -8.144
  602   3HD1  LEU  77          HD13      LEU  77   0.025   4.697  -8.936
  603   1HD2  LEU  77          HD21      LEU  77   0.098   3.950  -5.096
  604   2HD2  LEU  77          HD22      LEU  77  -0.768   3.311  -6.489
  605   3HD2  LEU  77          HD23      LEU  77  -1.464   4.623  -5.553
  606    H    CYS  78           HN       CYS  78   4.961   5.559  -7.979
  607    HA   CYS  78           HA       CYS  78   5.321   8.128  -6.468
  608   1HB   CYS  78          HB2       CYS  78   6.657   5.445  -6.042
  609   2HB   CYS  78          HB1       CYS  78   7.440   6.937  -5.526
  610    H    SER  79           HN       SER  79   7.521   8.867  -6.600
  611    HA   SER  79           HA       SER  79   9.315   9.663  -7.632
  612   1HB   SER  79          HB2       SER  79  10.505   8.419  -9.296
  613   2HB   SER  79          HB1       SER  79   9.641   7.188  -8.380
  614    HG   SER  79           HG       SER  79   7.953   7.936 -10.178
  615    H    GLY  80           HN       GLY  80   6.736  10.708  -8.049
  616   1HA   GLY  80          HA2       GLY  80   6.335  11.333 -10.862
  617   2HA   GLY  80          HA1       GLY  80   5.485  12.077  -9.507
  618    H    LEU  81           HN       LEU  81   5.761  14.245  -9.993
  619    HA   LEU  81           HA       LEU  81   8.311  15.308 -10.914
  620   1HB   LEU  81          HB2       LEU  81   5.700  16.543 -10.025
  621   2HB   LEU  81          HB1       LEU  81   7.110  17.543 -10.369
  622    HG   LEU  81           HG       LEU  81   7.249  16.549 -12.634
  623   1HD1  LEU  81          HD11      LEU  81   6.303  14.391 -12.399
  624   2HD1  LEU  81          HD12      LEU  81   5.117  15.274 -13.357
  625   3HD1  LEU  81          HD13      LEU  81   4.844  15.019 -11.633
  626   1HD2  LEU  81          HD21      LEU  81   5.966  18.623 -12.294
  627   2HD2  LEU  81          HD22      LEU  81   4.525  17.680 -11.912
  628   3HD2  LEU  81          HD23      LEU  81   5.207  17.631 -13.538
  629    H    VAL  82           HN       VAL  82   9.018  13.958  -8.714
  630    HA   VAL  82           HA       VAL  82   9.602  16.109  -6.716
  631    HB   VAL  82           HB       VAL  82   7.924  14.943  -5.587
  632   1HG1  VAL  82          HG11      VAL  82   7.777  12.442  -5.593
  633   2HG1  VAL  82          HG12      VAL  82   9.085  12.407  -6.773
  634   3HG1  VAL  82          HG13      VAL  82   7.548  13.166  -7.183
  635   1HG2  VAL  82          HG21      VAL  82   8.988  13.950  -3.744
  636   2HG2  VAL  82          HG22      VAL  82  10.269  14.946  -4.430
  637   3HG2  VAL  82          HG23      VAL  82  10.244  13.210  -4.735
  638    HA   PRO  83           HA       PRO  83  13.506  14.087  -8.054
  639   1HB   PRO  83          HB2       PRO  83  15.036  16.297  -6.992
  640   2HB   PRO  83          HB1       PRO  83  14.704  15.933  -8.688
  641   1HG   PRO  83          HG2       PRO  83  13.600  18.087  -7.111
  642   2HG   PRO  83          HG1       PRO  83  13.261  17.704  -8.805
  643   1HD   PRO  83          HD2       PRO  83  11.553  17.268  -6.484
  644   2HD   PRO  83          HD1       PRO  83  11.165  17.005  -8.198
  645    H    ARG  84           HN       ARG  84  12.497  12.852  -6.022
  646    HA   ARG  84           HA       ARG  84  14.651  12.564  -4.102
  647   1HB   ARG  84          HB2       ARG  84  13.305  14.607  -3.301
  648   2HB   ARG  84          HB1       ARG  84  12.008  13.473  -2.941
  649   1HG   ARG  84          HG2       ARG  84  14.833  13.208  -1.873
  650   2HG   ARG  84          HG1       ARG  84  13.523  13.972  -0.981
  651   1HD   ARG  84          HD2       ARG  84  12.287  11.656  -1.548
  652   2HD   ARG  84          HD1       ARG  84  13.946  11.072  -1.611
  653    HE   ARG  84           HE       ARG  84  12.470  11.569   0.753
  654   1HH1  ARG  84          HH21      ARG  84  15.548  12.344  -0.611
  655   2HH1  ARG  84          HH22      ARG  84  16.245  12.790   0.905
  656   1HH2  ARG  84          HH11      ARG  84  13.380  12.125   2.728
  657   2HH2  ARG  84          HH12      ARG  84  15.026  12.658   2.793
  Start of MODEL    4
    1   1H    SER   1          HT1       SER   1   7.404  16.725  -0.637
    2   2H    SER   1          HT2       SER   1   6.333  17.576  -1.646
    3   3H    SER   1          HT3       SER   1   6.442  15.883  -1.752
    4    HA   SER   1           HA       SER   1   5.776  15.997   0.759
    5   1HB   SER   1          HB2       SER   1   4.308  17.861   1.230
    6   2HB   SER   1          HB1       SER   1   5.849  18.518   0.688
    7    HG   SER   1           HG       SER   1   4.471  19.564  -0.581
    8    H    ASP   2           HN       ASP   2   5.389  14.716  -1.816
    9    HA   ASP   2           HA       ASP   2   2.617  14.861  -2.602
   10   1HB   ASP   2          HB2       ASP   2   3.156  13.209  -4.162
   11   2HB   ASP   2          HB1       ASP   2   4.718  13.965  -3.885
   12    H    VAL   3           HN       VAL   3   1.010  14.301  -1.271
   13    HA   VAL   3           HA       VAL   3   1.307  12.597   1.026
   14    HB   VAL   3           HB       VAL   3  -0.866  13.167   1.544
   15   1HG1  VAL   3          HG11      VAL   3  -0.324  15.288  -0.536
   16   2HG1  VAL   3          HG12      VAL   3   0.595  15.181   0.966
   17   3HG1  VAL   3          HG13      VAL   3  -1.146  15.464   1.014
   18   1HG2  VAL   3          HG21      VAL   3  -2.568  13.808  -0.253
   19   2HG2  VAL   3          HG22      VAL   3  -2.108  12.106  -0.208
   20   3HG2  VAL   3          HG23      VAL   3  -1.425  13.172  -1.437
   21    H    TYR   4           HN       TYR   4   0.709  11.789  -2.336
   22    HA   TYR   4           HA       TYR   4  -0.878   9.486  -1.675
   23   1HB   TYR   4          HB2       TYR   4   0.404  10.560  -4.173
   24   2HB   TYR   4          HB1       TYR   4  -0.071   8.872  -4.183
   25    HD1  TYR   4           HD1      TYR   4  -2.486   8.285  -3.541
   26    HD2  TYR   4           HD2      TYR   4  -1.202  12.262  -4.522
   27    HE1  TYR   4           HE1      TYR   4  -4.826   8.909  -4.041
   28    HE2  TYR   4           HE2      TYR   4  -3.550  12.898  -5.003
   29    HH   TYR   4           HH       TYR   4  -5.958  11.860  -4.106
   30    H    CYS   5           HN       CYS   5   2.550   9.830  -2.566
   31    HA   CYS   5           HA       CYS   5   3.260   7.063  -2.425
   32   1HB   CYS   5          HB2       CYS   5   4.801   9.621  -1.883
   33   2HB   CYS   5          HB1       CYS   5   5.554   8.043  -1.653
   34    H    GLU   6           HN       GLU   6   3.221   9.528   0.223
   35    HA   GLU   6           HA       GLU   6   4.198   7.846   2.254
   36   1HB   GLU   6          HB2       GLU   6   2.013   9.912   2.595
   37   2HB   GLU   6          HB1       GLU   6   3.129   9.336   3.833
   38   1HG   GLU   6          HG2       GLU   6   3.939  10.774   1.294
   39   2HG   GLU   6          HG1       GLU   6   3.841  11.518   2.891
   40    H    VAL   7           HN       VAL   7   0.882   8.177   1.036
   41    HA   VAL   7           HA       VAL   7  -0.225   6.328   2.990
   42    HB   VAL   7           HB       VAL   7  -1.227   7.402   0.330
   43   1HG1  VAL   7          HG11      VAL   7  -2.497   5.474   2.273
   44   2HG1  VAL   7          HG12      VAL   7  -2.392   5.362   0.517
   45   3HG1  VAL   7          HG13      VAL   7  -3.489   6.522   1.261
   46   1HG2  VAL   7          HG21      VAL   7  -1.639   8.152   3.222
   47   2HG2  VAL   7          HG22      VAL   7  -2.913   8.485   2.053
   48   3HG2  VAL   7          HG23      VAL   7  -1.316   9.191   1.837
   49    H    CYS   8           HN       CYS   8   1.004   5.847  -0.350
   50    HA   CYS   8           HA       CYS   8   0.130   3.156  -0.630
   51   1HB   CYS   8          HB2       CYS   8   1.545   3.088  -2.478
   52   2HB   CYS   8          HB1       CYS   8   1.304   4.821  -2.303
   53    H    GLU   9           HN       GLU   9   3.186   4.458   0.692
   54    HA   GLU   9           HA       GLU   9   4.230   1.880   1.349
   55   1HB   GLU   9          HB2       GLU   9   4.841   4.579   2.595
   56   2HB   GLU   9          HB1       GLU   9   5.823   3.125   2.773
   57   1HG   GLU   9          HG2       GLU   9   5.960   3.084   0.216
   58   2HG   GLU   9          HG1       GLU   9   5.308   4.724   0.261
   59    H    PHE  10           HN       PHE  10   1.979   4.071   3.041
   60    HA   PHE  10           HA       PHE  10   2.305   2.776   5.578
   61   1HB   PHE  10          HB2       PHE  10   1.250   4.994   5.414
   62   2HB   PHE  10          HB1       PHE  10  -0.093   4.289   4.506
   63    HD1  PHE  10           HD1      PHE  10  -1.779   2.960   5.585
   64    HD2  PHE  10           HD2      PHE  10   1.624   4.372   7.781
   65    HE1  PHE  10           HE1      PHE  10  -2.854   2.238   7.712
   66    HE2  PHE  10           HE2      PHE  10   0.556   3.667   9.907
   67    HZ   PHE  10           HZ       PHE  10  -1.683   2.602   9.870
   68    H    LEU  11           HN       LEU  11  -0.094   2.316   2.948
   69    HA   LEU  11           HA       LEU  11  -1.508   0.171   4.241
   70   1HB   LEU  11          HB2       LEU  11  -1.104   0.661   1.273
   71   2HB   LEU  11          HB1       LEU  11  -2.276  -0.463   1.975
   72    HG   LEU  11           HG       LEU  11  -2.260   2.461   2.764
   73   1HD1  LEU  11          HD11      LEU  11  -3.614   1.192   0.368
   74   2HD1  LEU  11          HD12      LEU  11  -2.446   2.512   0.354
   75   3HD1  LEU  11          HD13      LEU  11  -4.056   2.769   1.025
   76   1HD2  LEU  11          HD21      LEU  11  -3.641   1.068   4.165
   77   2HD2  LEU  11          HD22      LEU  11  -4.322   0.233   2.771
   78   3HD2  LEU  11          HD23      LEU  11  -4.726   1.920   3.071
   79    H    VAL  12           HN       VAL  12   1.318   0.136   2.001
   80    HA   VAL  12           HA       VAL  12   1.529  -2.679   1.834
   81    HB   VAL  12           HB       VAL  12   3.496  -0.389   1.624
   82   1HG1  VAL  12          HG11      VAL  12   5.105  -2.121   0.690
   83   2HG1  VAL  12          HG12      VAL  12   4.084  -3.351   1.440
   84   3HG1  VAL  12          HG13      VAL  12   4.902  -2.150   2.439
   85   1HG2  VAL  12          HG21      VAL  12   2.545  -2.433  -0.404
   86   2HG2  VAL  12          HG22      VAL  12   3.468  -0.964  -0.729
   87   3HG2  VAL  12          HG23      VAL  12   1.797  -0.851  -0.172
   88    H    LYS  13           HN       LYS  13   3.080  -0.418   4.172
   89    HA   LYS  13           HA       LYS  13   4.465  -2.403   5.661
   90   1HB   LYS  13          HB2       LYS  13   5.017  -0.111   6.058
   91   2HB   LYS  13          HB1       LYS  13   3.348   0.300   6.444
   92   1HG   LYS  13          HG2       LYS  13   3.439  -0.719   8.555
   93   2HG   LYS  13          HG1       LYS  13   4.796  -1.754   8.108
   94   1HD   LYS  13          HD2       LYS  13   5.439   0.114   9.653
   95   2HD   LYS  13          HD1       LYS  13   6.316   0.141   8.124
   96   1HE   LYS  13          HE2       LYS  13   5.394   2.386   8.897
   97   2HE   LYS  13          HE1       LYS  13   4.945   1.902   7.262
   98   1HZ   LYS  13          HZ1       LYS  13   3.134   2.747   8.869
   99   2HZ   LYS  13          HZ2       LYS  13   3.218   1.187   9.537
  100   3HZ   LYS  13          HZ3       LYS  13   2.808   1.393   7.901
  101    H    GLU  14           HN       GLU  14   1.195  -1.094   6.053
  102    HA   GLU  14           HA       GLU  14   0.587  -2.666   8.402
  103   1HB   GLU  14          HB2       GLU  14  -0.693  -0.634   6.830
  104   2HB   GLU  14          HB1       GLU  14  -1.825  -1.976   6.941
  105   1HG   GLU  14          HG2       GLU  14  -2.231  -0.537   8.825
  106   2HG   GLU  14          HG1       GLU  14  -1.428  -1.979   9.443
  107    H    VAL  15           HN       VAL  15   0.089  -3.179   4.921
  108    HA   VAL  15           HA       VAL  15  -1.508  -5.545   5.302
  109    HB   VAL  15           HB       VAL  15   0.017  -4.396   2.966
  110   1HG1  VAL  15          HG11      VAL  15   0.337  -6.641   2.411
  111   2HG1  VAL  15          HG12      VAL  15  -1.258  -6.352   1.704
  112   3HG1  VAL  15          HG13      VAL  15  -1.120  -7.168   3.257
  113   1HG2  VAL  15          HG21      VAL  15  -2.915  -5.066   3.368
  114   2HG2  VAL  15          HG22      VAL  15  -2.217  -4.139   2.040
  115   3HG2  VAL  15          HG23      VAL  15  -2.208  -3.480   3.676
  116    H    THR  16           HN       THR  16   2.041  -5.146   4.768
  117    HA   THR  16           HA       THR  16   2.441  -7.956   4.601
  118    HB   THR  16           HB       THR  16   4.703  -7.652   4.749
  119    HG1  THR  16           HG1      THR  16   4.415  -6.658   6.912
  120   1HG2  THR  16          HG21      THR  16   4.483  -4.788   4.190
  121   2HG2  THR  16          HG22      THR  16   3.326  -5.742   3.265
  122   3HG2  THR  16          HG23      THR  16   5.048  -6.084   3.144
  123    H    LYS  17           HN       LYS  17   2.310  -5.824   7.460
  124    HA   LYS  17           HA       LYS  17   3.187  -7.840   9.280
  125   1HB   LYS  17          HB2       LYS  17   3.058  -5.662  10.214
  126   2HB   LYS  17          HB1       LYS  17   1.410  -5.416   9.634
  127   1HG   LYS  17          HG2       LYS  17   0.475  -6.781  11.298
  128   2HG   LYS  17          HG1       LYS  17   1.972  -7.668  11.559
  129   1HD   LYS  17          HD2       LYS  17   2.962  -5.610  12.568
  130   2HD   LYS  17          HD1       LYS  17   1.393  -4.817  12.402
  131   1HE   LYS  17          HE2       LYS  17   0.343  -6.374  13.888
  132   2HE   LYS  17          HE1       LYS  17   1.741  -7.450  13.863
  133   1HZ   LYS  17          HZ1       LYS  17   1.282  -5.054  15.406
  134   2HZ   LYS  17          HZ2       LYS  17   2.817  -5.122  14.680
  135   3HZ   LYS  17          HZ3       LYS  17   2.310  -6.366  15.719
  136    H    LEU  18           HN       LEU  18   0.163  -7.089   7.725
  137    HA   LEU  18           HA       LEU  18  -1.484  -8.951   9.232
  138   1HB   LEU  18          HB2       LEU  18  -1.831  -7.573   6.551
  139   2HB   LEU  18          HB1       LEU  18  -3.044  -8.596   7.245
  140    HG   LEU  18           HG       LEU  18  -2.597  -5.780   7.714
  141   1HD1  LEU  18          HD11      LEU  18  -4.727  -5.912   8.888
  142   2HD1  LEU  18          HD12      LEU  18  -4.589  -7.659   8.989
  143   3HD1  LEU  18          HD13      LEU  18  -4.782  -6.885   7.416
  144   1HD2  LEU  18          HD21      LEU  18  -1.176  -6.540   9.667
  145   2HD2  LEU  18          HD22      LEU  18  -2.606  -7.337  10.321
  146   3HD2  LEU  18          HD23      LEU  18  -2.585  -5.594  10.110
  147    H    ILE  19           HN       ILE  19   0.471  -9.094   6.330
  148    HA   ILE  19           HA       ILE  19  -0.371 -11.771   5.576
  149    HB   ILE  19           HB       ILE  19   2.107 -10.146   4.858
  150   1HG1  ILE  19          HG12      ILE  19  -0.423 -10.772   3.290
  151   2HG1  ILE  19          HG11      ILE  19  -0.081  -9.241   4.070
  152   1HG2  ILE  19          HG21      ILE  19   2.384 -11.791   3.014
  153   2HG2  ILE  19          HG22      ILE  19   1.079 -12.755   3.703
  154   3HG2  ILE  19          HG23      ILE  19   2.580 -12.533   4.597
  155   1HD1  ILE  19          HD11      ILE  19   2.096  -9.227   2.673
  156   2HD1  ILE  19          HD12      ILE  19   0.583  -8.889   1.836
  157   3HD1  ILE  19          HD13      ILE  19   1.319 -10.485   1.714
  158    H    ASP  20           HN       ASP  20   2.079 -10.300   7.597
  159    HA   ASP  20           HA       ASP  20   3.554 -12.755   8.096
  160   1HB   ASP  20          HB2       ASP  20   4.527 -10.449   8.288
  161   2HB   ASP  20          HB1       ASP  20   3.524 -10.198   9.718
  162    H    ASN  21           HN       ASN  21   0.701 -11.260   9.499
  163    HA   ASN  21           HA       ASN  21   0.968 -12.960  11.900
  164   1HB   ASN  21          HB2       ASN  21   0.048 -10.614  12.105
  165   2HB   ASN  21          HB1       ASN  21  -1.349 -11.130  11.159
  166   1HD2  ASN  21          HD21      ASN  21  -2.686 -12.946  12.132
  167   2HD2  ASN  21          HD22      ASN  21  -2.737 -13.102  13.821
  168    H    ASN  22           HN       ASN  22   0.113 -13.583   8.857
  169    HA   ASN  22           HA       ASN  22  -0.750 -15.585   8.001
  170   1HB   ASN  22          HB2       ASN  22  -1.939 -16.346  10.654
  171   2HB   ASN  22          HB1       ASN  22  -1.297 -17.371   9.378
  172   1HD2  ASN  22          HD21      ASN  22  -0.525 -16.805  12.393
  173   2HD2  ASN  22          HD22      ASN  22   1.163 -16.654  12.312
  174    H    LYS  23           HN       LYS  23  -2.397 -13.193   7.823
  175    HA   LYS  23           HA       LYS  23  -5.147 -14.174   8.392
  176   1HB   LYS  23          HB2       LYS  23  -4.473 -11.565   7.154
  177   2HB   LYS  23          HB1       LYS  23  -5.915 -11.997   8.056
  178   1HG   LYS  23          HG2       LYS  23  -3.762 -12.460   9.849
  179   2HG   LYS  23          HG1       LYS  23  -3.370 -10.937   9.063
  180   1HD   LYS  23          HD2       LYS  23  -5.470  -9.952   9.783
  181   2HD   LYS  23          HD1       LYS  23  -6.052 -11.519  10.355
  182   1HE   LYS  23          HE2       LYS  23  -4.134 -11.560  11.976
  183   2HE   LYS  23          HE1       LYS  23  -3.759  -9.907  11.489
  184   1HZ   LYS  23          HZ1       LYS  23  -5.497  -9.097  12.613
  185   2HZ   LYS  23          HZ2       LYS  23  -5.448 -10.566  13.464
  186   3HZ   LYS  23          HZ3       LYS  23  -6.527 -10.369  12.166
  187    H    THR  24           HN       THR  24  -6.677 -14.443   6.655
  188    HA   THR  24           HA       THR  24  -5.512 -15.319   4.110
  189    HB   THR  24           HB       THR  24  -7.554 -16.321   3.705
  190    HG1  THR  24           HG1      THR  24  -9.414 -15.289   3.919
  191   1HG2  THR  24          HG21      THR  24  -8.108 -15.759   6.607
  192   2HG2  THR  24          HG22      THR  24  -6.757 -16.788   6.128
  193   3HG2  THR  24          HG23      THR  24  -8.408 -17.233   5.692
  194    H    GLU  25           HN       GLU  25  -6.366 -14.569   2.022
  195    HA   GLU  25           HA       GLU  25  -6.026 -11.774   1.619
  196   1HB   GLU  25          HB2       GLU  25  -6.009 -13.694  -0.129
  197   2HB   GLU  25          HB1       GLU  25  -7.763 -13.512  -0.160
  198   1HG   GLU  25          HG2       GLU  25  -7.293 -10.997  -0.572
  199   2HG   GLU  25          HG1       GLU  25  -5.651 -11.513  -0.962
  200    H    LYS  26           HN       LYS  26  -8.991 -13.711   1.948
  201    HA   LYS  26           HA       LYS  26 -10.908 -11.675   1.615
  202   1HB   LYS  26          HB2       LYS  26 -11.426 -14.092   1.782
  203   2HB   LYS  26          HB1       LYS  26 -11.055 -14.039   3.501
  204   1HG   LYS  26          HG2       LYS  26 -13.027 -11.997   2.570
  205   2HG   LYS  26          HG1       LYS  26 -13.577 -13.666   2.472
  206   1HD   LYS  26          HD2       LYS  26 -12.989 -13.990   4.860
  207   2HD   LYS  26          HD1       LYS  26 -12.497 -12.301   4.959
  208   1HE   LYS  26          HE2       LYS  26 -15.262 -13.162   4.080
  209   2HE   LYS  26          HE1       LYS  26 -14.859 -12.770   5.752
  210   1HZ   LYS  26          HZ1       LYS  26 -15.772 -10.873   4.507
  211   2HZ   LYS  26          HZ2       LYS  26 -14.445 -10.944   3.449
  212   3HZ   LYS  26          HZ3       LYS  26 -14.207 -10.577   5.090
  213    H    GLU  27           HN       GLU  27  -8.943 -12.402   4.451
  214    HA   GLU  27           HA       GLU  27 -10.492 -10.646   6.187
  215   1HB   GLU  27          HB2       GLU  27  -7.772 -11.935   6.454
  216   2HB   GLU  27          HB1       GLU  27  -8.435 -10.851   7.672
  217   1HG   GLU  27          HG2       GLU  27 -10.279 -12.301   8.096
  218   2HG   GLU  27          HG1       GLU  27  -9.900 -13.296   6.692
  219    H    ILE  28           HN       ILE  28  -7.553 -10.261   4.206
  220    HA   ILE  28           HA       ILE  28  -6.826  -7.705   5.281
  221    HB   ILE  28           HB       ILE  28  -6.308  -8.644   2.448
  222   1HG1  ILE  28          HG12      ILE  28  -5.494  -9.812   5.043
  223   2HG1  ILE  28          HG11      ILE  28  -5.598 -10.573   3.485
  224   1HG2  ILE  28          HG21      ILE  28  -4.583  -7.068   4.380
  225   2HG2  ILE  28          HG22      ILE  28  -5.576  -6.355   3.113
  226   3HG2  ILE  28          HG23      ILE  28  -4.233  -7.406   2.685
  227   1HD1  ILE  28          HD11      ILE  28  -3.432  -9.474   2.866
  228   2HD1  ILE  28          HD12      ILE  28  -3.299 -10.593   4.228
  229   3HD1  ILE  28          HD13      ILE  28  -3.332  -8.854   4.515
  230    H    LEU  29           HN       LEU  29  -8.924  -8.666   2.576
  231    HA   LEU  29           HA       LEU  29  -9.489  -5.943   1.788
  232   1HB   LEU  29          HB2       LEU  29 -11.148  -8.434   1.305
  233   2HB   LEU  29          HB1       LEU  29 -11.174  -6.941   0.362
  234    HG   LEU  29           HG       LEU  29  -8.756  -8.762   0.671
  235   1HD1  LEU  29          HD11      LEU  29 -10.782  -8.405  -1.563
  236   2HD1  LEU  29          HD12      LEU  29 -10.407  -9.886  -0.684
  237   3HD1  LEU  29          HD13      LEU  29  -9.222  -9.195  -1.791
  238   1HD2  LEU  29          HD21      LEU  29  -7.909  -6.601   0.231
  239   2HD2  LEU  29          HD22      LEU  29  -9.282  -6.160  -0.785
  240   3HD2  LEU  29          HD23      LEU  29  -8.065  -7.285  -1.384
  241    H    ASP  30           HN       ASP  30 -10.810  -8.177   4.119
  242    HA   ASP  30           HA       ASP  30 -13.274  -6.721   4.637
  243   1HB   ASP  30          HB2       ASP  30 -12.821  -9.126   5.320
  244   2HB   ASP  30          HB1       ASP  30 -11.753  -8.494   6.574
  245    H    ALA  31           HN       ALA  31 -10.046  -6.729   6.153
  246    HA   ALA  31           HA       ALA  31 -10.699  -4.769   8.148
  247   1HB   ALA  31          HB1       ALA  31  -8.716  -6.385   8.108
  248   2HB   ALA  31          HB2       ALA  31  -8.371  -4.741   8.641
  249   3HB   ALA  31          HB3       ALA  31  -7.944  -5.248   7.006
  250    H    PHE  32           HN       PHE  32  -9.826  -4.461   4.758
  251    HA   PHE  32           HA       PHE  32  -8.802  -1.821   4.667
  252   1HB   PHE  32          HB2       PHE  32 -10.506  -3.476   2.829
  253   2HB   PHE  32          HB1       PHE  32 -10.153  -1.810   2.421
  254    HD1  PHE  32           HD1      PHE  32  -9.096  -2.841   0.376
  255    HD2  PHE  32           HD2      PHE  32  -7.471  -3.489   4.319
  256    HE1  PHE  32           HE1      PHE  32  -6.917  -3.481  -0.608
  257    HE2  PHE  32           HE2      PHE  32  -5.311  -4.095   3.322
  258    HZ   PHE  32           HZ       PHE  32  -5.027  -4.110   0.864
  259    H    ASP  33           HN       ASP  33 -11.894  -2.921   5.686
  260    HA   ASP  33           HA       ASP  33 -13.330  -0.475   5.020
  261   1HB   ASP  33          HB2       ASP  33 -14.049  -2.741   6.898
  262   2HB   ASP  33          HB1       ASP  33 -15.148  -1.467   6.367
  263    H    LYS  34           HN       LYS  34 -11.275  -1.455   7.644
  264    HA   LYS  34           HA       LYS  34 -12.033   1.053   9.100
  265   1HB   LYS  34          HB2       LYS  34 -11.460  -0.215  11.228
  266   2HB   LYS  34          HB1       LYS  34 -12.965  -0.689  10.444
  267   1HG   LYS  34          HG2       LYS  34 -11.873  -2.608   9.416
  268   2HG   LYS  34          HG1       LYS  34 -10.315  -2.106  10.067
  269   1HD   LYS  34          HD2       LYS  34 -11.094  -3.787  11.563
  270   2HD   LYS  34          HD1       LYS  34 -11.387  -2.257  12.384
  271   1HE   LYS  34          HE2       LYS  34 -13.715  -2.329  11.925
  272   2HE   LYS  34          HE1       LYS  34 -13.521  -3.575  10.693
  273   1HZ   LYS  34          HZ1       LYS  34 -13.450  -5.194  12.219
  274   2HZ   LYS  34          HZ2       LYS  34 -14.221  -4.061  13.224
  275   3HZ   LYS  34          HZ3       LYS  34 -12.539  -4.282  13.320
  276    H    MET  35           HN       MET  35  -9.714  -0.162   7.257
  277    HA   MET  35           HA       MET  35  -7.408   0.224   9.032
  278   1HB   MET  35          HB2       MET  35  -7.802  -1.093   6.620
  279   2HB   MET  35          HB1       MET  35  -6.840   0.286   6.126
  280   1HG   MET  35          HG2       MET  35  -5.291  -0.335   8.081
  281   2HG   MET  35          HG1       MET  35  -6.166  -1.865   8.127
  282   1HE   MET  35          HE1       MET  35  -6.213  -3.626   6.339
  283   2HE   MET  35          HE2       MET  35  -4.749  -3.718   7.315
  284   3HE   MET  35          HE3       MET  35  -4.654  -3.977   5.576
  285    H    CYS  36           HN       CYS  36  -9.029   2.136   6.412
  286    HA   CYS  36           HA       CYS  36  -7.072   4.229   6.601
  287   1HB   CYS  36          HB2       CYS  36  -9.027   3.910   4.820
  288   2HB   CYS  36          HB1       CYS  36  -9.949   4.886   5.955
  289    H    SER  37           HN       SER  37  -9.097   2.981   8.837
  290    HA   SER  37           HA       SER  37  -9.862   5.500  10.161
  291   1HB   SER  37          HB2       SER  37 -11.136   3.254  10.255
  292   2HB   SER  37          HB1       SER  37  -9.924   2.764  11.435
  293    HG   SER  37           HG       SER  37 -11.801   3.753  12.368
  294    H    LYS  38           HN       LYS  38  -6.912   4.237   9.784
  295    HA   LYS  38           HA       LYS  38  -6.044   4.800  12.608
  296   1HB   LYS  38          HB2       LYS  38  -4.942   2.948  10.491
  297   2HB   LYS  38          HB1       LYS  38  -3.936   3.504  11.830
  298   1HG   LYS  38          HG2       LYS  38  -5.636   2.640  13.427
  299   2HG   LYS  38          HG1       LYS  38  -6.574   2.026  12.066
  300   1HD   LYS  38          HD2       LYS  38  -4.497   0.728  11.375
  301   2HD   LYS  38          HD1       LYS  38  -3.809   1.165  12.938
  302   1HE   LYS  38          HE2       LYS  38  -5.783   0.134  14.059
  303   2HE   LYS  38          HE1       LYS  38  -6.378  -0.379  12.479
  304   1HZ   LYS  38          HZ1       LYS  38  -4.006  -1.303  13.957
  305   2HZ   LYS  38          HZ2       LYS  38  -4.043  -1.420  12.262
  306   3HZ   LYS  38          HZ3       LYS  38  -5.218  -2.216  13.197
  307    H    LEU  39           HN       LEU  39  -6.373   6.470   9.916
  308    HA   LEU  39           HA       LEU  39  -3.713   7.852  10.139
  309   1HB   LEU  39          HB2       LEU  39  -5.584   7.727   7.749
  310   2HB   LEU  39          HB1       LEU  39  -4.045   8.574   7.790
  311    HG   LEU  39           HG       LEU  39  -4.379   5.587   8.170
  312   1HD1  LEU  39          HD11      LEU  39  -4.883   6.569   5.857
  313   2HD1  LEU  39          HD12      LEU  39  -3.636   5.325   5.925
  314   3HD1  LEU  39          HD13      LEU  39  -3.182   7.022   5.804
  315   1HD2  LEU  39          HD21      LEU  39  -1.999   7.446   8.079
  316   2HD2  LEU  39          HD22      LEU  39  -1.831   5.749   7.652
  317   3HD2  LEU  39          HD23      LEU  39  -2.365   6.198   9.268
  318    HA   PRO  40           HA       PRO  40  -6.006  11.330  11.681
  319   1HB   PRO  40          HB2       PRO  40  -4.565  13.170   9.865
  320   2HB   PRO  40          HB1       PRO  40  -4.542  13.111  11.636
  321   1HG   PRO  40          HG2       PRO  40  -2.487  12.187   9.878
  322   2HG   PRO  40          HG1       PRO  40  -2.563  11.953  11.631
  323   1HD   PRO  40          HD2       PRO  40  -2.884   9.954   9.590
  324   2HD   PRO  40          HD1       PRO  40  -3.005   9.727  11.341
  325    H    LYS  41           HN       LYS  41  -7.720  12.893  10.828
  326    HA   LYS  41           HA       LYS  41  -9.091  11.716   8.579
  327   1HB   LYS  41          HB2       LYS  41 -10.031  13.155  10.562
  328   2HB   LYS  41          HB1       LYS  41  -9.655  14.516   9.508
  329   1HG   LYS  41          HG2       LYS  41 -11.849  14.047   8.843
  330   2HG   LYS  41          HG1       LYS  41 -10.934  13.090   7.682
  331   1HD   LYS  41          HD2       LYS  41 -12.402  11.452   8.401
  332   2HD   LYS  41          HD1       LYS  41 -11.141  11.224   9.609
  333   1HE   LYS  41          HE2       LYS  41 -13.810  12.588   9.892
  334   2HE   LYS  41          HE1       LYS  41 -13.075  11.362  10.924
  335   1HZ   LYS  41          HZ1       LYS  41 -13.027  13.556  11.947
  336   2HZ   LYS  41          HZ2       LYS  41 -12.127  14.162  10.640
  337   3HZ   LYS  41          HZ3       LYS  41 -11.458  12.981  11.661
  338    H    SER  42           HN       SER  42  -6.554  14.024   8.631
  339    HA   SER  42           HA       SER  42  -7.400  15.405   6.250
  340   1HB   SER  42          HB2       SER  42  -4.646  15.227   7.508
  341   2HB   SER  42          HB1       SER  42  -5.100  16.352   6.229
  342    HG   SER  42           HG       SER  42  -5.850  17.575   7.750
  343    H    LEU  43           HN       LEU  43  -6.093  12.335   6.571
  344    HA   LEU  43           HA       LEU  43  -5.259  12.337   3.670
  345   1HB   LEU  43          HB2       LEU  43  -4.521  10.232   5.708
  346   2HB   LEU  43          HB1       LEU  43  -3.825  10.486   4.111
  347    HG   LEU  43           HG       LEU  43  -3.546  12.278   6.515
  348   1HD1  LEU  43          HD11      LEU  43  -1.081  11.753   6.064
  349   2HD1  LEU  43          HD12      LEU  43  -1.673  10.454   5.029
  350   3HD1  LEU  43          HD13      LEU  43  -2.061  10.459   6.749
  351   1HD2  LEU  43          HD21      LEU  43  -1.937  13.523   4.963
  352   2HD2  LEU  43          HD22      LEU  43  -3.649  13.737   4.613
  353   3HD2  LEU  43          HD23      LEU  43  -2.683  12.632   3.641
  354    H    SER  44           HN       SER  44  -7.768  11.557   5.698
  355    HA   SER  44           HA       SER  44  -8.666   9.017   5.314
  356   1HB   SER  44          HB2       SER  44 -10.112  10.627   6.367
  357   2HB   SER  44          HB1       SER  44 -10.230  11.576   4.889
  358    HG   SER  44           HG       SER  44 -11.372   9.900   3.946
  359    H    GLU  45           HN       GLU  45  -9.675  11.470   3.007
  360    HA   GLU  45           HA       GLU  45 -10.751   9.916   1.070
  361   1HB   GLU  45          HB2       GLU  45  -9.292  12.533   0.739
  362   2HB   GLU  45          HB1       GLU  45 -10.490  11.873  -0.378
  363   1HG   GLU  45          HG2       GLU  45 -12.176  11.874   1.445
  364   2HG   GLU  45          HG1       GLU  45 -10.982  12.586   2.531
  365    H    GLU  46           HN       GLU  46  -7.469  11.250   0.768
  366    HA   GLU  46           HA       GLU  46  -6.907  10.153  -1.766
  367   1HB   GLU  46          HB2       GLU  46  -4.784  10.322   0.357
  368   2HB   GLU  46          HB1       GLU  46  -4.678  10.734  -1.350
  369   1HG   GLU  46          HG2       GLU  46  -6.070  12.301   0.834
  370   2HG   GLU  46          HG1       GLU  46  -4.704  12.809  -0.149
  371    H    CYS  47           HN       CYS  47  -7.164   8.584   1.314
  372    HA   CYS  47           HA       CYS  47  -5.648   6.226   0.452
  373   1HB   CYS  47          HB2       CYS  47  -5.919   5.494   2.639
  374   2HB   CYS  47          HB1       CYS  47  -6.252   7.204   2.911
  375    H    GLN  48           HN       GLN  48  -9.051   7.142   0.863
  376    HA   GLN  48           HA       GLN  48 -10.237   4.681   0.196
  377   1HB   GLN  48          HB2       GLN  48 -11.501   6.713   0.917
  378   2HB   GLN  48          HB1       GLN  48 -11.210   7.424  -0.671
  379   1HG   GLN  48          HG2       GLN  48 -12.417   5.603  -1.755
  380   2HG   GLN  48          HG1       GLN  48 -12.627   4.784  -0.207
  381   1HE2  GLN  48          HE21      GLN  48 -15.033   5.049  -0.884
  382   2HE2  GLN  48          HE22      GLN  48 -15.803   6.494  -0.436
  383    H    GLU  49           HN       GLU  49  -9.018   7.235  -1.976
  384    HA   GLU  49           HA       GLU  49  -9.839   5.911  -4.380
  385   1HB   GLU  49          HB2       GLU  49  -7.780   8.044  -3.800
  386   2HB   GLU  49          HB1       GLU  49  -8.090   7.451  -5.431
  387   1HG   GLU  49          HG2       GLU  49 -10.408   8.135  -5.308
  388   2HG   GLU  49          HG1       GLU  49 -10.240   8.551  -3.602
  389    H    VAL  50           HN       VAL  50  -6.786   5.876  -2.529
  390    HA   VAL  50           HA       VAL  50  -5.374   4.270  -4.447
  391    HB   VAL  50           HB       VAL  50  -4.856   4.472  -1.471
  392   1HG1  VAL  50          HG11      VAL  50  -3.125   3.587  -3.788
  393   2HG1  VAL  50          HG12      VAL  50  -3.724   2.574  -2.474
  394   3HG1  VAL  50          HG13      VAL  50  -2.544   3.840  -2.144
  395   1HG2  VAL  50          HG21      VAL  50  -3.575   6.388  -1.867
  396   2HG2  VAL  50          HG22      VAL  50  -4.857   6.626  -3.050
  397   3HG2  VAL  50          HG23      VAL  50  -3.303   5.984  -3.561
  398    H    VAL  51           HN       VAL  51  -6.921   3.447  -1.308
  399    HA   VAL  51           HA       VAL  51  -6.492   0.676  -1.589
  400    HB   VAL  51           HB       VAL  51  -8.739   2.073  -0.084
  401   1HG1  VAL  51          HG11      VAL  51  -8.551   0.075   1.417
  402   2HG1  VAL  51          HG12      VAL  51  -7.466  -0.649   0.231
  403   3HG1  VAL  51          HG13      VAL  51  -9.141  -0.303  -0.200
  404   1HG2  VAL  51          HG21      VAL  51  -5.993   1.269   0.912
  405   2HG2  VAL  51          HG22      VAL  51  -7.228   2.138   1.820
  406   3HG2  VAL  51          HG23      VAL  51  -6.433   2.912   0.450
  407    H    ASP  52           HN       ASP  52  -9.425   2.522  -2.342
  408    HA   ASP  52           HA       ASP  52 -10.934   0.338  -3.318
  409   1HB   ASP  52          HB2       ASP  52 -11.120   3.250  -4.119
  410   2HB   ASP  52          HB1       ASP  52 -12.374   2.029  -4.338
  411    H    THR  53           HN       THR  53  -8.821   2.595  -5.104
  412    HA   THR  53           HA       THR  53  -9.427   1.231  -7.650
  413    HB   THR  53           HB       THR  53  -7.438   3.437  -7.099
  414    HG1  THR  53           HG1      THR  53 -10.017   3.514  -6.842
  415   1HG2  THR  53          HG21      THR  53  -8.836   2.533  -9.631
  416   2HG2  THR  53          HG22      THR  53  -7.146   2.221  -9.234
  417   3HG2  THR  53          HG23      THR  53  -7.698   3.874  -9.503
  418    H    TYR  54           HN       TYR  54  -6.652   1.522  -5.427
  419    HA   TYR  54           HA       TYR  54  -5.242  -0.510  -7.132
  420   1HB   TYR  54          HB2       TYR  54  -4.178   1.507  -5.167
  421   2HB   TYR  54          HB1       TYR  54  -3.192   0.279  -5.953
  422    HD1  TYR  54           HD1      TYR  54  -2.646   0.427  -8.325
  423    HD2  TYR  54           HD2      TYR  54  -5.209   3.311  -6.468
  424    HE1  TYR  54           HE1      TYR  54  -2.439   1.897 -10.313
  425    HE2  TYR  54           HE2      TYR  54  -5.010   4.786  -8.434
  426    HH   TYR  54           HH       TYR  54  -4.480   4.514 -10.883
  427    H    GLY  55           HN       GLY  55  -7.278  -1.168  -5.094
  428   1HA   GLY  55          HA2       GLY  55  -5.819  -2.224  -2.806
  429   2HA   GLY  55          HA1       GLY  55  -7.530  -2.459  -3.136
  430    H    SER  56           HN       SER  56  -7.685  -3.860  -5.444
  431    HA   SER  56           HA       SER  56  -6.761  -6.424  -4.624
  432   1HB   SER  56          HB2       SER  56  -7.455  -5.854  -7.496
  433   2HB   SER  56          HB1       SER  56  -7.789  -7.294  -6.534
  434    HG   SER  56           HG       SER  56  -8.881  -5.031  -5.472
  435    H    SER  57           HN       SER  57  -5.419  -3.951  -6.661
  436    HA   SER  57           HA       SER  57  -3.521  -5.731  -7.909
  437   1HB   SER  57          HB2       SER  57  -2.501  -3.674  -8.860
  438   2HB   SER  57          HB1       SER  57  -4.250  -3.679  -9.073
  439    HG   SER  57           HG       SER  57  -4.339  -2.410  -7.116
  440    H    ILE  58           HN       ILE  58  -3.190  -3.314  -5.305
  441    HA   ILE  58           HA       ILE  58  -0.392  -3.691  -4.829
  442    HB   ILE  58           HB       ILE  58  -2.705  -2.971  -3.003
  443   1HG1  ILE  58          HG12      ILE  58  -0.353  -1.335  -4.006
  444   2HG1  ILE  58          HG11      ILE  58  -1.944  -1.330  -4.758
  445   1HG2  ILE  58          HG21      ILE  58   0.217  -3.399  -2.372
  446   2HG2  ILE  58          HG22      ILE  58  -1.197  -3.935  -1.470
  447   3HG2  ILE  58          HG23      ILE  58  -0.727  -2.240  -1.439
  448   1HD1  ILE  58          HD11      ILE  58  -1.128  -0.296  -2.050
  449   2HD1  ILE  58          HD12      ILE  58  -2.809  -0.737  -2.355
  450   3HD1  ILE  58          HD13      ILE  58  -2.047   0.531  -3.310
  451    H    LEU  59           HN       LEU  59  -3.199  -5.098  -3.284
  452    HA   LEU  59           HA       LEU  59  -1.873  -7.036  -1.699
  453   1HB   LEU  59          HB2       LEU  59  -4.180  -6.406  -1.279
  454   2HB   LEU  59          HB1       LEU  59  -4.670  -6.965  -2.875
  455    HG   LEU  59           HG       LEU  59  -4.171  -9.268  -2.281
  456   1HD1  LEU  59          HD11      LEU  59  -2.287  -9.164  -0.851
  457   2HD1  LEU  59          HD12      LEU  59  -3.578  -9.666   0.229
  458   3HD1  LEU  59          HD13      LEU  59  -3.046  -7.985   0.215
  459   1HD2  LEU  59          HD21      LEU  59  -6.376  -8.879  -1.647
  460   2HD2  LEU  59          HD22      LEU  59  -5.941  -7.656  -0.455
  461   3HD2  LEU  59          HD23      LEU  59  -5.700  -9.359  -0.095
  462    H    SER  60           HN       SER  60  -2.665  -7.065  -5.155
  463    HA   SER  60           HA       SER  60  -2.394  -9.939  -5.237
  464   1HB   SER  60          HB2       SER  60  -3.765  -9.087  -6.950
  465   2HB   SER  60          HB1       SER  60  -2.619  -7.813  -7.355
  466    HG   SER  60           HG       SER  60  -2.208 -10.602  -7.722
  467    H    ILE  61           HN       ILE  61  -0.340  -7.146  -5.852
  468    HA   ILE  61           HA       ILE  61   1.883  -8.524  -7.062
  469    HB   ILE  61           HB       ILE  61   2.060  -6.004  -5.399
  470   1HG1  ILE  61          HG12      ILE  61   0.402  -6.414  -7.751
  471   2HG1  ILE  61          HG11      ILE  61   0.650  -4.939  -6.829
  472   1HG2  ILE  61          HG21      ILE  61   3.913  -5.483  -6.906
  473   2HG2  ILE  61          HG22      ILE  61   3.612  -6.966  -7.815
  474   3HG2  ILE  61          HG23      ILE  61   4.155  -7.051  -6.141
  475   1HD1  ILE  61          HD11      ILE  61   2.651  -4.422  -8.162
  476   2HD1  ILE  61          HD12      ILE  61   1.229  -4.605  -9.185
  477   3HD1  ILE  61          HD13      ILE  61   2.418  -5.901  -9.096
  478    H    LEU  62           HN       LEU  62   1.246  -7.457  -3.718
  479    HA   LEU  62           HA       LEU  62   3.613  -8.211  -2.493
  480   1HB   LEU  62          HB2       LEU  62   0.741  -8.199  -1.603
  481   2HB   LEU  62          HB1       LEU  62   1.959  -8.842  -0.507
  482    HG   LEU  62           HG       LEU  62   2.660  -6.218  -1.762
  483   1HD1  LEU  62          HD11      LEU  62   0.295  -6.561   0.065
  484   2HD1  LEU  62          HD12      LEU  62   0.408  -5.620  -1.415
  485   3HD1  LEU  62          HD13      LEU  62   1.219  -5.060   0.048
  486   1HD2  LEU  62          HD21      LEU  62   3.362  -5.753   0.579
  487   2HD2  LEU  62          HD22      LEU  62   4.073  -7.246  -0.036
  488   3HD2  LEU  62          HD23      LEU  62   2.704  -7.308   1.074
  489    H    LEU  63           HN       LEU  63   0.950 -10.285  -3.543
  490    HA   LEU  63           HA       LEU  63   2.010 -12.670  -2.238
  491   1HB   LEU  63          HB2       LEU  63  -0.065 -12.428  -4.438
  492   2HB   LEU  63          HB1       LEU  63   0.221 -13.842  -3.422
  493    HG   LEU  63           HG       LEU  63  -0.700 -11.117  -2.466
  494   1HD1  LEU  63          HD11      LEU  63  -2.534 -12.202  -3.524
  495   2HD1  LEU  63          HD12      LEU  63  -2.742 -12.519  -1.801
  496   3HD1  LEU  63          HD13      LEU  63  -2.088 -13.772  -2.855
  497   1HD2  LEU  63          HD21      LEU  63  -1.092 -12.589  -0.311
  498   2HD2  LEU  63          HD22      LEU  63   0.512 -11.939  -0.639
  499   3HD2  LEU  63          HD23      LEU  63   0.149 -13.622  -1.023
  500    H    GLU  64           HN       GLU  64   2.803 -11.034  -5.146
  501    HA   GLU  64           HA       GLU  64   3.802 -13.499  -6.412
  502   1HB   GLU  64          HB2       GLU  64   3.768 -10.583  -7.207
  503   2HB   GLU  64          HB1       GLU  64   4.791 -11.732  -8.070
  504   1HG   GLU  64          HG2       GLU  64   1.822 -12.143  -7.649
  505   2HG   GLU  64          HG1       GLU  64   2.502 -11.388  -9.089
  506    H    GLU  65           HN       GLU  65   4.750 -12.658  -3.812
  507    HA   GLU  65           HA       GLU  65   6.798 -12.549  -2.611
  508   1HB   GLU  65          HB2       GLU  65   7.691 -13.824  -5.191
  509   2HB   GLU  65          HB1       GLU  65   8.624 -13.793  -3.696
  510   1HG   GLU  65          HG2       GLU  65   5.817 -14.912  -3.861
  511   2HG   GLU  65          HG1       GLU  65   7.261 -15.904  -4.070
  512    H    VAL  66           HN       VAL  66   6.149 -10.166  -4.335
  513    HA   VAL  66           HA       VAL  66   8.820  -9.262  -5.280
  514    HB   VAL  66           HB       VAL  66   5.981  -8.365  -5.593
  515   1HG1  VAL  66          HG11      VAL  66   6.870  -6.165  -6.554
  516   2HG1  VAL  66          HG12      VAL  66   8.358  -6.501  -5.670
  517   3HG1  VAL  66          HG13      VAL  66   6.842  -6.287  -4.794
  518   1HG2  VAL  66          HG21      VAL  66   6.543  -8.312  -7.898
  519   2HG2  VAL  66          HG22      VAL  66   7.412  -9.710  -7.262
  520   3HG2  VAL  66          HG23      VAL  66   8.269  -8.200  -7.559
  521    H    SER  67           HN       SER  67   9.950  -7.531  -4.212
  522    HA   SER  67           HA       SER  67   9.719  -7.350  -1.422
  523   1HB   SER  67          HB2       SER  67  11.399  -5.739  -1.499
  524   2HB   SER  67          HB1       SER  67  11.594  -6.490  -3.079
  525    HG   SER  67           HG       SER  67   9.837  -4.752  -3.567
  526    HA   PRO  68           HA       PRO  68   6.188  -4.761  -0.805
  527   1HB   PRO  68          HB2       PRO  68   7.180  -3.309   1.469
  528   2HB   PRO  68          HB1       PRO  68   6.171  -4.751   1.480
  529   1HG   PRO  68          HG2       PRO  68   9.002  -4.531   2.137
  530   2HG   PRO  68          HG1       PRO  68   7.924  -5.922   2.341
  531   1HD   PRO  68          HD2       PRO  68   9.988  -5.626   0.369
  532   2HD   PRO  68          HD1       PRO  68   8.790  -6.934   0.500
  533    H    GLU  69           HN       GLU  69   9.342  -3.038  -0.655
  534    HA   GLU  69           HA       GLU  69   8.043  -0.471  -1.166
  535   1HB   GLU  69          HB2       GLU  69  10.667   0.065  -1.666
  536   2HB   GLU  69          HB1       GLU  69   9.983   0.004  -0.045
  537   1HG   GLU  69          HG2       GLU  69  10.695  -2.301   0.233
  538   2HG   GLU  69          HG1       GLU  69  11.254  -2.371  -1.437
  539    H    LEU  70           HN       LEU  70   9.064  -3.047  -3.192
  540    HA   LEU  70           HA       LEU  70   9.587  -1.357  -5.503
  541   1HB   LEU  70          HB2       LEU  70   9.074  -4.322  -5.182
  542   2HB   LEU  70          HB1       LEU  70   9.193  -3.598  -6.772
  543    HG   LEU  70           HG       LEU  70  11.338  -3.175  -4.719
  544   1HD1  LEU  70          HD11      LEU  70  10.916  -5.662  -5.167
  545   2HD1  LEU  70          HD12      LEU  70  12.545  -5.082  -5.495
  546   3HD1  LEU  70          HD13      LEU  70  11.418  -5.337  -6.824
  547   1HD2  LEU  70          HD21      LEU  70  11.567  -1.689  -6.581
  548   2HD2  LEU  70          HD22      LEU  70  11.223  -2.979  -7.728
  549   3HD2  LEU  70          HD23      LEU  70  12.736  -2.979  -6.837
  550    H    VAL  71           HN       VAL  71   6.856  -2.370  -3.785
  551    HA   VAL  71           HA       VAL  71   4.937  -2.447  -5.896
  552    HB   VAL  71           HB       VAL  71   4.756  -1.995  -2.913
  553   1HG1  VAL  71          HG11      VAL  71   2.169  -2.076  -3.261
  554   2HG1  VAL  71          HG12      VAL  71   2.530  -1.485  -4.883
  555   3HG1  VAL  71          HG13      VAL  71   2.987  -0.530  -3.473
  556   1HG2  VAL  71          HG21      VAL  71   3.660  -4.075  -4.816
  557   2HG2  VAL  71          HG22      VAL  71   3.316  -4.045  -3.086
  558   3HG2  VAL  71          HG23      VAL  71   4.970  -4.280  -3.652
  559    H    CYS  72           HN       CYS  72   5.681   0.330  -3.696
  560    HA   CYS  72           HA       CYS  72   3.920   1.979  -5.163
  561   1HB   CYS  72          HB2       CYS  72   6.329   2.798  -3.486
  562   2HB   CYS  72          HB1       CYS  72   5.064   3.895  -4.020
  563    H    SER  73           HN       SER  73   7.235   1.048  -5.719
  564    HA   SER  73           HA       SER  73   7.746   3.163  -7.696
  565   1HB   SER  73          HB2       SER  73   9.253   0.556  -7.551
  566   2HB   SER  73          HB1       SER  73   9.848   2.137  -8.048
  567    HG   SER  73           HG       SER  73  10.466   1.493  -5.891
  568    H    MET  74           HN       MET  74   6.689  -0.251  -7.946
  569    HA   MET  74           HA       MET  74   6.758  -0.243 -10.872
  570   1HB   MET  74          HB2       MET  74   5.921  -2.119  -8.734
  571   2HB   MET  74          HB1       MET  74   4.999  -2.261 -10.228
  572   1HG   MET  74          HG2       MET  74   7.332  -2.324 -11.394
  573   2HG   MET  74          HG1       MET  74   7.944  -2.692  -9.787
  574   1HE   MET  74          HE1       MET  74   6.431  -4.320  -8.250
  575   2HE   MET  74          HE2       MET  74   5.632  -5.763  -8.858
  576   3HE   MET  74          HE3       MET  74   4.833  -4.200  -8.997
  577    H    LEU  75           HN       LEU  75   4.127   0.304  -8.495
  578    HA   LEU  75           HA       LEU  75   2.127   0.492 -10.584
  579   1HB   LEU  75          HB2       LEU  75   2.004   1.614  -7.774
  580   2HB   LEU  75          HB1       LEU  75   0.637   1.310  -8.842
  581    HG   LEU  75           HG       LEU  75   2.479  -0.742  -7.589
  582   1HD1  LEU  75          HD11      LEU  75   0.235  -1.605  -6.757
  583   2HD1  LEU  75          HD12      LEU  75  -0.451  -0.081  -7.314
  584   3HD1  LEU  75          HD13      LEU  75   0.786  -0.086  -6.057
  585   1HD2  LEU  75          HD21      LEU  75   2.115  -1.669  -9.723
  586   2HD2  LEU  75          HD22      LEU  75   0.489  -0.992  -9.839
  587   3HD2  LEU  75          HD23      LEU  75   0.802  -2.356  -8.770
  588    H    HIS  76           HN       HIS  76   4.630   2.302 -10.561
  589    HA   HIS  76           HA       HIS  76   5.163   4.535 -11.062
  590   1HB   HIS  76          HB2       HIS  76   3.889   5.485 -12.859
  591   2HB   HIS  76          HB1       HIS  76   3.890   3.741 -13.104
  592    HD1  HIS  76           HD1      HIS  76   1.668   6.457 -11.624
  593    HD2  HIS  76           HD2      HIS  76   1.353   2.627 -13.238
  594    HE1  HIS  76           HE1      HIS  76  -0.808   5.949 -11.786
  595    H    LEU  77           HN       LEU  77   3.356   4.002  -8.588
  596    HA   LEU  77           HA       LEU  77   1.816   6.505  -8.443
  597   1HB   LEU  77          HB2       LEU  77   2.402   4.331  -6.420
  598   2HB   LEU  77          HB1       LEU  77   1.518   5.782  -6.008
  599    HG   LEU  77           HG       LEU  77   0.703   3.555  -7.862
  600   1HD1  LEU  77          HD11      LEU  77   0.177   3.302  -5.488
  601   2HD1  LEU  77          HD12      LEU  77  -1.309   3.579  -6.399
  602   3HD1  LEU  77          HD13      LEU  77  -0.585   4.889  -5.472
  603   1HD2  LEU  77          HD21      LEU  77  -1.431   5.040  -8.175
  604   2HD2  LEU  77          HD22      LEU  77  -0.026   5.395  -9.172
  605   3HD2  LEU  77          HD23      LEU  77  -0.368   6.381  -7.747
  606    H    CYS  78           HN       CYS  78   5.061   5.637  -7.975
  607    HA   CYS  78           HA       CYS  78   5.483   8.194  -6.473
  608   1HB   CYS  78          HB2       CYS  78   6.777   5.504  -6.022
  609   2HB   CYS  78          HB1       CYS  78   7.525   7.000  -5.469
  610    H    SER  79           HN       SER  79   7.677   8.914  -6.620
  611    HA   SER  79           HA       SER  79   9.514   9.625  -7.642
  612   1HB   SER  79          HB2       SER  79   9.107   7.630  -9.901
  613   2HB   SER  79          HB1       SER  79  10.621   8.385  -9.411
  614    HG   SER  79           HG       SER  79   9.319   6.201  -8.395
  615    H    GLY  80           HN       GLY  80   7.082  10.884  -8.014
  616   1HA   GLY  80          HA2       GLY  80   6.430  11.407 -10.749
  617   2HA   GLY  80          HA1       GLY  80   5.973  12.420  -9.382
  618    H    LEU  81           HN       LEU  81   9.168  11.571 -10.827
  619    HA   LEU  81           HA       LEU  81   9.873  14.463 -10.732
  620   1HB   LEU  81          HB2       LEU  81  11.598  12.078 -11.485
  621   2HB   LEU  81          HB1       LEU  81  12.155  13.715 -11.150
  622    HG   LEU  81           HG       LEU  81  10.688  12.009  -9.119
  623   1HD1  LEU  81          HD11      LEU  81  12.728  10.845  -9.559
  624   2HD1  LEU  81          HD12      LEU  81  13.022  11.794  -8.103
  625   3HD1  LEU  81          HD13      LEU  81  13.646  12.348  -9.657
  626   1HD2  LEU  81          HD21      LEU  81  11.898  13.682  -7.572
  627   2HD2  LEU  81          HD22      LEU  81  10.544  14.309  -8.509
  628   3HD2  LEU  81          HD23      LEU  81  12.198  14.634  -9.025
  629    H    VAL  82           HN       VAL  82   8.297  12.378 -12.605
  630    HA   VAL  82           HA       VAL  82   9.050  12.124 -15.167
  631    HB   VAL  82           HB       VAL  82   6.706  13.112 -15.825
  632   1HG1  VAL  82          HG11      VAL  82   7.160  10.713 -15.565
  633   2HG1  VAL  82          HG12      VAL  82   5.607  11.118 -14.835
  634   3HG1  VAL  82          HG13      VAL  82   7.020  10.860 -13.813
  635   1HG2  VAL  82          HG21      VAL  82   6.382  12.962 -12.819
  636   2HG2  VAL  82          HG22      VAL  82   5.230  13.568 -14.008
  637   3HG2  VAL  82          HG23      VAL  82   6.691  14.486 -13.650
  638    HA   PRO  83           HA       PRO  83  10.498  16.443 -15.832
  639   1HB   PRO  83          HB2       PRO  83  12.285  15.560 -17.905
  640   2HB   PRO  83          HB1       PRO  83  12.714  16.037 -16.257
  641   1HG   PRO  83          HG2       PRO  83  12.756  13.372 -17.383
  642   2HG   PRO  83          HG1       PRO  83  13.182  13.855 -15.735
  643   1HD   PRO  83          HD2       PRO  83  10.768  12.492 -16.652
  644   2HD   PRO  83          HD1       PRO  83  11.271  12.832 -14.985
  645    H    ARG  84           HN       ARG  84   8.839  14.165 -17.622
  646    HA   ARG  84           HA       ARG  84   7.838  14.153 -19.777
  647   1HB   ARG  84          HB2       ARG  84   6.223  16.074 -19.941
  648   2HB   ARG  84          HB1       ARG  84   6.159  15.202 -18.412
  649   1HG   ARG  84          HG2       ARG  84   7.458  16.907 -17.301
  650   2HG   ARG  84          HG1       ARG  84   7.774  17.732 -18.820
  651   1HD   ARG  84          HD2       ARG  84   5.123  17.439 -17.399
  652   2HD   ARG  84          HD1       ARG  84   6.004  18.934 -17.689
  653    HE   ARG  84           HE       ARG  84   4.114  17.690 -19.456
  654   1HH1  ARG  84          HH21      ARG  84   7.202  19.237 -19.515
  655   2HH1  ARG  84          HH22      ARG  84   7.160  19.524 -21.221
  656   1HH2  ARG  84          HH11      ARG  84   4.047  18.077 -21.661
  657   2HH2  ARG  84          HH12      ARG  84   5.377  18.875 -22.432
  Start of MODEL    5
    1   1H    SER   1          HT1       SER   1   6.966  15.552  -1.717
    2   2H    SER   1          HT2       SER   1   7.474  16.982  -0.953
    3   3H    SER   1          HT3       SER   1   6.288  17.040  -2.168
    4    HA   SER   1           HA       SER   1   6.000  15.770   0.501
    5   1HB   SER   1          HB2       SER   1   5.930  18.232   0.560
    6   2HB   SER   1          HB1       SER   1   4.731  18.236  -0.730
    7    HG   SER   1           HG       SER   1   3.597  16.722   0.870
    8    H    ASP   2           HN       ASP   2   5.661  14.449  -2.058
    9    HA   ASP   2           HA       ASP   2   2.899  14.461  -2.871
   10   1HB   ASP   2          HB2       ASP   2   4.569  13.646  -4.398
   11   2HB   ASP   2          HB1       ASP   2   5.118  12.442  -3.237
   12    H    VAL   3           HN       VAL   3   1.419  14.059  -1.318
   13    HA   VAL   3           HA       VAL   3   1.700  12.324   0.920
   14    HB   VAL   3           HB       VAL   3  -0.541  12.771   1.368
   15   1HG1  VAL   3          HG11      VAL   3  -0.810  15.101   0.975
   16   2HG1  VAL   3          HG12      VAL   3   0.114  15.031  -0.524
   17   3HG1  VAL   3          HG13      VAL   3   0.931  14.825   1.025
   18   1HG2  VAL   3          HG21      VAL   3  -0.925  12.967  -1.632
   19   2HG2  VAL   3          HG22      VAL   3  -2.140  13.539  -0.486
   20   3HG2  VAL   3          HG23      VAL   3  -1.684  11.835  -0.512
   21    H    TYR   4           HN       TYR   4   1.219  11.464  -2.443
   22    HA   TYR   4           HA       TYR   4  -0.365   9.145  -1.779
   23   1HB   TYR   4          HB2       TYR   4   1.027  10.089  -4.288
   24   2HB   TYR   4          HB1       TYR   4   0.504   8.411  -4.223
   25    HD1  TYR   4           HD1      TYR   4  -0.474  11.567  -5.295
   26    HD2  TYR   4           HD2      TYR   4  -1.995   8.171  -3.150
   27    HE1  TYR   4           HE1      TYR   4  -2.783  12.205  -5.916
   28    HE2  TYR   4           HE2      TYR   4  -4.298   8.802  -3.786
   29    HH   TYR   4           HH       TYR   4  -5.558  10.164  -5.034
   30    H    CYS   5           HN       CYS   5   3.070   9.572  -2.531
   31    HA   CYS   5           HA       CYS   5   3.861   6.844  -2.305
   32   1HB   CYS   5          HB2       CYS   5   5.315   9.414  -1.577
   33   2HB   CYS   5          HB1       CYS   5   6.076   7.823  -1.510
   34    H    GLU   6           HN       GLU   6   3.312   9.288   0.199
   35    HA   GLU   6           HA       GLU   6   4.230   7.728   2.399
   36   1HB   GLU   6          HB2       GLU   6   3.810  10.099   2.669
   37   2HB   GLU   6          HB1       GLU   6   2.107   9.886   2.263
   38   1HG   GLU   6          HG2       GLU   6   1.663   8.705   4.279
   39   2HG   GLU   6          HG1       GLU   6   3.380   8.465   4.606
   40    H    VAL   7           HN       VAL   7   0.947   7.949   0.977
   41    HA   VAL   7           HA       VAL   7  -0.152   6.085   2.922
   42    HB   VAL   7           HB       VAL   7  -1.225   6.915   0.202
   43   1HG1  VAL   7          HG11      VAL   7  -2.365   4.934   0.785
   44   2HG1  VAL   7          HG12      VAL   7  -3.423   6.215   1.373
   45   3HG1  VAL   7          HG13      VAL   7  -2.386   5.343   2.499
   46   1HG2  VAL   7          HG21      VAL   7  -2.770   8.301   1.774
   47   2HG2  VAL   7          HG22      VAL   7  -1.139   8.895   1.482
   48   3HG2  VAL   7          HG23      VAL   7  -1.513   8.051   2.984
   49    H    CYS   8           HN       CYS   8   0.997   5.595  -0.457
   50    HA   CYS   8           HA       CYS   8   0.208   2.877  -0.618
   51   1HB   CYS   8          HB2       CYS   8   1.604   2.773  -2.497
   52   2HB   CYS   8          HB1       CYS   8   1.127   4.463  -2.422
   53    H    GLU   9           HN       GLU   9   2.995   4.390   0.961
   54    HA   GLU   9           HA       GLU   9   4.279   1.803   1.428
   55   1HB   GLU   9          HB2       GLU   9   4.763   4.575   2.571
   56   2HB   GLU   9          HB1       GLU   9   5.751   3.164   2.949
   57   1HG   GLU   9          HG2       GLU   9   6.357   2.911   0.599
   58   2HG   GLU   9          HG1       GLU   9   5.294   4.247   0.157
   59    H    PHE  10           HN       PHE  10   1.962   3.941   3.087
   60    HA   PHE  10           HA       PHE  10   2.252   2.628   5.638
   61   1HB   PHE  10          HB2       PHE  10   1.223   4.857   5.461
   62   2HB   PHE  10          HB1       PHE  10  -0.115   4.164   4.538
   63    HD1  PHE  10           HD1      PHE  10  -1.908   3.042   5.621
   64    HD2  PHE  10           HD2      PHE  10   1.657   4.013   7.807
   65    HE1  PHE  10           HE1      PHE  10  -3.009   2.328   7.734
   66    HE2  PHE  10           HE2      PHE  10   0.560   3.313   9.917
   67    HZ   PHE  10           HZ       PHE  10  -1.774   2.472   9.879
   68    H    LEU  11           HN       LEU  11  -0.114   2.219   2.949
   69    HA   LEU  11           HA       LEU  11  -1.571   0.082   4.212
   70   1HB   LEU  11          HB2       LEU  11  -1.110   0.434   1.229
   71   2HB   LEU  11          HB1       LEU  11  -2.381  -0.522   1.993
   72    HG   LEU  11           HG       LEU  11  -2.093   2.455   2.491
   73   1HD1  LEU  11          HD11      LEU  11  -2.394   2.324   0.124
   74   2HD1  LEU  11          HD12      LEU  11  -4.000   2.629   0.788
   75   3HD1  LEU  11          HD13      LEU  11  -3.552   1.003   0.273
   76   1HD2  LEU  11          HD21      LEU  11  -4.580   2.162   2.934
   77   2HD2  LEU  11          HD22      LEU  11  -3.522   1.354   4.087
   78   3HD2  LEU  11          HD23      LEU  11  -4.323   0.423   2.820
   79    H    VAL  12           HN       VAL  12   1.288   0.043   2.014
   80    HA   VAL  12           HA       VAL  12   1.527  -2.774   1.868
   81    HB   VAL  12           HB       VAL  12   3.474  -0.468   1.657
   82   1HG1  VAL  12          HG11      VAL  12   4.879  -2.237   2.467
   83   2HG1  VAL  12          HG12      VAL  12   5.086  -2.187   0.721
   84   3HG1  VAL  12          HG13      VAL  12   4.065  -3.428   1.452
   85   1HG2  VAL  12          HG21      VAL  12   3.422  -1.004  -0.693
   86   2HG2  VAL  12          HG22      VAL  12   1.751  -0.965  -0.130
   87   3HG2  VAL  12          HG23      VAL  12   2.559  -2.512  -0.386
   88    H    LYS  13           HN       LYS  13   3.041  -0.453   4.160
   89    HA   LYS  13           HA       LYS  13   4.490  -2.333   5.709
   90   1HB   LYS  13          HB2       LYS  13   4.900   0.004   6.046
   91   2HB   LYS  13          HB1       LYS  13   3.209   0.322   6.412
   92   1HG   LYS  13          HG2       LYS  13   3.352  -0.831   8.515
   93   2HG   LYS  13          HG1       LYS  13   4.946  -1.478   8.125
   94   1HD   LYS  13          HD2       LYS  13   4.531   1.510   8.178
   95   2HD   LYS  13          HD1       LYS  13   4.724   0.639   9.697
   96   1HE   LYS  13          HE2       LYS  13   6.684   0.633   7.379
   97   2HE   LYS  13          HE1       LYS  13   6.898   1.449   8.926
   98   1HZ   LYS  13          HZ1       LYS  13   6.379  -1.017   9.752
   99   2HZ   LYS  13          HZ2       LYS  13   7.951  -0.455   9.437
  100   3HZ   LYS  13          HZ3       LYS  13   7.123  -1.373   8.270
  101    H    GLU  14           HN       GLU  14   1.182  -1.146   6.063
  102    HA   GLU  14           HA       GLU  14   0.596  -2.703   8.429
  103   1HB   GLU  14          HB2       GLU  14  -0.648  -0.649   6.941
  104   2HB   GLU  14          HB1       GLU  14  -1.766  -2.003   6.844
  105   1HG   GLU  14          HG2       GLU  14  -2.300  -0.661   8.806
  106   2HG   GLU  14          HG1       GLU  14  -1.651  -2.212   9.338
  107    H    VAL  15           HN       VAL  15   0.091  -3.247   4.944
  108    HA   VAL  15           HA       VAL  15  -1.479  -5.619   5.335
  109    HB   VAL  15           HB       VAL  15   0.093  -4.529   2.994
  110   1HG1  VAL  15          HG11      VAL  15  -1.016  -6.428   1.687
  111   2HG1  VAL  15          HG12      VAL  15  -1.305  -7.203   3.243
  112   3HG1  VAL  15          HG13      VAL  15   0.350  -6.897   2.709
  113   1HG2  VAL  15          HG21      VAL  15  -2.100  -4.217   2.040
  114   2HG2  VAL  15          HG22      VAL  15  -2.147  -3.580   3.685
  115   3HG2  VAL  15          HG23      VAL  15  -2.853  -5.158   3.329
  116    H    THR  16           HN       THR  16   2.073  -5.187   4.864
  117    HA   THR  16           HA       THR  16   2.512  -7.989   4.734
  118    HB   THR  16           HB       THR  16   4.762  -7.664   4.912
  119    HG1  THR  16           HG1      THR  16   4.133  -5.473   6.591
  120   1HG2  THR  16          HG21      THR  16   4.490  -4.794   4.352
  121   2HG2  THR  16          HG22      THR  16   3.414  -5.798   3.382
  122   3HG2  THR  16          HG23      THR  16   5.152  -6.069   3.336
  123    H    LYS  17           HN       LYS  17   2.301  -5.837   7.569
  124    HA   LYS  17           HA       LYS  17   3.162  -7.834   9.420
  125   1HB   LYS  17          HB2       LYS  17   3.021  -5.675  10.360
  126   2HB   LYS  17          HB1       LYS  17   1.407  -5.392   9.708
  127   1HG   LYS  17          HG2       LYS  17   0.363  -6.704  11.345
  128   2HG   LYS  17          HG1       LYS  17   1.814  -7.648  11.664
  129   1HD   LYS  17          HD2       LYS  17   2.844  -5.609  12.695
  130   2HD   LYS  17          HD1       LYS  17   1.298  -4.781  12.492
  131   1HE   LYS  17          HE2       LYS  17   0.177  -6.342  13.936
  132   2HE   LYS  17          HE1       LYS  17   1.576  -7.416  13.967
  133   1HZ   LYS  17          HZ1       LYS  17   2.219  -4.748  14.781
  134   2HZ   LYS  17          HZ2       LYS  17   2.519  -6.223  15.570
  135   3HZ   LYS  17          HZ3       LYS  17   1.024  -5.441  15.765
  136    H    LEU  18           HN       LEU  18   0.156  -7.103   7.811
  137    HA   LEU  18           HA       LEU  18  -1.516  -8.965   9.297
  138   1HB   LEU  18          HB2       LEU  18  -1.807  -7.602   6.604
  139   2HB   LEU  18          HB1       LEU  18  -3.027  -8.643   7.261
  140    HG   LEU  18           HG       LEU  18  -2.711  -5.833   7.696
  141   1HD1  LEU  18          HD11      LEU  18  -4.823  -7.158   7.534
  142   2HD1  LEU  18          HD12      LEU  18  -4.797  -6.008   8.874
  143   3HD1  LEU  18          HD13      LEU  18  -4.540  -7.720   9.182
  144   1HD2  LEU  18          HD21      LEU  18  -2.600  -5.552  10.070
  145   2HD2  LEU  18          HD22      LEU  18  -1.176  -6.461   9.614
  146   3HD2  LEU  18          HD23      LEU  18  -2.545  -7.283  10.356
  147    H    ILE  19           HN       ILE  19   0.455  -9.104   6.393
  148    HA   ILE  19           HA       ILE  19  -0.338 -11.801   5.666
  149    HB   ILE  19           HB       ILE  19   2.110 -10.139   4.932
  150   1HG1  ILE  19          HG12      ILE  19  -0.398 -10.841   3.359
  151   2HG1  ILE  19          HG11      ILE  19  -0.105  -9.294   4.127
  152   1HG2  ILE  19          HG21      ILE  19   1.140 -12.789   3.824
  153   2HG2  ILE  19          HG22      ILE  19   2.644 -12.507   4.700
  154   3HG2  ILE  19          HG23      ILE  19   2.412 -11.804   3.105
  155   1HD1  ILE  19          HD11      ILE  19   0.508  -9.059   1.810
  156   2HD1  ILE  19          HD12      ILE  19   1.473 -10.533   1.862
  157   3HD1  ILE  19          HD13      ILE  19   2.003  -9.102   2.743
  158    H    ASP  20           HN       ASP  20   2.073 -10.267   7.685
  159    HA   ASP  20           HA       ASP  20   3.597 -12.687   8.213
  160   1HB   ASP  20          HB2       ASP  20   4.475 -10.316   8.395
  161   2HB   ASP  20          HB1       ASP  20   3.511 -10.154   9.862
  162    H    ASN  21           HN       ASN  21   0.687 -11.267   9.569
  163    HA   ASN  21           HA       ASN  21   0.985 -12.935  11.991
  164   1HB   ASN  21          HB2       ASN  21   0.004 -10.636  12.221
  165   2HB   ASN  21          HB1       ASN  21  -1.346 -11.139  11.200
  166   1HD2  ASN  21          HD21      ASN  21  -0.127 -13.639  13.253
  167   2HD2  ASN  21          HD22      ASN  21  -1.343 -13.562  14.434
  168    H    ASN  22           HN       ASN  22   0.140 -13.586   8.932
  169    HA   ASN  22           HA       ASN  22  -0.654 -15.630   8.102
  170   1HB   ASN  22          HB2       ASN  22  -0.160 -16.355  10.592
  171   2HB   ASN  22          HB1       ASN  22  -1.917 -16.409  10.712
  172   1HD2  ASN  22          HD21      ASN  22   0.452 -17.373   8.149
  173   2HD2  ASN  22          HD22      ASN  22  -0.206 -18.922   7.929
  174    H    LYS  23           HN       LYS  23  -2.314 -13.262   7.875
  175    HA   LYS  23           HA       LYS  23  -5.069 -14.252   8.415
  176   1HB   LYS  23          HB2       LYS  23  -4.377 -11.653   7.154
  177   2HB   LYS  23          HB1       LYS  23  -5.833 -12.073   8.041
  178   1HG   LYS  23          HG2       LYS  23  -3.644 -12.504   9.839
  179   2HG   LYS  23          HG1       LYS  23  -3.351 -10.951   9.076
  180   1HD   LYS  23          HD2       LYS  23  -5.449 -10.077   9.854
  181   2HD   LYS  23          HD1       LYS  23  -6.005 -11.686  10.335
  182   1HE   LYS  23          HE2       LYS  23  -3.689 -10.179  11.560
  183   2HE   LYS  23          HE1       LYS  23  -5.274 -10.419  12.292
  184   1HZ   LYS  23          HZ1       LYS  23  -3.122 -12.362  11.840
  185   2HZ   LYS  23          HZ2       LYS  23  -4.731 -12.907  11.842
  186   3HZ   LYS  23          HZ3       LYS  23  -4.092 -12.129  13.211
  187    H    THR  24           HN       THR  24  -6.587 -14.497   6.676
  188    HA   THR  24           HA       THR  24  -5.401 -15.416   4.163
  189    HB   THR  24           HB       THR  24  -7.424 -16.468   3.805
  190    HG1  THR  24           HG1      THR  24  -8.525 -14.113   4.899
  191   1HG2  THR  24          HG21      THR  24  -6.691 -16.905   6.201
  192   2HG2  THR  24          HG22      THR  24  -8.395 -17.201   5.861
  193   3HG2  THR  24          HG23      THR  24  -7.905 -15.729   6.696
  194    H    GLU  25           HN       GLU  25  -6.305 -14.689   2.066
  195    HA   GLU  25           HA       GLU  25  -5.952 -11.893   1.643
  196   1HB   GLU  25          HB2       GLU  25  -5.913 -13.798  -0.096
  197   2HB   GLU  25          HB1       GLU  25  -7.672 -13.677  -0.108
  198   1HG   GLU  25          HG2       GLU  25  -7.302 -11.157  -0.553
  199   2HG   GLU  25          HG1       GLU  25  -5.643 -11.611  -0.949
  200    H    LYS  26           HN       LYS  26  -8.929 -13.813   1.987
  201    HA   LYS  26           HA       LYS  26 -10.819 -11.759   1.615
  202   1HB   LYS  26          HB2       LYS  26 -10.996 -14.406   2.100
  203   2HB   LYS  26          HB1       LYS  26 -11.403 -13.813   3.704
  204   1HG   LYS  26          HG2       LYS  26 -12.791 -13.087   1.105
  205   2HG   LYS  26          HG1       LYS  26 -13.447 -14.084   2.403
  206   1HD   LYS  26          HD2       LYS  26 -13.024 -11.992   3.909
  207   2HD   LYS  26          HD1       LYS  26 -12.932 -11.113   2.382
  208   1HE   LYS  26          HE2       LYS  26 -15.220 -11.018   3.193
  209   2HE   LYS  26          HE1       LYS  26 -15.170 -12.052   1.765
  210   1HZ   LYS  26          HZ1       LYS  26 -15.634 -13.881   2.961
  211   2HZ   LYS  26          HZ2       LYS  26 -16.296 -12.770   4.063
  212   3HZ   LYS  26          HZ3       LYS  26 -14.730 -13.382   4.307
  213    H    GLU  27           HN       GLU  27  -8.904 -12.471   4.493
  214    HA   GLU  27           HA       GLU  27 -10.482 -10.699   6.193
  215   1HB   GLU  27          HB2       GLU  27  -7.756 -11.961   6.511
  216   2HB   GLU  27          HB1       GLU  27  -8.428 -10.849   7.698
  217   1HG   GLU  27          HG2       GLU  27 -10.318 -12.300   8.079
  218   2HG   GLU  27          HG1       GLU  27  -9.803 -13.375   6.784
  219    H    ILE  28           HN       ILE  28  -7.537 -10.322   4.227
  220    HA   ILE  28           HA       ILE  28  -6.825  -7.759   5.288
  221    HB   ILE  28           HB       ILE  28  -6.286  -8.718   2.465
  222   1HG1  ILE  28          HG12      ILE  28  -5.493  -9.885   5.064
  223   2HG1  ILE  28          HG11      ILE  28  -5.563 -10.637   3.499
  224   1HG2  ILE  28          HG21      ILE  28  -5.558  -6.430   3.100
  225   2HG2  ILE  28          HG22      ILE  28  -4.210  -7.486   2.700
  226   3HG2  ILE  28          HG23      ILE  28  -4.574  -7.122   4.388
  227   1HD1  ILE  28          HD11      ILE  28  -3.400  -9.520   2.921
  228   2HD1  ILE  28          HD12      ILE  28  -3.278 -10.643   4.284
  229   3HD1  ILE  28          HD13      ILE  28  -3.331  -8.904   4.575
  230    H    LEU  29           HN       LEU  29  -8.917  -8.737   2.586
  231    HA   LEU  29           HA       LEU  29  -9.455  -6.014   1.775
  232   1HB   LEU  29          HB2       LEU  29 -11.068  -8.532   1.271
  233   2HB   LEU  29          HB1       LEU  29 -11.149  -7.029   0.345
  234    HG   LEU  29           HG       LEU  29  -8.651  -8.740   0.642
  235   1HD1  LEU  29          HD11      LEU  29 -10.760  -8.559  -1.528
  236   2HD1  LEU  29          HD12      LEU  29 -10.180  -9.998  -0.690
  237   3HD1  LEU  29          HD13      LEU  29  -9.137  -9.171  -1.846
  238   1HD2  LEU  29          HD21      LEU  29  -9.318  -6.176  -0.821
  239   2HD2  LEU  29          HD22      LEU  29  -8.074  -7.250  -1.455
  240   3HD2  LEU  29          HD23      LEU  29  -7.900  -6.559   0.155
  241    H    ASP  30           HN       ASP  30 -10.875  -8.250   4.072
  242    HA   ASP  30           HA       ASP  30 -13.326  -6.762   4.527
  243   1HB   ASP  30          HB2       ASP  30 -12.936  -9.151   5.249
  244   2HB   ASP  30          HB1       ASP  30 -11.847  -8.539   6.495
  245    H    ALA  31           HN       ALA  31 -10.145  -6.772   6.131
  246    HA   ALA  31           HA       ALA  31 -10.826  -4.801   8.097
  247   1HB   ALA  31          HB1       ALA  31  -8.870  -6.417   8.131
  248   2HB   ALA  31          HB2       ALA  31  -8.490  -4.764   8.607
  249   3HB   ALA  31          HB3       ALA  31  -8.064  -5.340   6.994
  250    H    PHE  32           HN       PHE  32  -9.901  -4.485   4.725
  251    HA   PHE  32           HA       PHE  32  -8.873  -1.834   4.654
  252   1HB   PHE  32          HB2       PHE  32 -10.539  -3.487   2.775
  253   2HB   PHE  32          HB1       PHE  32 -10.168  -1.819   2.381
  254    HD1  PHE  32           HD1      PHE  32  -9.015  -2.777   0.367
  255    HD2  PHE  32           HD2      PHE  32  -7.589  -3.580   4.358
  256    HE1  PHE  32           HE1      PHE  32  -6.801  -3.422  -0.534
  257    HE2  PHE  32           HE2      PHE  32  -5.394  -4.187   3.445
  258    HZ   PHE  32           HZ       PHE  32  -4.995  -4.131   1.005
  259    H    ASP  33           HN       ASP  33 -12.011  -2.964   5.545
  260    HA   ASP  33           HA       ASP  33 -13.437  -0.521   4.883
  261   1HB   ASP  33          HB2       ASP  33 -14.609  -2.671   5.051
  262   2HB   ASP  33          HB1       ASP  33 -14.170  -2.789   6.755
  263    H    LYS  34           HN       LYS  34 -11.437  -1.502   7.553
  264    HA   LYS  34           HA       LYS  34 -12.205   1.018   8.981
  265   1HB   LYS  34          HB2       LYS  34 -11.725  -0.239  11.131
  266   2HB   LYS  34          HB1       LYS  34 -13.200  -0.722  10.293
  267   1HG   LYS  34          HG2       LYS  34 -12.113  -2.670   9.363
  268   2HG   LYS  34          HG1       LYS  34 -10.546  -2.145   9.978
  269   1HD   LYS  34          HD2       LYS  34 -11.383  -3.828  11.491
  270   2HD   LYS  34          HD1       LYS  34 -11.500  -2.271  12.308
  271   1HE   LYS  34          HE2       LYS  34 -13.840  -2.160  12.019
  272   2HE   LYS  34          HE1       LYS  34 -13.834  -3.380  10.745
  273   1HZ   LYS  34          HZ1       LYS  34 -13.842  -5.039  12.222
  274   2HZ   LYS  34          HZ2       LYS  34 -14.403  -3.869  13.319
  275   3HZ   LYS  34          HZ3       LYS  34 -12.752  -4.269  13.269
  276    H    MET  35           HN       MET  35  -9.847  -0.234   7.210
  277    HA   MET  35           HA       MET  35  -7.595   0.127   9.052
  278   1HB   MET  35          HB2       MET  35  -7.895  -1.242   6.692
  279   2HB   MET  35          HB1       MET  35  -7.043   0.174   6.116
  280   1HG   MET  35          HG2       MET  35  -5.203  -1.044   6.702
  281   2HG   MET  35          HG1       MET  35  -5.536  -0.436   8.314
  282   1HE   MET  35          HE1       MET  35  -4.405  -3.621   6.730
  283   2HE   MET  35          HE2       MET  35  -5.763  -3.090   5.740
  284   3HE   MET  35          HE3       MET  35  -5.868  -4.613   6.615
  285    H    CYS  36           HN       CYS  36  -9.121   2.043   6.394
  286    HA   CYS  36           HA       CYS  36  -7.159   4.134   6.594
  287   1HB   CYS  36          HB2       CYS  36  -9.941   3.938   5.457
  288   2HB   CYS  36          HB1       CYS  36  -9.245   5.542   5.687
  289    H    SER  37           HN       SER  37  -9.170   2.919   8.848
  290    HA   SER  37           HA       SER  37 -10.012   5.461  10.085
  291   1HB   SER  37          HB2       SER  37 -11.276   3.229  10.214
  292   2HB   SER  37          HB1       SER  37 -10.057   2.735  11.386
  293    HG   SER  37           HG       SER  37 -12.171   3.990  11.975
  294    H    LYS  38           HN       LYS  38  -7.009   4.482   9.768
  295    HA   LYS  38           HA       LYS  38  -6.256   5.026  12.633
  296   1HB   LYS  38          HB2       LYS  38  -5.013   3.188  10.586
  297   2HB   LYS  38          HB1       LYS  38  -4.073   3.806  11.945
  298   1HG   LYS  38          HG2       LYS  38  -5.735   2.887  13.515
  299   2HG   LYS  38          HG1       LYS  38  -6.680   2.273  12.157
  300   1HD   LYS  38          HD2       LYS  38  -4.618   0.978  11.444
  301   2HD   LYS  38          HD1       LYS  38  -3.894   1.429  12.988
  302   1HE   LYS  38          HE2       LYS  38  -6.470  -0.127  12.605
  303   2HE   LYS  38          HE1       LYS  38  -4.937  -0.774  13.190
  304   1HZ   LYS  38          HZ1       LYS  38  -5.095   0.912  15.016
  305   2HZ   LYS  38          HZ2       LYS  38  -6.253  -0.330  15.077
  306   3HZ   LYS  38          HZ3       LYS  38  -6.688   1.214  14.516
  307    H    LEU  39           HN       LEU  39  -6.338   6.410   9.623
  308    HA   LEU  39           HA       LEU  39  -3.808   7.966  10.017
  309   1HB   LEU  39          HB2       LEU  39  -5.653   7.850   7.618
  310   2HB   LEU  39          HB1       LEU  39  -4.083   8.646   7.681
  311    HG   LEU  39           HG       LEU  39  -4.510   5.682   8.131
  312   1HD1  LEU  39          HD11      LEU  39  -3.775   5.303   5.913
  313   2HD1  LEU  39          HD12      LEU  39  -3.265   6.977   5.714
  314   3HD1  LEU  39          HD13      LEU  39  -4.981   6.581   5.789
  315   1HD2  LEU  39          HD21      LEU  39  -2.487   6.247   9.216
  316   2HD2  LEU  39          HD22      LEU  39  -2.084   7.473   8.020
  317   3HD2  LEU  39          HD23      LEU  39  -1.948   5.767   7.611
  318    HA   PRO  40           HA       PRO  40  -6.141  11.371  11.695
  319   1HB   PRO  40          HB2       PRO  40  -4.759  13.248   9.857
  320   2HB   PRO  40          HB1       PRO  40  -4.721  13.192  11.624
  321   1HG   PRO  40          HG2       PRO  40  -2.664  12.304   9.857
  322   2HG   PRO  40          HG1       PRO  40  -2.730  12.052  11.607
  323   1HD   PRO  40          HD2       PRO  40  -3.017  10.070   9.547
  324   2HD   PRO  40          HD1       PRO  40  -3.144   9.823  11.296
  325    H    LYS  41           HN       LYS  41  -7.897  12.886  10.937
  326    HA   LYS  41           HA       LYS  41  -9.360  11.736   8.743
  327   1HB   LYS  41          HB2       LYS  41 -10.255  13.101  10.792
  328   2HB   LYS  41          HB1       LYS  41  -9.940  14.504   9.772
  329   1HG   LYS  41          HG2       LYS  41 -12.124  14.041   9.112
  330   2HG   LYS  41          HG1       LYS  41 -11.253  13.044   7.945
  331   1HD   LYS  41          HD2       LYS  41 -11.490  11.097   9.492
  332   2HD   LYS  41          HD1       LYS  41 -12.460  12.105  10.566
  333   1HE   LYS  41          HE2       LYS  41 -13.993  12.546   8.588
  334   2HE   LYS  41          HE1       LYS  41 -13.109  11.287   7.725
  335   1HZ   LYS  41          HZ1       LYS  41 -13.782   9.671   9.259
  336   2HZ   LYS  41          HZ2       LYS  41 -15.184  10.582   8.951
  337   3HZ   LYS  41          HZ3       LYS  41 -14.310  10.822  10.388
  338    H    SER  42           HN       SER  42  -6.987  14.238   8.771
  339    HA   SER  42           HA       SER  42  -7.954  15.520   6.379
  340   1HB   SER  42          HB2       SER  42  -6.577  16.761   7.961
  341   2HB   SER  42          HB1       SER  42  -5.242  15.635   7.725
  342    HG   SER  42           HG       SER  42  -6.202  16.632   5.381
  343    H    LEU  43           HN       LEU  43  -6.485  12.626   6.783
  344    HA   LEU  43           HA       LEU  43  -5.240  12.614   4.083
  345   1HB   LEU  43          HB2       LEU  43  -4.397  11.764   6.710
  346   2HB   LEU  43          HB1       LEU  43  -4.571  10.313   5.738
  347    HG   LEU  43           HG       LEU  43  -3.076  11.165   4.113
  348   1HD1  LEU  43          HD11      LEU  43  -3.499  13.752   5.482
  349   2HD1  LEU  43          HD12      LEU  43  -3.097  13.434   3.798
  350   3HD1  LEU  43          HD13      LEU  43  -1.827  13.450   5.011
  351   1HD2  LEU  43          HD21      LEU  43  -1.876  10.032   5.771
  352   2HD2  LEU  43          HD22      LEU  43  -2.130  11.312   6.953
  353   3HD2  LEU  43          HD23      LEU  43  -1.000  11.552   5.623
  354    H    SER  44           HN       SER  44  -7.883  11.747   5.858
  355    HA   SER  44           HA       SER  44  -8.686   9.190   5.411
  356   1HB   SER  44          HB2       SER  44 -10.211  10.750   6.418
  357   2HB   SER  44          HB1       SER  44 -10.295  11.708   4.943
  358    HG   SER  44           HG       SER  44 -11.916   9.838   5.593
  359    H    GLU  45           HN       GLU  45  -9.479  11.712   3.069
  360    HA   GLU  45           HA       GLU  45 -10.554  10.242   1.070
  361   1HB   GLU  45          HB2       GLU  45  -8.946  12.780   0.858
  362   2HB   GLU  45          HB1       GLU  45 -10.106  12.200  -0.340
  363   1HG   GLU  45          HG2       GLU  45 -11.909  12.282   1.338
  364   2HG   GLU  45          HG1       GLU  45 -10.759  12.839   2.554
  365    H    GLU  46           HN       GLU  46  -7.191  11.409   0.847
  366    HA   GLU  46           HA       GLU  46  -6.646  10.272  -1.681
  367   1HB   GLU  46          HB2       GLU  46  -4.753  10.612   0.657
  368   2HB   GLU  46          HB1       GLU  46  -4.283  10.416  -1.029
  369   1HG   GLU  46          HG2       GLU  46  -6.095  12.657  -0.121
  370   2HG   GLU  46          HG1       GLU  46  -4.340  12.820  -0.141
  371    H    CYS  47           HN       CYS  47  -7.015   8.757   1.409
  372    HA   CYS  47           HA       CYS  47  -5.605   6.328   0.587
  373   1HB   CYS  47          HB2       CYS  47  -5.908   5.654   2.783
  374   2HB   CYS  47          HB1       CYS  47  -6.236   7.371   3.027
  375    H    GLN  48           HN       GLN  48  -8.985   7.355   0.921
  376    HA   GLN  48           HA       GLN  48 -10.214   4.913   0.241
  377   1HB   GLN  48          HB2       GLN  48 -11.454   6.965   0.934
  378   2HB   GLN  48          HB1       GLN  48 -11.107   7.680  -0.640
  379   1HG   GLN  48          HG2       GLN  48 -12.322   5.880  -1.765
  380   2HG   GLN  48          HG1       GLN  48 -12.609   5.080  -0.219
  381   1HE2  GLN  48          HE21      GLN  48 -14.975   5.338  -0.626
  382   2HE2  GLN  48          HE22      GLN  48 -15.717   6.841  -0.363
  383    H    GLU  49           HN       GLU  49  -8.900   7.429  -1.919
  384    HA   GLU  49           HA       GLU  49  -9.702   6.120  -4.342
  385   1HB   GLU  49          HB2       GLU  49  -9.141   8.485  -4.334
  386   2HB   GLU  49          HB1       GLU  49  -7.501   8.128  -3.795
  387   1HG   GLU  49          HG2       GLU  49  -6.957   7.048  -5.860
  388   2HG   GLU  49          HG1       GLU  49  -8.647   7.027  -6.369
  389    H    VAL  50           HN       VAL  50  -6.681   5.991  -2.435
  390    HA   VAL  50           HA       VAL  50  -5.308   4.354  -4.350
  391    HB   VAL  50           HB       VAL  50  -4.782   4.485  -1.376
  392   1HG1  VAL  50          HG11      VAL  50  -3.060   3.661  -3.720
  393   2HG1  VAL  50          HG12      VAL  50  -3.695   2.600  -2.460
  394   3HG1  VAL  50          HG13      VAL  50  -2.496   3.826  -2.058
  395   1HG2  VAL  50          HG21      VAL  50  -3.180   6.035  -3.396
  396   2HG2  VAL  50          HG22      VAL  50  -3.507   6.412  -1.705
  397   3HG2  VAL  50          HG23      VAL  50  -4.746   6.683  -2.924
  398    H    VAL  51           HN       VAL  51  -6.937   3.560  -1.249
  399    HA   VAL  51           HA       VAL  51  -6.549   0.779  -1.524
  400    HB   VAL  51           HB       VAL  51  -8.805   2.196  -0.055
  401   1HG1  VAL  51          HG11      VAL  51  -8.687   0.200   1.436
  402   2HG1  VAL  51          HG12      VAL  51  -7.544  -0.526   0.308
  403   3HG1  VAL  51          HG13      VAL  51  -9.198  -0.192  -0.206
  404   1HG2  VAL  51          HG21      VAL  51  -6.467   2.994   0.501
  405   2HG2  VAL  51          HG22      VAL  51  -6.118   1.355   1.050
  406   3HG2  VAL  51          HG23      VAL  51  -7.357   2.313   1.864
  407    H    ASP  52           HN       ASP  52  -9.433   2.672  -2.329
  408    HA   ASP  52           HA       ASP  52 -10.946   0.499  -3.334
  409   1HB   ASP  52          HB2       ASP  52 -11.898   2.678  -2.715
  410   2HB   ASP  52          HB1       ASP  52 -11.116   3.418  -4.110
  411    H    THR  53           HN       THR  53  -8.837   2.794  -5.084
  412    HA   THR  53           HA       THR  53  -9.394   1.475  -7.650
  413    HB   THR  53           HB       THR  53  -7.313   3.573  -7.026
  414    HG1  THR  53           HG1      THR  53  -9.860   3.798  -6.697
  415   1HG2  THR  53          HG21      THR  53  -8.811   2.911  -9.575
  416   2HG2  THR  53          HG22      THR  53  -7.172   2.366  -9.213
  417   3HG2  THR  53          HG23      THR  53  -7.510   4.088  -9.393
  418    H    TYR  54           HN       TYR  54  -6.639   1.663  -5.384
  419    HA   TYR  54           HA       TYR  54  -5.289  -0.409  -7.081
  420   1HB   TYR  54          HB2       TYR  54  -4.167   1.581  -5.124
  421   2HB   TYR  54          HB1       TYR  54  -3.216   0.331  -5.922
  422    HD1  TYR  54           HD1      TYR  54  -2.792   0.422  -8.347
  423    HD2  TYR  54           HD2      TYR  54  -5.079   3.453  -6.371
  424    HE1  TYR  54           HE1      TYR  54  -2.574   1.889 -10.336
  425    HE2  TYR  54           HE2      TYR  54  -4.868   4.926  -8.333
  426    HH   TYR  54           HH       TYR  54  -4.470   4.499 -10.907
  427    H    GLY  55           HN       GLY  55  -7.330  -1.068  -5.078
  428   1HA   GLY  55          HA2       GLY  55  -5.910  -2.122  -2.763
  429   2HA   GLY  55          HA1       GLY  55  -7.617  -2.347  -3.118
  430    H    SER  56           HN       SER  56  -7.673  -3.719  -5.486
  431    HA   SER  56           HA       SER  56  -6.826  -6.314  -4.618
  432   1HB   SER  56          HB2       SER  56  -7.497  -5.741  -7.493
  433   2HB   SER  56          HB1       SER  56  -7.848  -7.176  -6.528
  434    HG   SER  56           HG       SER  56  -9.251  -5.786  -5.267
  435    H    SER  57           HN       SER  57  -5.401  -3.895  -6.682
  436    HA   SER  57           HA       SER  57  -3.555  -5.755  -7.892
  437   1HB   SER  57          HB2       SER  57  -4.023  -2.829  -8.082
  438   2HB   SER  57          HB1       SER  57  -2.375  -3.350  -8.427
  439    HG   SER  57           HG       SER  57  -3.371  -3.603 -10.321
  440    H    ILE  58           HN       ILE  58  -3.153  -3.330  -5.278
  441    HA   ILE  58           HA       ILE  58  -0.379  -3.788  -4.789
  442    HB   ILE  58           HB       ILE  58  -2.654  -3.118  -2.905
  443   1HG1  ILE  58          HG12      ILE  58  -0.414  -1.390  -4.003
  444   2HG1  ILE  58          HG11      ILE  58  -2.022  -1.461  -4.712
  445   1HG2  ILE  58          HG21      ILE  58  -0.669  -2.339  -1.422
  446   2HG2  ILE  58          HG22      ILE  58   0.325  -3.373  -2.447
  447   3HG2  ILE  58          HG23      ILE  58  -0.987  -4.072  -1.501
  448   1HD1  ILE  58          HD11      ILE  58  -2.106   0.414  -3.251
  449   2HD1  ILE  58          HD12      ILE  58  -1.217  -0.446  -1.989
  450   3HD1  ILE  58          HD13      ILE  58  -2.889  -0.878  -2.343
  451    H    LEU  59           HN       LEU  59  -3.209  -5.190  -3.306
  452    HA   LEU  59           HA       LEU  59  -1.922  -7.135  -1.711
  453   1HB   LEU  59          HB2       LEU  59  -4.229  -6.484  -1.345
  454   2HB   LEU  59          HB1       LEU  59  -4.689  -7.051  -2.946
  455    HG   LEU  59           HG       LEU  59  -4.230  -9.350  -2.332
  456   1HD1  LEU  59          HD11      LEU  59  -2.358  -9.270  -0.880
  457   2HD1  LEU  59          HD12      LEU  59  -3.667  -9.740   0.196
  458   3HD1  LEU  59          HD13      LEU  59  -3.107  -8.069   0.168
  459   1HD2  LEU  59          HD21      LEU  59  -6.437  -8.903  -1.724
  460   2HD2  LEU  59          HD22      LEU  59  -5.983  -7.717  -0.503
  461   3HD2  LEU  59          HD23      LEU  59  -5.785  -9.432  -0.178
  462    H    SER  60           HN       SER  60  -2.602  -7.106  -5.165
  463    HA   SER  60           HA       SER  60  -2.397  -9.975  -5.325
  464   1HB   SER  60          HB2       SER  60  -2.541  -7.778  -7.368
  465   2HB   SER  60          HB1       SER  60  -2.218  -9.432  -7.881
  466    HG   SER  60           HG       SER  60  -4.268  -9.174  -6.066
  467    H    ILE  61           HN       ILE  61  -0.276  -7.217  -5.909
  468    HA   ILE  61           HA       ILE  61   1.936  -8.642  -7.089
  469    HB   ILE  61           HB       ILE  61   2.106  -6.081  -5.488
  470   1HG1  ILE  61          HG12      ILE  61   0.573  -6.609  -7.951
  471   2HG1  ILE  61          HG11      ILE  61   0.593  -5.177  -6.931
  472   1HG2  ILE  61          HG21      ILE  61   4.204  -7.203  -6.235
  473   2HG2  ILE  61          HG22      ILE  61   3.993  -5.598  -6.923
  474   3HG2  ILE  61          HG23      ILE  61   3.668  -7.029  -7.905
  475   1HD1  ILE  61          HD11      ILE  61   1.320  -4.557  -9.151
  476   2HD1  ILE  61          HD12      ILE  61   2.556  -5.811  -9.147
  477   3HD1  ILE  61          HD13      ILE  61   2.691  -4.434  -8.051
  478    H    LEU  62           HN       LEU  62   1.290  -7.530  -3.766
  479    HA   LEU  62           HA       LEU  62   3.708  -8.257  -2.604
  480   1HB   LEU  62          HB2       LEU  62   0.967  -7.725  -1.717
  481   2HB   LEU  62          HB1       LEU  62   1.757  -8.884  -0.653
  482    HG   LEU  62           HG       LEU  62   3.174  -6.340  -1.480
  483   1HD1  LEU  62          HD11      LEU  62   2.292  -5.559   0.887
  484   2HD1  LEU  62          HD12      LEU  62   0.970  -6.661   0.519
  485   3HD1  LEU  62          HD13      LEU  62   1.315  -5.316  -0.559
  486   1HD2  LEU  62          HD21      LEU  62   4.242  -6.743   0.770
  487   2HD2  LEU  62          HD22      LEU  62   4.545  -8.019  -0.400
  488   3HD2  LEU  62          HD23      LEU  62   3.351  -8.252   0.872
  489    H    LEU  63           HN       LEU  63   0.996 -10.354  -3.465
  490    HA   LEU  63           HA       LEU  63   2.117 -12.689  -2.111
  491   1HB   LEU  63          HB2       LEU  63   0.053 -12.621  -4.329
  492   2HB   LEU  63          HB1       LEU  63   0.349 -13.937  -3.193
  493    HG   LEU  63           HG       LEU  63  -0.661 -11.166  -2.501
  494   1HD1  LEU  63          HD11      LEU  63  -1.942 -13.900  -2.618
  495   2HD1  LEU  63          HD12      LEU  63  -2.443 -12.429  -3.453
  496   3HD1  LEU  63          HD13      LEU  63  -2.652 -12.567  -1.707
  497   1HD2  LEU  63          HD21      LEU  63  -0.996 -12.402  -0.211
  498   2HD2  LEU  63          HD22      LEU  63   0.600 -11.779  -0.618
  499   3HD2  LEU  63          HD23      LEU  63   0.249 -13.496  -0.817
  500    H    GLU  64           HN       GLU  64   2.894 -11.099  -5.030
  501    HA   GLU  64           HA       GLU  64   3.929 -13.561  -6.276
  502   1HB   GLU  64          HB2       GLU  64   3.862 -10.653  -7.093
  503   2HB   GLU  64          HB1       GLU  64   4.882 -11.808  -7.953
  504   1HG   GLU  64          HG2       GLU  64   1.919 -12.225  -7.504
  505   2HG   GLU  64          HG1       GLU  64   2.583 -11.482  -8.956
  506    H    GLU  65           HN       GLU  65   4.868 -12.706  -3.691
  507    HA   GLU  65           HA       GLU  65   6.926 -12.530  -2.493
  508   1HB   GLU  65          HB2       GLU  65   7.807 -13.839  -5.060
  509   2HB   GLU  65          HB1       GLU  65   8.751 -13.781  -3.572
  510   1HG   GLU  65          HG2       GLU  65   5.949 -14.921  -3.707
  511   2HG   GLU  65          HG1       GLU  65   7.401 -15.905  -3.898
  512    H    VAL  66           HN       VAL  66   6.238 -10.198  -4.302
  513    HA   VAL  66           HA       VAL  66   8.900  -9.275  -5.246
  514    HB   VAL  66           HB       VAL  66   6.048  -8.437  -5.595
  515   1HG1  VAL  66          HG11      VAL  66   8.390  -6.533  -5.664
  516   2HG1  VAL  66          HG12      VAL  66   6.833  -6.320  -4.865
  517   3HG1  VAL  66          HG13      VAL  66   6.936  -6.247  -6.623
  518   1HG2  VAL  66          HG21      VAL  66   7.507  -9.800  -7.223
  519   2HG2  VAL  66          HG22      VAL  66   8.341  -8.284  -7.555
  520   3HG2  VAL  66          HG23      VAL  66   6.618  -8.433  -7.899
  521    H    SER  67           HN       SER  67   9.990  -7.518  -4.220
  522    HA   SER  67           HA       SER  67   9.788  -7.243  -1.441
  523   1HB   SER  67          HB2       SER  67  11.433  -5.598  -1.621
  524   2HB   SER  67          HB1       SER  67  11.598  -6.389  -3.181
  525    HG   SER  67           HG       SER  67   9.762  -4.699  -3.630
  526    HA   PRO  68           HA       PRO  68   6.198  -4.730  -0.846
  527   1HB   PRO  68          HB2       PRO  68   7.137  -3.141   1.338
  528   2HB   PRO  68          HB1       PRO  68   6.285  -4.677   1.447
  529   1HG   PRO  68          HG2       PRO  68   9.135  -4.129   1.903
  530   2HG   PRO  68          HG1       PRO  68   8.194  -5.562   2.347
  531   1HD   PRO  68          HD2       PRO  68  10.084  -5.391   0.232
  532   2HD   PRO  68          HD1       PRO  68   8.930  -6.709   0.519
  533    H    GLU  69           HN       GLU  69   9.284  -2.868  -0.778
  534    HA   GLU  69           HA       GLU  69   7.884  -0.388  -1.405
  535   1HB   GLU  69          HB2       GLU  69  10.460   0.279  -1.881
  536   2HB   GLU  69          HB1       GLU  69   9.791   0.171  -0.256
  537   1HG   GLU  69          HG2       GLU  69  10.652  -2.072   0.027
  538   2HG   GLU  69          HG1       GLU  69  11.172  -2.135  -1.657
  539    H    LEU  70           HN       LEU  70   9.016  -2.984  -3.356
  540    HA   LEU  70           HA       LEU  70   9.537  -1.332  -5.686
  541   1HB   LEU  70          HB2       LEU  70   9.044  -4.297  -5.325
  542   2HB   LEU  70          HB1       LEU  70   9.164  -3.601  -6.927
  543    HG   LEU  70           HG       LEU  70  11.298  -3.118  -4.875
  544   1HD1  LEU  70          HD11      LEU  70  11.402  -5.319  -6.941
  545   2HD1  LEU  70          HD12      LEU  70  10.901  -5.618  -5.280
  546   3HD1  LEU  70          HD13      LEU  70  12.526  -5.029  -5.615
  547   1HD2  LEU  70          HD21      LEU  70  12.701  -2.934  -6.982
  548   2HD2  LEU  70          HD22      LEU  70  11.500  -1.667  -6.780
  549   3HD2  LEU  70          HD23      LEU  70  11.199  -3.000  -7.891
  550    H    VAL  71           HN       VAL  71   6.808  -2.327  -3.984
  551    HA   VAL  71           HA       VAL  71   4.905  -2.443  -6.106
  552    HB   VAL  71           HB       VAL  71   4.683  -1.924  -3.129
  553   1HG1  VAL  71          HG11      VAL  71   2.137  -2.144  -3.459
  554   2HG1  VAL  71          HG12      VAL  71   2.440  -1.716  -5.144
  555   3HG1  VAL  71          HG13      VAL  71   2.851  -0.586  -3.856
  556   1HG2  VAL  71          HG21      VAL  71   3.354  -4.066  -3.264
  557   2HG2  VAL  71          HG22      VAL  71   5.048  -4.219  -3.729
  558   3HG2  VAL  71          HG23      VAL  71   3.795  -4.154  -4.970
  559    H    CYS  72           HN       CYS  72   5.571   0.354  -3.911
  560    HA   CYS  72           HA       CYS  72   3.794   1.983  -5.369
  561   1HB   CYS  72          HB2       CYS  72   5.188   2.310  -3.059
  562   2HB   CYS  72          HB1       CYS  72   6.134   3.362  -4.101
  563    H    SER  73           HN       SER  73   7.133   1.119  -5.939
  564    HA   SER  73           HA       SER  73   7.603   3.223  -7.932
  565   1HB   SER  73          HB2       SER  73   9.374   1.897  -6.560
  566   2HB   SER  73          HB1       SER  73   9.173   0.654  -7.792
  567    HG   SER  73           HG       SER  73  10.841   2.205  -8.260
  568    H    MET  74           HN       MET  74   6.618  -0.209  -8.161
  569    HA   MET  74           HA       MET  74   6.716  -0.232 -11.081
  570   1HB   MET  74          HB2       MET  74   5.825  -2.081  -8.936
  571   2HB   MET  74          HB1       MET  74   4.959  -2.249 -10.461
  572   1HG   MET  74          HG2       MET  74   7.321  -2.324 -11.547
  573   2HG   MET  74          HG1       MET  74   7.895  -2.638  -9.914
  574   1HE   MET  74          HE1       MET  74   5.566  -5.725  -8.991
  575   2HE   MET  74          HE2       MET  74   4.779  -4.164  -9.183
  576   3HE   MET  74          HE3       MET  74   6.341  -4.263  -8.376
  577    H    LEU  75           HN       LEU  75   4.064   0.345  -8.738
  578    HA   LEU  75           HA       LEU  75   2.091   0.553 -10.857
  579   1HB   LEU  75          HB2       LEU  75   1.929   1.695  -8.050
  580   2HB   LEU  75          HB1       LEU  75   0.581   1.364  -9.136
  581    HG   LEU  75           HG       LEU  75   2.420  -0.663  -7.843
  582   1HD1  LEU  75          HD11      LEU  75   0.706   0.000  -6.333
  583   2HD1  LEU  75          HD12      LEU  75   0.181  -1.536  -7.020
  584   3HD1  LEU  75          HD13      LEU  75  -0.516  -0.026  -7.603
  585   1HD2  LEU  75          HD21      LEU  75   0.766  -2.296  -9.032
  586   2HD2  LEU  75          HD22      LEU  75   2.082  -1.604  -9.976
  587   3HD2  LEU  75          HD23      LEU  75   0.453  -0.938 -10.110
  588    H    HIS  76           HN       HIS  76   4.643   2.362 -10.714
  589    HA   HIS  76           HA       HIS  76   5.175   4.601 -11.210
  590   1HB   HIS  76          HB2       HIS  76   2.509   4.419 -12.655
  591   2HB   HIS  76          HB1       HIS  76   3.782   5.598 -12.971
  592    HD1  HIS  76           HD1      HIS  76   6.227   4.369 -13.539
  593    HD2  HIS  76           HD2      HIS  76   2.749   2.181 -14.244
  594    HE1  HIS  76           HE1      HIS  76   6.864   2.504 -15.130
  595    H    LEU  77           HN       LEU  77   3.439   4.031  -8.764
  596    HA   LEU  77           HA       LEU  77   1.774   6.439  -8.577
  597   1HB   LEU  77          HB2       LEU  77   1.830   3.893  -7.314
  598   2HB   LEU  77          HB1       LEU  77   2.201   5.039  -6.041
  599    HG   LEU  77           HG       LEU  77   0.149   6.212  -6.399
  600   1HD1  LEU  77          HD11      LEU  77  -1.448   4.927  -8.228
  601   2HD1  LEU  77          HD12      LEU  77   0.126   4.833  -9.012
  602   3HD1  LEU  77          HD13      LEU  77  -0.539   6.397  -8.564
  603   1HD2  LEU  77          HD21      LEU  77  -0.816   3.394  -6.658
  604   2HD2  LEU  77          HD22      LEU  77  -1.308   4.638  -5.523
  605   3HD2  LEU  77          HD23      LEU  77   0.224   3.802  -5.299
  606    H    CYS  78           HN       CYS  78   5.031   5.595  -8.035
  607    HA   CYS  78           HA       CYS  78   5.453   8.174  -6.554
  608   1HB   CYS  78          HB2       CYS  78   6.741   5.471  -6.103
  609   2HB   CYS  78          HB1       CYS  78   7.553   6.959  -5.618
  610    H    SER  79           HN       SER  79   7.775   8.967  -6.922
  611    HA   SER  79           HA       SER  79   8.289   8.956  -9.783
  612   1HB   SER  79          HB2       SER  79  10.011  10.550  -9.307
  613   2HB   SER  79          HB1       SER  79   8.702  10.905  -8.182
  614    HG   SER  79           HG       SER  79   9.875   9.492  -6.688
  615    H    GLY  80           HN       GLY  80  10.130   7.780  -6.938
  616   1HA   GLY  80          HA2       GLY  80  10.958   5.346  -7.467
  617   2HA   GLY  80          HA1       GLY  80  11.840   6.160  -8.762
  618    H    LEU  81           HN       LEU  81  12.361   4.936  -5.808
  619    HA   LEU  81           HA       LEU  81  13.520   6.825  -4.151
  620   1HB   LEU  81          HB2       LEU  81  14.964   4.249  -4.788
  621   2HB   LEU  81          HB1       LEU  81  14.890   5.103  -3.248
  622    HG   LEU  81           HG       LEU  81  12.626   3.632  -4.627
  623   1HD1  LEU  81          HD11      LEU  81  14.084   3.226  -2.000
  624   2HD1  LEU  81          HD12      LEU  81  14.171   2.182  -3.419
  625   3HD1  LEU  81          HD13      LEU  81  12.665   2.312  -2.510
  626   1HD2  LEU  81          HD21      LEU  81  11.396   4.283  -2.461
  627   2HD2  LEU  81          HD22      LEU  81  11.611   5.559  -3.658
  628   3HD2  LEU  81          HD23      LEU  81  12.660   5.493  -2.242
  629    H    VAL  82           HN       VAL  82  14.575   6.029  -7.397
  630    HA   VAL  82           HA       VAL  82  16.937   7.839  -6.941
  631    HB   VAL  82           HB       VAL  82  17.809   5.618  -7.070
  632   1HG1  VAL  82          HG11      VAL  82  17.191   3.976  -8.600
  633   2HG1  VAL  82          HG12      VAL  82  16.670   5.139  -9.813
  634   3HG1  VAL  82          HG13      VAL  82  15.655   4.814  -8.411
  635   1HG2  VAL  82          HG21      VAL  82  18.872   7.535  -8.385
  636   2HG2  VAL  82          HG22      VAL  82  18.164   6.806  -9.826
  637   3HG2  VAL  82          HG23      VAL  82  19.342   5.906  -8.871
  638    HA   PRO  83           HA       PRO  83  14.520   9.443 -10.503
  639   1HB   PRO  83          HB2       PRO  83  14.989  12.139  -9.838
  640   2HB   PRO  83          HB1       PRO  83  13.557  11.214  -9.366
  641   1HG   PRO  83          HG2       PRO  83  15.765  12.136  -7.664
  642   2HG   PRO  83          HG1       PRO  83  14.213  11.439  -7.177
  643   1HD   PRO  83          HD2       PRO  83  16.812  10.138  -7.229
  644   2HD   PRO  83          HD1       PRO  83  15.264   9.457  -6.695
  645    H    ARG  84           HN       ARG  84  15.834   9.135 -12.255
  646    HA   ARG  84           HA       ARG  84  18.617   9.942 -12.288
  647   1HB   ARG  84          HB2       ARG  84  18.532   9.244 -14.675
  648   2HB   ARG  84          HB1       ARG  84  17.875   8.019 -13.593
  649   1HG   ARG  84          HG2       ARG  84  16.087   8.021 -15.036
  650   2HG   ARG  84          HG1       ARG  84  15.597   9.464 -14.157
  651   1HD   ARG  84          HD2       ARG  84  17.051  10.763 -15.862
  652   2HD   ARG  84          HD1       ARG  84  17.027   9.278 -16.809
  653    HE   ARG  84           HE       ARG  84  14.357   9.732 -16.227
  654   1HH1  ARG  84          HH21      ARG  84  16.963  11.529 -17.594
  655   2HH1  ARG  84          HH22      ARG  84  15.945  12.471 -18.631
  656   1HH2  ARG  84          HH11      ARG  84  13.012  10.952 -17.574
  657   2HH2  ARG  84          HH12      ARG  84  13.709  12.145 -18.620
  Start of MODEL    6
    1   1H    SER   1          HT1       SER   1   7.149  16.975  -0.623
    2   2H    SER   1          HT2       SER   1   6.039  17.909  -1.506
    3   3H    SER   1          HT3       SER   1   6.165  16.239  -1.791
    4    HA   SER   1           HA       SER   1   5.603  16.173   0.790
    5   1HB   SER   1          HB2       SER   1   3.942  17.885   1.298
    6   2HB   SER   1          HB1       SER   1   5.453  18.667   0.845
    7    HG   SER   1           HG       SER   1   3.030  18.465  -0.544
    8    H    ASP   2           HN       ASP   2   5.288  14.892  -1.774
    9    HA   ASP   2           HA       ASP   2   2.545  14.844  -2.616
   10   1HB   ASP   2          HB2       ASP   2   4.259  14.049  -4.111
   11   2HB   ASP   2          HB1       ASP   2   4.797  12.850  -2.937
   12    H    VAL   3           HN       VAL   3   0.943  14.265  -1.305
   13    HA   VAL   3           HA       VAL   3   1.248  12.569   1.010
   14    HB   VAL   3           HB       VAL   3  -0.934  13.122   1.506
   15   1HG1  VAL   3          HG11      VAL   3  -1.216  15.426   0.993
   16   2HG1  VAL   3          HG12      VAL   3  -0.357  15.269  -0.538
   17   3HG1  VAL   3          HG13      VAL   3   0.525  15.148   0.984
   18   1HG2  VAL   3          HG21      VAL   3  -2.149  12.082  -0.274
   19   2HG2  VAL   3          HG22      VAL   3  -1.449  13.163  -1.481
   20   3HG2  VAL   3          HG23      VAL   3  -2.611  13.785  -0.308
   21    H    TYR   4           HN       TYR   4   0.732  11.799  -2.370
   22    HA   TYR   4           HA       TYR   4  -0.891   9.495  -1.775
   23   1HB   TYR   4          HB2       TYR   4   0.421  10.611  -4.241
   24   2HB   TYR   4          HB1       TYR   4  -0.079   8.931  -4.290
   25    HD1  TYR   4           HD1      TYR   4  -2.500   8.361  -3.681
   26    HD2  TYR   4           HD2      TYR   4  -1.162  12.344  -4.559
   27    HE1  TYR   4           HE1      TYR   4  -4.827   9.024  -4.181
   28    HE2  TYR   4           HE2      TYR   4  -3.499  13.019  -5.040
   29    HH   TYR   4           HH       TYR   4  -5.703  11.551  -5.859
   30    H    CYS   5           HN       CYS   5   2.539   9.811  -2.672
   31    HA   CYS   5           HA       CYS   5   3.161   7.031  -2.579
   32   1HB   CYS   5          HB2       CYS   5   4.618   9.184  -3.217
   33   2HB   CYS   5          HB1       CYS   5   5.200   8.989  -1.567
   34    H    GLU   6           HN       GLU   6   3.172   9.481   0.058
   35    HA   GLU   6           HA       GLU   6   4.205   7.811   2.083
   36   1HB   GLU   6          HB2       GLU   6   2.038   9.888   2.474
   37   2HB   GLU   6          HB1       GLU   6   3.206   9.327   3.672
   38   1HG   GLU   6          HG2       GLU   6   3.899  10.749   1.089
   39   2HG   GLU   6          HG1       GLU   6   3.888  11.493   2.688
   40    H    VAL   7           HN       VAL   7   0.842   8.157   0.966
   41    HA   VAL   7           HA       VAL   7  -0.205   6.335   2.980
   42    HB   VAL   7           HB       VAL   7  -1.296   7.383   0.341
   43   1HG1  VAL   7          HG11      VAL   7  -2.464   5.352   0.588
   44   2HG1  VAL   7          HG12      VAL   7  -3.530   6.523   1.363
   45   3HG1  VAL   7          HG13      VAL   7  -2.504   5.479   2.346
   46   1HG2  VAL   7          HG21      VAL   7  -1.331   9.191   1.827
   47   2HG2  VAL   7          HG22      VAL   7  -1.598   8.171   3.237
   48   3HG2  VAL   7          HG23      VAL   7  -2.920   8.489   2.116
   49    H    CYS   8           HN       CYS   8   0.953   5.815  -0.361
   50    HA   CYS   8           HA       CYS   8   0.055   3.118  -0.624
   51   1HB   CYS   8          HB2       CYS   8   1.480   3.015  -2.465
   52   2HB   CYS   8          HB1       CYS   8   1.228   4.750  -2.323
   53    H    GLU   9           HN       GLU   9   3.111   4.427   0.683
   54    HA   GLU   9           HA       GLU   9   4.187   1.868   1.349
   55   1HB   GLU   9          HB2       GLU   9   4.741   4.630   2.468
   56   2HB   GLU   9          HB1       GLU   9   5.678   3.199   2.896
   57   1HG   GLU   9          HG2       GLU   9   6.094   2.862   0.417
   58   2HG   GLU   9          HG1       GLU   9   5.390   4.460   0.162
   59    H    PHE  10           HN       PHE  10   1.973   4.078   3.069
   60    HA   PHE  10           HA       PHE  10   2.285   2.803   5.596
   61   1HB   PHE  10          HB2       PHE  10   1.194   5.005   5.367
   62   2HB   PHE  10          HB1       PHE  10  -0.140   4.251   4.488
   63    HD1  PHE  10           HD1      PHE  10  -1.805   2.940   5.611
   64    HD2  PHE  10           HD2      PHE  10   1.574   4.484   7.750
   65    HE1  PHE  10           HE1      PHE  10  -2.876   2.295   7.763
   66    HE2  PHE  10           HE2      PHE  10   0.516   3.848   9.903
   67    HZ   PHE  10           HZ       PHE  10  -1.711   2.756   9.907
   68    H    LEU  11           HN       LEU  11  -0.101   2.261   2.981
   69    HA   LEU  11           HA       LEU  11  -1.491   0.098   4.274
   70   1HB   LEU  11          HB2       LEU  11  -1.075   0.624   1.318
   71   2HB   LEU  11          HB1       LEU  11  -2.209  -0.554   1.989
   72    HG   LEU  11           HG       LEU  11  -2.324   2.339   2.864
   73   1HD1  LEU  11          HD11      LEU  11  -4.011   2.727   1.079
   74   2HD1  LEU  11          HD12      LEU  11  -3.633   1.143   0.403
   75   3HD1  LEU  11          HD13      LEU  11  -2.407   2.410   0.418
   76   1HD2  LEU  11          HD21      LEU  11  -3.692   0.800   4.145
   77   2HD2  LEU  11          HD22      LEU  11  -4.327   0.063   2.675
   78   3HD2  LEU  11          HD23      LEU  11  -4.764   1.717   3.091
   79    H    VAL  12           HN       VAL  12   1.348   0.062   2.042
   80    HA   VAL  12           HA       VAL  12   1.559  -2.757   1.871
   81    HB   VAL  12           HB       VAL  12   3.530  -0.474   1.657
   82   1HG1  VAL  12          HG11      VAL  12   4.125  -3.439   1.517
   83   2HG1  VAL  12          HG12      VAL  12   4.935  -2.223   2.507
   84   3HG1  VAL  12          HG13      VAL  12   5.150  -2.217   0.760
   85   1HG2  VAL  12          HG21      VAL  12   1.810  -1.037  -0.135
   86   2HG2  VAL  12          HG22      VAL  12   2.673  -2.558  -0.370
   87   3HG2  VAL  12          HG23      VAL  12   3.487  -1.023  -0.679
   88    H    LYS  13           HN       LYS  13   3.093  -0.500   4.229
   89    HA   LYS  13           HA       LYS  13   4.500  -2.467   5.720
   90   1HB   LYS  13          HB2       LYS  13   5.011  -0.181   6.149
   91   2HB   LYS  13          HB1       LYS  13   3.329   0.212   6.497
   92   1HG   LYS  13          HG2       LYS  13   3.433  -0.604   8.659
   93   2HG   LYS  13          HG1       LYS  13   4.555  -1.895   8.233
   94   1HD   LYS  13          HD2       LYS  13   5.683  -0.274   9.669
   95   2HD   LYS  13          HD1       LYS  13   6.383  -0.213   8.051
   96   1HE   LYS  13          HE2       LYS  13   5.060   1.756   7.504
   97   2HE   LYS  13          HE1       LYS  13   4.224   1.659   9.054
   98   1HZ   LYS  13          HZ1       LYS  13   6.214   3.247   8.807
   99   2HZ   LYS  13          HZ2       LYS  13   7.161   1.845   8.960
  100   3HZ   LYS  13          HZ3       LYS  13   6.099   2.297  10.207
  101    H    GLU  14           HN       GLU  14   1.170  -1.298   6.061
  102    HA   GLU  14           HA       GLU  14   0.626  -2.908   8.418
  103   1HB   GLU  14          HB2       GLU  14  -1.146  -1.472   6.429
  104   2HB   GLU  14          HB1       GLU  14  -1.812  -2.425   7.754
  105   1HG   GLU  14          HG2       GLU  14  -0.303  -1.009   9.299
  106   2HG   GLU  14          HG1       GLU  14  -0.109   0.067   7.916
  107    H    VAL  15           HN       VAL  15   0.103  -3.395   4.915
  108    HA   VAL  15           HA       VAL  15  -1.422  -5.784   5.284
  109    HB   VAL  15           HB       VAL  15   0.142  -4.641   2.964
  110   1HG1  VAL  15          HG11      VAL  15  -0.854  -6.545   1.601
  111   2HG1  VAL  15          HG12      VAL  15  -1.194  -7.357   3.128
  112   3HG1  VAL  15          HG13      VAL  15   0.476  -7.012   2.668
  113   1HG2  VAL  15          HG21      VAL  15  -2.786  -5.342   3.326
  114   2HG2  VAL  15          HG22      VAL  15  -2.078  -4.460   1.973
  115   3HG2  VAL  15          HG23      VAL  15  -2.103  -3.736   3.581
  116    H    THR  16           HN       THR  16   2.117  -5.317   4.795
  117    HA   THR  16           HA       THR  16   2.605  -8.102   4.670
  118    HB   THR  16           HB       THR  16   4.848  -7.742   4.875
  119    HG1  THR  16           HG1      THR  16   4.086  -5.665   6.615
  120   1HG2  THR  16          HG21      THR  16   5.220  -6.158   3.281
  121   2HG2  THR  16          HG22      THR  16   4.501  -4.885   4.260
  122   3HG2  THR  16          HG23      THR  16   3.471  -5.944   3.298
  123    H    LYS  17           HN       LYS  17   2.406  -5.941   7.481
  124    HA   LYS  17           HA       LYS  17   3.253  -7.870   9.401
  125   1HB   LYS  17          HB2       LYS  17   2.911  -5.458   9.934
  126   2HB   LYS  17          HB1       LYS  17   1.173  -5.688   9.781
  127   1HG   LYS  17          HG2       LYS  17   1.645  -7.670  11.529
  128   2HG   LYS  17          HG1       LYS  17   3.041  -6.674  11.914
  129   1HD   LYS  17          HD2       LYS  17   1.613  -4.795  12.463
  130   2HD   LYS  17          HD1       LYS  17   0.185  -5.663  11.897
  131   1HE   LYS  17          HE2       LYS  17   0.159  -5.932  14.263
  132   2HE   LYS  17          HE1       LYS  17   0.783  -7.466  13.647
  133   1HZ   LYS  17          HZ1       LYS  17   2.030  -6.344  15.549
  134   2HZ   LYS  17          HZ2       LYS  17   2.599  -5.251  14.379
  135   3HZ   LYS  17          HZ3       LYS  17   2.945  -6.908  14.236
  136    H    LEU  18           HN       LEU  18   0.226  -7.207   7.773
  137    HA   LEU  18           HA       LEU  18  -1.370  -9.113   9.282
  138   1HB   LEU  18          HB2       LEU  18  -1.760  -7.693   6.634
  139   2HB   LEU  18          HB1       LEU  18  -2.960  -8.737   7.324
  140    HG   LEU  18           HG       LEU  18  -2.401  -5.928   7.931
  141   1HD1  LEU  18          HD11      LEU  18  -4.620  -5.980   8.896
  142   2HD1  LEU  18          HD12      LEU  18  -4.607  -7.734   8.908
  143   3HD1  LEU  18          HD13      LEU  18  -4.611  -6.868   7.375
  144   1HD2  LEU  18          HD21      LEU  18  -2.726  -7.670  10.396
  145   2HD2  LEU  18          HD22      LEU  18  -2.602  -5.918  10.335
  146   3HD2  LEU  18          HD23      LEU  18  -1.203  -6.903   9.942
  147    H    ILE  19           HN       ILE  19   0.462  -9.189   6.273
  148    HA   ILE  19           HA       ILE  19  -0.319 -11.876   5.540
  149    HB   ILE  19           HB       ILE  19   2.137 -10.216   4.816
  150   1HG1  ILE  19          HG12      ILE  19  -0.350 -10.936   3.212
  151   2HG1  ILE  19          HG11      ILE  19  -0.104  -9.392   4.011
  152   1HG2  ILE  19          HG21      ILE  19   2.400 -11.892   2.967
  153   2HG2  ILE  19          HG22      ILE  19   1.182 -12.891   3.761
  154   3HG2  ILE  19          HG23      ILE  19   2.712 -12.550   4.570
  155   1HD1  ILE  19          HD11      ILE  19   1.740 -10.528   1.885
  156   2HD1  ILE  19          HD12      ILE  19   1.851  -8.933   2.624
  157   3HD1  ILE  19          HD13      ILE  19   0.487  -9.327   1.580
  158    H    ASP  20           HN       ASP  20   2.062 -10.379   7.602
  159    HA   ASP  20           HA       ASP  20   3.582 -12.808   8.101
  160   1HB   ASP  20          HB2       ASP  20   3.487 -10.212   9.661
  161   2HB   ASP  20          HB1       ASP  20   4.716 -11.468   9.806
  162    H    ASN  21           HN       ASN  21   0.700 -11.339   9.492
  163    HA   ASN  21           HA       ASN  21   0.963 -13.035  11.891
  164   1HB   ASN  21          HB2       ASN  21   0.013 -10.739  12.147
  165   2HB   ASN  21          HB1       ASN  21  -1.332 -11.196  11.104
  166   1HD2  ASN  21          HD21      ASN  21  -0.152 -13.718  13.173
  167   2HD2  ASN  21          HD22      ASN  21  -1.398 -13.648  14.323
  168    H    ASN  22           HN       ASN  22   0.062 -13.631   8.822
  169    HA   ASN  22           HA       ASN  22  -0.753 -15.667   7.981
  170   1HB   ASN  22          HB2       ASN  22  -0.245 -16.424  10.454
  171   2HB   ASN  22          HB1       ASN  22  -2.001 -16.458  10.594
  172   1HD2  ASN  22          HD21      ASN  22   0.329 -18.606  10.193
  173   2HD2  ASN  22          HD22      ASN  22  -0.351 -19.647   9.038
  174    H    LYS  23           HN       LYS  23  -2.420 -13.249   7.855
  175    HA   LYS  23           HA       LYS  23  -5.165 -14.262   8.387
  176   1HB   LYS  23          HB2       LYS  23  -4.526 -11.630   7.183
  177   2HB   LYS  23          HB1       LYS  23  -5.948 -12.088   8.101
  178   1HG   LYS  23          HG2       LYS  23  -3.800 -12.562   9.874
  179   2HG   LYS  23          HG1       LYS  23  -3.374 -11.051   9.085
  180   1HD   LYS  23          HD2       LYS  23  -5.458 -10.018   9.805
  181   2HD   LYS  23          HD1       LYS  23  -6.063 -11.570  10.390
  182   1HE   LYS  23          HE2       LYS  23  -4.131 -11.641  11.995
  183   2HE   LYS  23          HE1       LYS  23  -3.734  -9.995  11.499
  184   1HZ   LYS  23          HZ1       LYS  23  -5.753  -9.189  12.326
  185   2HZ   LYS  23          HZ2       LYS  23  -5.188 -10.247  13.528
  186   3HZ   LYS  23          HZ3       LYS  23  -6.425 -10.740  12.473
  187    H    THR  24           HN       THR  24  -6.696 -14.480   6.629
  188    HA   THR  24           HA       THR  24  -5.509 -15.338   4.092
  189    HB   THR  24           HB       THR  24  -7.552 -16.326   3.661
  190    HG1  THR  24           HG1      THR  24  -8.680 -14.082   4.968
  191   1HG2  THR  24          HG21      THR  24  -6.802 -16.799   6.099
  192   2HG2  THR  24          HG22      THR  24  -8.449 -17.230   5.636
  193   3HG2  THR  24          HG23      THR  24  -8.150 -15.757   6.556
  194    H    GLU  25           HN       GLU  25  -6.241 -14.523   2.013
  195    HA   GLU  25           HA       GLU  25  -5.916 -11.720   1.685
  196   1HB   GLU  25          HB2       GLU  25  -5.871 -13.603  -0.116
  197   2HB   GLU  25          HB1       GLU  25  -7.616 -13.358  -0.210
  198   1HG   GLU  25          HG2       GLU  25  -7.099 -10.870  -0.533
  199   2HG   GLU  25          HG1       GLU  25  -5.425 -11.358  -0.793
  200    H    LYS  26           HN       LYS  26  -8.890 -13.657   1.918
  201    HA   LYS  26           HA       LYS  26 -10.802 -11.616   1.569
  202   1HB   LYS  26          HB2       LYS  26 -11.417 -13.978   1.688
  203   2HB   LYS  26          HB1       LYS  26 -10.932 -14.035   3.382
  204   1HG   LYS  26          HG2       LYS  26 -12.695 -12.580   4.046
  205   2HG   LYS  26          HG1       LYS  26 -13.020 -12.091   2.383
  206   1HD   LYS  26          HD2       LYS  26 -13.747 -14.400   1.856
  207   2HD   LYS  26          HD1       LYS  26 -13.459 -14.863   3.534
  208   1HE   LYS  26          HE2       LYS  26 -15.093 -13.090   4.237
  209   2HE   LYS  26          HE1       LYS  26 -15.460 -12.817   2.535
  210   1HZ   LYS  26          HZ1       LYS  26 -16.166 -15.056   4.250
  211   2HZ   LYS  26          HZ2       LYS  26 -15.734 -15.445   2.654
  212   3HZ   LYS  26          HZ3       LYS  26 -17.017 -14.371   2.953
  213    H    GLU  27           HN       GLU  27  -8.892 -12.371   4.432
  214    HA   GLU  27           HA       GLU  27 -10.465 -10.635   6.165
  215   1HB   GLU  27          HB2       GLU  27  -7.743 -11.916   6.452
  216   2HB   GLU  27          HB1       GLU  27  -8.437 -10.859   7.677
  217   1HG   GLU  27          HG2       GLU  27 -10.253 -12.329   8.077
  218   2HG   GLU  27          HG1       GLU  27  -9.910 -13.266   6.624
  219    H    ILE  28           HN       ILE  28  -7.506 -10.230   4.229
  220    HA   ILE  28           HA       ILE  28  -6.789  -7.681   5.330
  221    HB   ILE  28           HB       ILE  28  -6.227  -8.623   2.501
  222   1HG1  ILE  28          HG12      ILE  28  -5.418  -9.741   5.137
  223   2HG1  ILE  28          HG11      ILE  28  -5.618 -10.557   3.614
  224   1HG2  ILE  28          HG21      ILE  28  -5.486  -6.330   3.206
  225   2HG2  ILE  28          HG22      ILE  28  -4.155  -7.396   2.767
  226   3HG2  ILE  28          HG23      ILE  28  -4.505  -7.079   4.464
  227   1HD1  ILE  28          HD11      ILE  28  -3.245  -8.900   4.492
  228   2HD1  ILE  28          HD12      ILE  28  -3.440  -9.554   2.865
  229   3HD1  ILE  28          HD13      ILE  28  -3.295 -10.647   4.248
  230    H    LEU  29           HN       LEU  29  -8.847  -8.627   2.593
  231    HA   LEU  29           HA       LEU  29  -9.393  -5.895   1.815
  232   1HB   LEU  29          HB2       LEU  29 -11.053  -8.371   1.268
  233   2HB   LEU  29          HB1       LEU  29 -11.017  -6.879   0.325
  234    HG   LEU  29           HG       LEU  29  -8.658  -8.759   0.720
  235   1HD1  LEU  29          HD11      LEU  29  -9.033  -9.066  -1.808
  236   2HD1  LEU  29          HD12      LEU  29 -10.618  -8.338  -1.552
  237   3HD1  LEU  29          HD13      LEU  29 -10.201  -9.846  -0.741
  238   1HD2  LEU  29          HD21      LEU  29  -9.035  -6.121  -0.715
  239   2HD2  LEU  29          HD22      LEU  29  -7.819  -7.274  -1.267
  240   3HD2  LEU  29          HD23      LEU  29  -7.730  -6.617   0.364
  241    H    ASP  30           HN       ASP  30 -10.705  -8.136   4.127
  242    HA   ASP  30           HA       ASP  30 -13.207  -6.728   4.625
  243   1HB   ASP  30          HB2       ASP  30 -12.680  -9.132   5.309
  244   2HB   ASP  30          HB1       ASP  30 -11.681  -8.455   6.595
  245    H    ALA  31           HN       ALA  31 -10.008  -6.701   6.211
  246    HA   ALA  31           HA       ALA  31 -10.716  -4.759   8.192
  247   1HB   ALA  31          HB1       ALA  31  -7.950  -5.211   7.085
  248   2HB   ALA  31          HB2       ALA  31  -8.724  -6.314   8.222
  249   3HB   ALA  31          HB3       ALA  31  -8.397  -4.650   8.697
  250    H    PHE  32           HN       PHE  32  -9.828  -4.410   4.822
  251    HA   PHE  32           HA       PHE  32  -8.814  -1.770   4.755
  252   1HB   PHE  32          HB2       PHE  32 -10.485  -3.434   2.897
  253   2HB   PHE  32          HB1       PHE  32 -10.141  -1.763   2.491
  254    HD1  PHE  32           HD1      PHE  32  -9.019  -2.733   0.467
  255    HD2  PHE  32           HD2      PHE  32  -7.497  -3.469   4.435
  256    HE1  PHE  32           HE1      PHE  32  -6.805  -3.324  -0.472
  257    HE2  PHE  32           HE2      PHE  32  -5.306  -4.037   3.482
  258    HZ   PHE  32           HZ       PHE  32  -4.953  -3.971   1.038
  259    H    ASP  33           HN       ASP  33 -11.842  -2.790   5.932
  260    HA   ASP  33           HA       ASP  33 -13.259  -0.319   5.180
  261   1HB   ASP  33          HB2       ASP  33 -13.982  -2.760   6.799
  262   2HB   ASP  33          HB1       ASP  33 -15.035  -1.346   6.749
  263    H    LYS  34           HN       LYS  34 -11.283  -1.405   7.829
  264    HA   LYS  34           HA       LYS  34 -12.015   1.083   9.335
  265   1HB   LYS  34          HB2       LYS  34 -10.968  -0.641  11.275
  266   2HB   LYS  34          HB1       LYS  34 -12.671  -0.271  11.055
  267   1HG   LYS  34          HG2       LYS  34 -11.465  -2.443   9.357
  268   2HG   LYS  34          HG1       LYS  34 -11.778  -2.790  11.045
  269   1HD   LYS  34          HD2       LYS  34 -14.033  -1.450   9.611
  270   2HD   LYS  34          HD1       LYS  34 -13.669  -3.083   9.075
  271   1HE   LYS  34          HE2       LYS  34 -14.084  -4.018  11.185
  272   2HE   LYS  34          HE1       LYS  34 -13.920  -2.468  12.010
  273   1HZ   LYS  34          HZ1       LYS  34 -15.964  -2.347  10.050
  274   2HZ   LYS  34          HZ2       LYS  34 -16.066  -2.063  11.723
  275   3HZ   LYS  34          HZ3       LYS  34 -16.254  -3.638  11.112
  276    H    MET  35           HN       MET  35  -9.719  -0.087   7.410
  277    HA   MET  35           HA       MET  35  -7.376   0.369   9.117
  278   1HB   MET  35          HB2       MET  35  -7.829  -0.940   6.678
  279   2HB   MET  35          HB1       MET  35  -6.812   0.418   6.229
  280   1HG   MET  35          HG2       MET  35  -5.295  -0.292   8.164
  281   2HG   MET  35          HG1       MET  35  -6.240  -1.778   8.220
  282   1HE   MET  35          HE1       MET  35  -6.258  -3.628   6.423
  283   2HE   MET  35          HE2       MET  35  -4.880  -3.633   7.520
  284   3HE   MET  35          HE3       MET  35  -4.635  -3.980   5.810
  285    H    CYS  36           HN       CYS  36  -9.043   2.223   6.464
  286    HA   CYS  36           HA       CYS  36  -7.131   4.359   6.659
  287   1HB   CYS  36          HB2       CYS  36  -9.048   3.984   4.850
  288   2HB   CYS  36          HB1       CYS  36 -10.005   4.960   5.957
  289    H    SER  37           HN       SER  37  -9.302   3.119   8.831
  290    HA   SER  37           HA       SER  37 -10.054   5.667  10.108
  291   1HB   SER  37          HB2       SER  37 -11.436   3.539  10.204
  292   2HB   SER  37          HB1       SER  37 -10.231   2.902  11.319
  293    HG   SER  37           HG       SER  37 -11.274   5.449  11.800
  294    H    LYS  38           HN       LYS  38  -7.104   4.565   9.823
  295    HA   LYS  38           HA       LYS  38  -6.357   5.048  12.699
  296   1HB   LYS  38          HB2       LYS  38  -5.144   3.229  10.614
  297   2HB   LYS  38          HB1       LYS  38  -4.207   3.783  12.002
  298   1HG   LYS  38          HG2       LYS  38  -5.947   2.879  13.517
  299   2HG   LYS  38          HG1       LYS  38  -6.845   2.291  12.117
  300   1HD   LYS  38          HD2       LYS  38  -4.721   1.017  11.472
  301   2HD   LYS  38          HD1       LYS  38  -4.126   1.395  13.089
  302   1HE   LYS  38          HE2       LYS  38  -6.108   0.307  14.077
  303   2HE   LYS  38          HE1       LYS  38  -6.706  -0.073  12.461
  304   1HZ   LYS  38          HZ1       LYS  38  -4.770  -1.440  14.021
  305   2HZ   LYS  38          HZ2       LYS  38  -4.107  -0.976  12.527
  306   3HZ   LYS  38          HZ3       LYS  38  -5.517  -1.923  12.577
  307    H    LEU  39           HN       LEU  39  -6.391   6.461   9.698
  308    HA   LEU  39           HA       LEU  39  -3.836   7.960  10.141
  309   1HB   LEU  39          HB2       LEU  39  -5.641   7.863   7.701
  310   2HB   LEU  39          HB1       LEU  39  -4.089   8.682   7.788
  311    HG   LEU  39           HG       LEU  39  -4.481   5.704   8.166
  312   1HD1  LEU  39          HD11      LEU  39  -4.918   6.673   5.840
  313   2HD1  LEU  39          HD12      LEU  39  -3.683   5.419   5.944
  314   3HD1  LEU  39          HD13      LEU  39  -3.212   7.112   5.823
  315   1HD2  LEU  39          HD21      LEU  39  -2.486   6.291   9.311
  316   2HD2  LEU  39          HD22      LEU  39  -2.073   7.528   8.124
  317   3HD2  LEU  39          HD23      LEU  39  -1.919   5.827   7.710
  318    HA   PRO  40           HA       PRO  40  -6.148  11.439  11.652
  319   1HB   PRO  40          HB2       PRO  40  -4.667  13.285   9.875
  320   2HB   PRO  40          HB1       PRO  40  -4.678  13.214  11.645
  321   1HG   PRO  40          HG2       PRO  40  -2.595  12.290   9.918
  322   2HG   PRO  40          HG1       PRO  40  -2.702  12.053  11.668
  323   1HD   PRO  40          HD2       PRO  40  -2.988  10.059   9.623
  324   2HD   PRO  40          HD1       PRO  40  -3.151   9.830  11.368
  325    H    LYS  41           HN       LYS  41  -7.831  13.012  10.793
  326    HA   LYS  41           HA       LYS  41  -9.218  11.899   8.527
  327   1HB   LYS  41          HB2       LYS  41 -10.197  13.286  10.461
  328   2HB   LYS  41          HB1       LYS  41  -9.614  14.695   9.576
  329   1HG   LYS  41          HG2       LYS  41 -10.953  14.107   7.637
  330   2HG   LYS  41          HG1       LYS  41 -11.439  12.584   8.383
  331   1HD   LYS  41          HD2       LYS  41 -12.568  13.840  10.192
  332   2HD   LYS  41          HD1       LYS  41 -12.101  15.357   9.421
  333   1HE   LYS  41          HE2       LYS  41 -13.347  14.671   7.378
  334   2HE   LYS  41          HE1       LYS  41 -13.870  13.209   8.213
  335   1HZ   LYS  41          HZ1       LYS  41 -14.957  14.566   9.871
  336   2HZ   LYS  41          HZ2       LYS  41 -15.533  14.970   8.324
  337   3HZ   LYS  41          HZ3       LYS  41 -14.422  15.985   9.111
  338    H    SER  42           HN       SER  42  -6.619  14.140   8.630
  339    HA   SER  42           HA       SER  42  -7.383  15.548   6.235
  340   1HB   SER  42          HB2       SER  42  -5.035  16.394   6.248
  341   2HB   SER  42          HB1       SER  42  -5.825  16.579   7.813
  342    HG   SER  42           HG       SER  42  -3.755  14.897   7.019
  343    H    LEU  43           HN       LEU  43  -6.140  12.433   6.566
  344    HA   LEU  43           HA       LEU  43  -5.303  12.447   3.667
  345   1HB   LEU  43          HB2       LEU  43  -4.573  10.320   5.683
  346   2HB   LEU  43          HB1       LEU  43  -3.871  10.594   4.092
  347    HG   LEU  43           HG       LEU  43  -3.604  12.358   6.517
  348   1HD1  LEU  43          HD11      LEU  43  -1.726  10.541   5.030
  349   2HD1  LEU  43          HD12      LEU  43  -2.123  10.539   6.748
  350   3HD1  LEU  43          HD13      LEU  43  -1.135  11.833   6.075
  351   1HD2  LEU  43          HD21      LEU  43  -2.731  12.741   3.651
  352   2HD2  LEU  43          HD22      LEU  43  -1.977  13.611   4.984
  353   3HD2  LEU  43          HD23      LEU  43  -3.687  13.842   4.638
  354    H    SER  44           HN       SER  44  -7.830  11.648   5.675
  355    HA   SER  44           HA       SER  44  -8.714   9.101   5.269
  356   1HB   SER  44          HB2       SER  44 -10.189  10.671   6.323
  357   2HB   SER  44          HB1       SER  44 -10.275  11.668   4.875
  358    HG   SER  44           HG       SER  44 -11.446  10.079   3.869
  359    H    GLU  45           HN       GLU  45  -9.716  11.567   2.965
  360    HA   GLU  45           HA       GLU  45 -10.784  10.028   1.021
  361   1HB   GLU  45          HB2       GLU  45  -9.306  12.636   0.699
  362   2HB   GLU  45          HB1       GLU  45 -10.497  11.982  -0.428
  363   1HG   GLU  45          HG2       GLU  45 -12.202  11.997   1.371
  364   2HG   GLU  45          HG1       GLU  45 -11.015  12.688   2.477
  365    H    GLU  46           HN       GLU  46  -7.470  11.305   0.741
  366    HA   GLU  46           HA       GLU  46  -6.940  10.176  -1.797
  367   1HB   GLU  46          HB2       GLU  46  -4.870  10.424   0.382
  368   2HB   GLU  46          HB1       GLU  46  -4.657  10.608  -1.353
  369   1HG   GLU  46          HG2       GLU  46  -4.735  12.852  -0.790
  370   2HG   GLU  46          HG1       GLU  46  -6.462  12.577  -0.991
  371    H    CYS  47           HN       CYS  47  -7.172   8.657   1.323
  372    HA   CYS  47           HA       CYS  47  -5.678   6.285   0.481
  373   1HB   CYS  47          HB2       CYS  47  -5.982   5.550   2.665
  374   2HB   CYS  47          HB1       CYS  47  -6.288   7.266   2.931
  375    H    GLN  48           HN       GLN  48  -9.089   7.197   0.856
  376    HA   GLN  48           HA       GLN  48 -10.269   4.740   0.165
  377   1HB   GLN  48          HB2       GLN  48 -11.133   7.565  -0.536
  378   2HB   GLN  48          HB1       GLN  48 -12.142   6.144  -0.805
  379   1HG   GLN  48          HG2       GLN  48 -12.057   5.610   1.589
  380   2HG   GLN  48          HG1       GLN  48 -11.019   7.007   1.873
  381   1HE2  GLN  48          HE21      GLN  48 -12.202   9.034   0.435
  382   2HE2  GLN  48          HE22      GLN  48 -13.797   9.293   0.955
  383    H    GLU  49           HN       GLU  49  -8.989   7.290  -1.971
  384    HA   GLU  49           HA       GLU  49  -9.768   5.983  -4.393
  385   1HB   GLU  49          HB2       GLU  49  -7.745   8.126  -3.736
  386   2HB   GLU  49          HB1       GLU  49  -7.947   7.520  -5.380
  387   1HG   GLU  49          HG2       GLU  49  -9.333   9.531  -4.989
  388   2HG   GLU  49          HG1       GLU  49 -10.334   8.118  -5.320
  389    H    VAL  50           HN       VAL  50  -6.747   5.915  -2.489
  390    HA   VAL  50           HA       VAL  50  -5.325   4.308  -4.394
  391    HB   VAL  50           HB       VAL  50  -4.813   4.432  -1.418
  392   1HG1  VAL  50          HG11      VAL  50  -3.069   3.685  -3.770
  393   2HG1  VAL  50          HG12      VAL  50  -3.678   2.594  -2.525
  394   3HG1  VAL  50          HG13      VAL  50  -2.508   3.842  -2.106
  395   1HG2  VAL  50          HG21      VAL  50  -3.221   6.050  -3.384
  396   2HG2  VAL  50          HG22      VAL  50  -3.621   6.412  -1.707
  397   3HG2  VAL  50          HG23      VAL  50  -4.821   6.651  -2.970
  398    H    VAL  51           HN       VAL  51  -6.896   3.496  -1.265
  399    HA   VAL  51           HA       VAL  51  -6.487   0.728  -1.539
  400    HB   VAL  51           HB       VAL  51  -8.743   2.139  -0.055
  401   1HG1  VAL  51          HG11      VAL  51  -9.135  -0.238  -0.158
  402   2HG1  VAL  51          HG12      VAL  51  -8.561   0.155   1.462
  403   3HG1  VAL  51          HG13      VAL  51  -7.462  -0.575   0.292
  404   1HG2  VAL  51          HG21      VAL  51  -7.241   2.210   1.863
  405   2HG2  VAL  51          HG22      VAL  51  -6.454   2.996   0.494
  406   3HG2  VAL  51          HG23      VAL  51  -5.995   1.358   0.952
  407    H    ASP  52           HN       ASP  52  -9.431   2.561  -2.300
  408    HA   ASP  52           HA       ASP  52 -10.908   0.365  -3.297
  409   1HB   ASP  52          HB2       ASP  52 -11.132   3.269  -4.113
  410   2HB   ASP  52          HB1       ASP  52 -12.376   2.032  -4.289
  411    H    THR  53           HN       THR  53  -8.802   2.652  -5.043
  412    HA   THR  53           HA       THR  53  -9.371   1.331  -7.613
  413    HB   THR  53           HB       THR  53  -7.295   3.441  -7.043
  414    HG1  THR  53           HG1      THR  53  -9.088   4.823  -7.810
  415   1HG2  THR  53          HG21      THR  53  -8.898   2.782  -9.527
  416   2HG2  THR  53          HG22      THR  53  -7.242   2.247  -9.236
  417   3HG2  THR  53          HG23      THR  53  -7.597   3.967  -9.400
  418    H    TYR  54           HN       TYR  54  -6.626   1.542  -5.343
  419    HA   TYR  54           HA       TYR  54  -5.240  -0.503  -7.047
  420   1HB   TYR  54          HB2       TYR  54  -4.157   1.500  -5.081
  421   2HB   TYR  54          HB1       TYR  54  -3.186   0.242  -5.839
  422    HD1  TYR  54           HD1      TYR  54  -5.066   3.340  -6.383
  423    HD2  TYR  54           HD2      TYR  54  -2.677   0.315  -8.241
  424    HE1  TYR  54           HE1      TYR  54  -4.813   4.790  -8.359
  425    HE2  TYR  54           HE2      TYR  54  -2.415   1.758 -10.244
  426    HH   TYR  54           HH       TYR  54  -4.004   3.813 -11.246
  427    H    GLY  55           HN       GLY  55  -7.297  -1.149  -5.033
  428   1HA   GLY  55          HA2       GLY  55  -5.868  -2.230  -2.733
  429   2HA   GLY  55          HA1       GLY  55  -7.583  -2.428  -3.069
  430    H    SER  56           HN       SER  56  -7.718  -3.801  -5.415
  431    HA   SER  56           HA       SER  56  -6.870  -6.401  -4.578
  432   1HB   SER  56          HB2       SER  56  -7.499  -6.015  -7.460
  433   2HB   SER  56          HB1       SER  56  -8.118  -7.203  -6.311
  434    HG   SER  56           HG       SER  56  -8.928  -4.866  -5.453
  435    H    SER  57           HN       SER  57  -5.467  -3.970  -6.640
  436    HA   SER  57           HA       SER  57  -3.622  -5.811  -7.888
  437   1HB   SER  57          HB2       SER  57  -2.606  -3.854  -8.929
  438   2HB   SER  57          HB1       SER  57  -4.355  -3.648  -8.957
  439    HG   SER  57           HG       SER  57  -3.836  -1.813  -8.033
  440    H    ILE  58           HN       ILE  58  -3.184  -3.372  -5.288
  441    HA   ILE  58           HA       ILE  58  -0.413  -3.848  -4.815
  442    HB   ILE  58           HB       ILE  58  -2.692  -3.196  -2.922
  443   1HG1  ILE  58          HG12      ILE  58  -0.381  -1.512  -3.950
  444   2HG1  ILE  58          HG11      ILE  58  -1.987  -1.500  -4.663
  445   1HG2  ILE  58          HG21      ILE  58  -1.069  -4.253  -1.534
  446   2HG2  ILE  58          HG22      ILE  58  -0.721  -2.530  -1.375
  447   3HG2  ILE  58          HG23      ILE  58   0.274  -3.541  -2.425
  448   1HD1  ILE  58          HD11      ILE  58  -2.136   0.315  -3.189
  449   2HD1  ILE  58          HD12      ILE  58  -1.083  -0.455  -1.999
  450   3HD1  ILE  58          HD13      ILE  58  -2.754  -0.989  -2.173
  451    H    LEU  59           HN       LEU  59  -3.298  -5.432  -3.601
  452    HA   LEU  59           HA       LEU  59  -2.024  -7.446  -2.023
  453   1HB   LEU  59          HB2       LEU  59  -4.712  -6.784  -3.011
  454   2HB   LEU  59          HB1       LEU  59  -4.466  -8.520  -3.000
  455    HG   LEU  59           HG       LEU  59  -5.489  -7.736  -0.936
  456   1HD1  LEU  59          HD11      LEU  59  -3.592  -9.599  -1.092
  457   2HD1  LEU  59          HD12      LEU  59  -4.257  -9.106   0.461
  458   3HD1  LEU  59          HD13      LEU  59  -2.707  -8.465  -0.070
  459   1HD2  LEU  59          HD21      LEU  59  -4.498  -6.172   0.522
  460   2HD2  LEU  59          HD22      LEU  59  -4.285  -5.457  -1.075
  461   3HD2  LEU  59          HD23      LEU  59  -2.933  -6.263  -0.278
  462    H    SER  60           HN       SER  60  -2.552  -7.303  -5.513
  463    HA   SER  60           HA       SER  60  -2.201 -10.145  -5.674
  464   1HB   SER  60          HB2       SER  60  -3.507  -9.253  -7.410
  465   2HB   SER  60          HB1       SER  60  -2.364  -7.945  -7.712
  466    HG   SER  60           HG       SER  60  -0.883  -9.659  -8.387
  467    H    ILE  61           HN       ILE  61  -0.202  -7.306  -6.109
  468    HA   ILE  61           HA       ILE  61   2.096  -8.603  -7.262
  469    HB   ILE  61           HB       ILE  61   2.003  -6.019  -5.689
  470   1HG1  ILE  61          HG12      ILE  61   0.841  -6.773  -8.329
  471   2HG1  ILE  61          HG11      ILE  61   0.452  -5.426  -7.274
  472   1HG2  ILE  61          HG21      ILE  61   3.962  -5.419  -6.992
  473   2HG2  ILE  61          HG22      ILE  61   3.839  -6.903  -7.936
  474   3HG2  ILE  61          HG23      ILE  61   4.252  -6.975  -6.226
  475   1HD1  ILE  61          HD11      ILE  61   2.508  -4.249  -8.058
  476   2HD1  ILE  61          HD12      ILE  61   1.333  -4.545  -9.339
  477   3HD1  ILE  61          HD13      ILE  61   2.769  -5.556  -9.216
  478    H    LEU  62           HN       LEU  62   1.347  -7.554  -3.934
  479    HA   LEU  62           HA       LEU  62   3.795  -8.254  -2.769
  480   1HB   LEU  62          HB2       LEU  62   1.127  -7.530  -1.905
  481   2HB   LEU  62          HB1       LEU  62   1.710  -8.827  -0.870
  482    HG   LEU  62           HG       LEU  62   3.415  -6.401  -1.489
  483   1HD1  LEU  62          HD11      LEU  62   1.205  -6.724   0.518
  484   2HD1  LEU  62          HD12      LEU  62   1.585  -5.343  -0.502
  485   3HD1  LEU  62          HD13      LEU  62   2.593  -5.709   0.893
  486   1HD2  LEU  62          HD21      LEU  62   4.402  -7.104   0.739
  487   2HD2  LEU  62          HD22      LEU  62   4.630  -8.268  -0.559
  488   3HD2  LEU  62          HD23      LEU  62   3.394  -8.540   0.665
  489    H    LEU  63           HN       LEU  63   0.975 -10.257  -3.495
  490    HA   LEU  63           HA       LEU  63   2.018 -12.643  -2.196
  491   1HB   LEU  63          HB2       LEU  63  -0.075 -12.357  -4.376
  492   2HB   LEU  63          HB1       LEU  63   0.213 -13.802  -3.403
  493    HG   LEU  63           HG       LEU  63  -0.606 -11.097  -2.307
  494   1HD1  LEU  63          HD11      LEU  63  -2.432 -12.123  -3.550
  495   2HD1  LEU  63          HD12      LEU  63  -2.762 -12.258  -1.821
  496   3HD1  LEU  63          HD13      LEU  63  -2.173 -13.658  -2.719
  497   1HD2  LEU  63          HD21      LEU  63   0.526 -12.099  -0.531
  498   2HD2  LEU  63          HD22      LEU  63   0.118 -13.734  -1.050
  499   3HD2  LEU  63          HD23      LEU  63  -1.100 -12.724  -0.273
  500    H    GLU  64           HN       GLU  64   2.758 -11.058  -5.119
  501    HA   GLU  64           HA       GLU  64   3.756 -13.509  -6.401
  502   1HB   GLU  64          HB2       GLU  64   2.734 -11.461  -7.609
  503   2HB   GLU  64          HB1       GLU  64   4.276 -10.674  -7.313
  504   1HG   GLU  64          HG2       GLU  64   4.428 -11.655  -9.492
  505   2HG   GLU  64          HG1       GLU  64   5.379 -12.686  -8.423
  506    H    GLU  65           HN       GLU  65   4.734 -12.748  -3.831
  507    HA   GLU  65           HA       GLU  65   6.787 -12.594  -2.639
  508   1HB   GLU  65          HB2       GLU  65   7.613 -13.878  -5.237
  509   2HB   GLU  65          HB1       GLU  65   8.618 -13.816  -3.789
  510   1HG   GLU  65          HG2       GLU  65   5.818 -14.962  -3.789
  511   2HG   GLU  65          HG1       GLU  65   7.252 -15.946  -4.079
  512    H    VAL  66           HN       VAL  66   6.134 -10.201  -4.368
  513    HA   VAL  66           HA       VAL  66   8.823  -9.318  -5.295
  514    HB   VAL  66           HB       VAL  66   6.000  -8.374  -5.628
  515   1HG1  VAL  66          HG11      VAL  66   6.877  -6.302  -4.876
  516   2HG1  VAL  66          HG12      VAL  66   6.996  -6.215  -6.634
  517   3HG1  VAL  66          HG13      VAL  66   8.428  -6.580  -5.669
  518   1HG2  VAL  66          HG21      VAL  66   8.313  -8.317  -7.574
  519   2HG2  VAL  66          HG22      VAL  66   6.590  -8.353  -7.939
  520   3HG2  VAL  66          HG23      VAL  66   7.383  -9.783  -7.275
  521    H    SER  67           HN       SER  67   9.957  -7.620  -4.218
  522    HA   SER  67           HA       SER  67   9.745  -7.420  -1.438
  523   1HB   SER  67          HB2       SER  67  11.497  -6.466  -3.303
  524   2HB   SER  67          HB1       SER  67  10.761  -4.963  -2.758
  525    HG   SER  67           HG       SER  67  12.419  -6.734  -1.449
  526    HA   PRO  68           HA       PRO  68   6.233  -4.830  -0.753
  527   1HB   PRO  68          HB2       PRO  68   7.165  -3.352   1.495
  528   2HB   PRO  68          HB1       PRO  68   6.338  -4.907   1.539
  529   1HG   PRO  68          HG2       PRO  68   9.192  -4.332   1.986
  530   2HG   PRO  68          HG1       PRO  68   8.268  -5.781   2.411
  531   1HD   PRO  68          HD2       PRO  68  10.125  -5.550   0.271
  532   2HD   PRO  68          HD1       PRO  68   8.980  -6.881   0.544
  533    H    GLU  69           HN       GLU  69   9.349  -3.011  -0.566
  534    HA   GLU  69           HA       GLU  69   8.001  -0.489  -1.105
  535   1HB   GLU  69          HB2       GLU  69  10.628   0.076  -1.635
  536   2HB   GLU  69          HB1       GLU  69   9.937   0.056  -0.015
  537   1HG   GLU  69          HG2       GLU  69  10.672  -2.228   0.336
  538   2HG   GLU  69          HG1       GLU  69  11.227  -2.351  -1.333
  539    H    LEU  70           HN       LEU  70   9.063  -3.046  -3.125
  540    HA   LEU  70           HA       LEU  70   9.555  -1.359  -5.442
  541   1HB   LEU  70          HB2       LEU  70   9.044  -4.337  -5.133
  542   2HB   LEU  70          HB1       LEU  70   9.232  -3.596  -6.707
  543    HG   LEU  70           HG       LEU  70  11.257  -3.467  -4.498
  544   1HD1  LEU  70          HD11      LEU  70  11.537  -4.983  -7.085
  545   2HD1  LEU  70          HD12      LEU  70  10.835  -5.737  -5.655
  546   3HD1  LEU  70          HD13      LEU  70  12.496  -5.148  -5.616
  547   1HD2  LEU  70          HD21      LEU  70  11.112  -2.238  -7.215
  548   2HD2  LEU  70          HD22      LEU  70  12.684  -2.819  -6.674
  549   3HD2  LEU  70          HD23      LEU  70  11.827  -1.603  -5.737
  550    H    VAL  71           HN       VAL  71   6.835  -2.399  -3.726
  551    HA   VAL  71           HA       VAL  71   4.932  -2.492  -5.851
  552    HB   VAL  71           HB       VAL  71   4.720  -2.046  -2.867
  553   1HG1  VAL  71          HG11      VAL  71   2.508  -1.573  -4.861
  554   2HG1  VAL  71          HG12      VAL  71   2.934  -0.612  -3.443
  555   3HG1  VAL  71          HG13      VAL  71   2.139  -2.169  -3.242
  556   1HG2  VAL  71          HG21      VAL  71   4.975  -4.329  -3.579
  557   2HG2  VAL  71          HG22      VAL  71   3.695  -4.153  -4.781
  558   3HG2  VAL  71          HG23      VAL  71   3.303  -4.118  -3.061
  559    H    CYS  72           HN       CYS  72   5.633   0.279  -3.633
  560    HA   CYS  72           HA       CYS  72   3.853   1.919  -5.063
  561   1HB   CYS  72          HB2       CYS  72   6.265   2.724  -3.394
  562   2HB   CYS  72          HB1       CYS  72   5.007   3.829  -3.923
  563    H    SER  73           HN       SER  73   7.218   1.109  -5.653
  564    HA   SER  73           HA       SER  73   7.645   3.259  -7.608
  565   1HB   SER  73          HB2       SER  73   9.449   1.968  -6.279
  566   2HB   SER  73          HB1       SER  73   9.243   0.704  -7.488
  567    HG   SER  73           HG       SER  73  10.895   2.293  -7.974
  568    H    MET  74           HN       MET  74   6.693  -0.173  -7.916
  569    HA   MET  74           HA       MET  74   6.806  -0.143 -10.846
  570   1HB   MET  74          HB2       MET  74   5.918  -2.041  -8.734
  571   2HB   MET  74          HB1       MET  74   5.100  -2.200 -10.286
  572   1HG   MET  74          HG2       MET  74   7.501  -2.208 -11.300
  573   2HG   MET  74          HG1       MET  74   8.026  -2.552  -9.659
  574   1HE   MET  74          HE1       MET  74   6.444  -4.223  -8.209
  575   2HE   MET  74          HE2       MET  74   5.723  -5.685  -8.869
  576   3HE   MET  74          HE3       MET  74   4.902  -4.141  -9.069
  577    H    LEU  75           HN       LEU  75   4.137   0.356  -8.505
  578    HA   LEU  75           HA       LEU  75   2.162   0.517 -10.618
  579   1HB   LEU  75          HB2       LEU  75   1.986   1.630  -7.809
  580   2HB   LEU  75          HB1       LEU  75   0.636   1.308  -8.895
  581    HG   LEU  75           HG       LEU  75   2.502  -0.728  -7.654
  582   1HD1  LEU  75          HD11      LEU  75   0.836  -0.129  -6.086
  583   2HD1  LEU  75          HD12      LEU  75   0.255  -1.620  -6.823
  584   3HD1  LEU  75          HD13      LEU  75  -0.418  -0.071  -7.325
  585   1HD2  LEU  75          HD21      LEU  75   2.130  -1.658  -9.780
  586   2HD2  LEU  75          HD22      LEU  75   0.509  -0.967  -9.899
  587   3HD2  LEU  75          HD23      LEU  75   0.807  -2.339  -8.835
  588    H    HIS  76           HN       HIS  76   4.637   2.359 -10.577
  589    HA   HIS  76           HA       HIS  76   5.148   4.597 -11.074
  590   1HB   HIS  76          HB2       HIS  76   3.873   5.536 -12.880
  591   2HB   HIS  76          HB1       HIS  76   3.903   3.793 -13.128
  592    HD1  HIS  76           HD1      HIS  76   1.626   6.449 -11.618
  593    HD2  HIS  76           HD2      HIS  76   1.386   2.654 -13.325
  594    HE1  HIS  76           HE1      HIS  76  -0.840   5.906 -11.812
  595    H    LEU  77           HN       LEU  77   3.409   4.077  -8.587
  596    HA   LEU  77           HA       LEU  77   1.785   6.531  -8.466
  597   1HB   LEU  77          HB2       LEU  77   2.418   4.360  -6.460
  598   2HB   LEU  77          HB1       LEU  77   1.523   5.797  -6.020
  599    HG   LEU  77           HG       LEU  77   0.705   3.616  -7.953
  600   1HD1  LEU  77          HD11      LEU  77  -1.226   3.456  -6.436
  601   2HD1  LEU  77          HD12      LEU  77  -0.612   4.815  -5.499
  602   3HD1  LEU  77          HD13      LEU  77   0.278   3.299  -5.527
  603   1HD2  LEU  77          HD21      LEU  77  -0.368   6.430  -7.676
  604   2HD2  LEU  77          HD22      LEU  77  -1.466   5.114  -8.086
  605   3HD2  LEU  77          HD23      LEU  77  -0.112   5.485  -9.145
  606    H    CYS  78           HN       CYS  78   5.047   5.793  -8.028
  607    HA   CYS  78           HA       CYS  78   5.422   8.392  -6.570
  608   1HB   CYS  78          HB2       CYS  78   6.039   5.919  -5.502
  609   2HB   CYS  78          HB1       CYS  78   7.581   6.384  -6.189
  610    H    SER  79           HN       SER  79   6.030   9.596  -8.487
  611    HA   SER  79           HA       SER  79   7.580   8.336 -10.508
  612   1HB   SER  79          HB2       SER  79   6.319  10.249 -11.209
  613   2HB   SER  79          HB1       SER  79   7.008  11.261  -9.942
  614    HG   SER  79           HG       SER  79   8.720  11.589 -11.141
  615    H    GLY  80           HN       GLY  80   9.841   9.420 -11.238
  616   1HA   GLY  80          HA2       GLY  80  11.606   9.168  -8.852
  617   2HA   GLY  80          HA1       GLY  80  12.117   9.032 -10.535
  618    H    LEU  81           HN       LEU  81  13.748  10.637  -9.345
  619    HA   LEU  81           HA       LEU  81  12.786  13.384  -9.099
  620   1HB   LEU  81          HB2       LEU  81  15.677  12.534  -9.358
  621   2HB   LEU  81          HB1       LEU  81  15.021  13.942  -8.520
  622    HG   LEU  81           HG       LEU  81  14.634  11.044  -7.716
  623   1HD1  LEU  81          HD11      LEU  81  15.936  11.759  -5.712
  624   2HD1  LEU  81          HD12      LEU  81  16.187  13.333  -6.469
  625   3HD1  LEU  81          HD13      LEU  81  16.871  11.883  -7.202
  626   1HD2  LEU  81          HD21      LEU  81  13.636  12.224  -5.638
  627   2HD2  LEU  81          HD22      LEU  81  12.639  12.171  -7.091
  628   3HD2  LEU  81          HD23      LEU  81  13.505  13.649  -6.670
  629    H    VAL  82           HN       VAL  82  11.827  13.419 -11.317
  630    HA   VAL  82           HA       VAL  82  13.880  13.909 -13.458
  631    HB   VAL  82           HB       VAL  82  11.736  13.559 -14.940
  632   1HG1  VAL  82          HG11      VAL  82  12.148  11.099 -14.916
  633   2HG1  VAL  82          HG12      VAL  82  13.095  11.295 -13.440
  634   3HG1  VAL  82          HG13      VAL  82  13.646  12.029 -14.947
  635   1HG2  VAL  82          HG21      VAL  82  10.004  12.243 -13.962
  636   2HG2  VAL  82          HG22      VAL  82  10.290  13.545 -12.810
  637   3HG2  VAL  82          HG23      VAL  82  10.950  11.940 -12.506
  638    HA   PRO  83           HA       PRO  83  12.001  18.024 -12.495
  639   1HB   PRO  83          HB2       PRO  83  14.294  19.291 -13.741
  640   2HB   PRO  83          HB1       PRO  83  13.868  19.264 -12.025
  641   1HG   PRO  83          HG2       PRO  83  16.027  17.851 -13.291
  642   2HG   PRO  83          HG1       PRO  83  15.532  17.750 -11.596
  643   1HD   PRO  83          HD2       PRO  83  15.139  15.782 -13.716
  644   2HD   PRO  83          HD1       PRO  83  14.797  15.614 -11.982
  645    H    ARG  84           HN       ARG  84  12.498  16.213 -15.190
  646    HA   ARG  84           HA       ARG  84  10.808  17.909 -16.837
  647   1HB   ARG  84          HB2       ARG  84  13.094  18.932 -17.155
  648   2HB   ARG  84          HB1       ARG  84  13.622  17.393 -17.838
  649   1HG   ARG  84          HG2       ARG  84  11.873  17.558 -19.572
  650   2HG   ARG  84          HG1       ARG  84  11.345  19.097 -18.892
  651   1HD   ARG  84          HD2       ARG  84  14.067  18.496 -20.084
  652   2HD   ARG  84          HD1       ARG  84  12.821  19.532 -20.782
  653    HE   ARG  84           HE       ARG  84  13.287  20.649 -18.291
  654   1HH1  ARG  84          HH21      ARG  84  15.182  19.725 -21.019
  655   2HH1  ARG  84          HH22      ARG  84  16.389  20.939 -20.759
  656   1HH2  ARG  84          HH11      ARG  84  14.851  22.238 -17.935
  657   2HH2  ARG  84          HH12      ARG  84  16.203  22.362 -19.013
  Start of MODEL    7
    1   1H    SER   1          HT1       SER   1   6.832  16.088  -1.357
    2   2H    SER   1          HT2       SER   1   6.708  17.771  -1.159
    3   3H    SER   1          HT3       SER   1   5.735  16.973  -2.301
    4    HA   SER   1           HA       SER   1   5.551  16.181   0.521
    5   1HB   SER   1          HB2       SER   1   3.952  17.931   0.977
    6   2HB   SER   1          HB1       SER   1   5.421  18.702   0.387
    7    HG   SER   1           HG       SER   1   4.390  19.316  -1.349
    8    H    ASP   2           HN       ASP   2   5.250  14.795  -2.001
    9    HA   ASP   2           HA       ASP   2   2.486  14.722  -2.805
   10   1HB   ASP   2          HB2       ASP   2   4.155  13.951  -4.348
   11   2HB   ASP   2          HB1       ASP   2   4.777  12.786  -3.183
   12    H    VAL   3           HN       VAL   3   1.044  14.301  -1.233
   13    HA   VAL   3           HA       VAL   3   1.365  12.561   1.006
   14    HB   VAL   3           HB       VAL   3  -0.869  13.004   1.478
   15   1HG1  VAL   3          HG11      VAL   3   0.625  15.044   1.183
   16   2HG1  VAL   3          HG12      VAL   3  -1.111  15.346   1.140
   17   3HG1  VAL   3          HG13      VAL   3  -0.187  15.301  -0.361
   18   1HG2  VAL   3          HG21      VAL   3  -1.999  12.119  -0.461
   19   2HG2  VAL   3          HG22      VAL   3  -1.292  13.349  -1.508
   20   3HG2  VAL   3          HG23      VAL   3  -2.494  13.804  -0.299
   21    H    TYR   4           HN       TYR   4   0.754  11.765  -2.367
   22    HA   TYR   4           HA       TYR   4  -0.844   9.459  -1.723
   23   1HB   TYR   4          HB2       TYR   4   0.401  10.582  -4.211
   24   2HB   TYR   4          HB1       TYR   4  -0.042   8.885  -4.247
   25    HD1  TYR   4           HD1      TYR   4  -2.441   8.296  -3.357
   26    HD2  TYR   4           HD2      TYR   4  -1.242  12.190  -4.713
   27    HE1  TYR   4           HE1      TYR   4  -4.813   8.882  -3.759
   28    HE2  TYR   4           HE2      TYR   4  -3.617  12.781  -5.106
   29    HH   TYR   4           HH       TYR   4  -6.217  10.404  -4.575
   30    H    CYS   5           HN       CYS   5   2.562   9.788  -2.668
   31    HA   CYS   5           HA       CYS   5   3.254   7.018  -2.544
   32   1HB   CYS   5          HB2       CYS   5   4.834   9.546  -1.966
   33   2HB   CYS   5          HB1       CYS   5   5.564   7.944  -1.847
   34    H    GLU   6           HN       GLU   6   3.126   9.482   0.067
   35    HA   GLU   6           HA       GLU   6   4.135   7.864   2.142
   36   1HB   GLU   6          HB2       GLU   6   3.552  10.325   2.270
   37   2HB   GLU   6          HB1       GLU   6   1.870   9.841   2.466
   38   1HG   GLU   6          HG2       GLU   6   2.753  10.137   4.677
   39   2HG   GLU   6          HG1       GLU   6   2.629   8.397   4.416
   40    H    VAL   7           HN       VAL   7   0.791   8.057   0.900
   41    HA   VAL   7           HA       VAL   7  -0.213   6.202   2.903
   42    HB   VAL   7           HB       VAL   7  -1.376   7.071   0.227
   43   1HG1  VAL   7          HG11      VAL   7  -2.453   5.037   0.750
   44   2HG1  VAL   7          HG12      VAL   7  -3.539   6.274   1.381
   45   3HG1  VAL   7          HG13      VAL   7  -2.477   5.391   2.477
   46   1HG2  VAL   7          HG21      VAL   7  -1.542   8.157   3.038
   47   2HG2  VAL   7          HG22      VAL   7  -2.951   8.309   1.991
   48   3HG2  VAL   7          HG23      VAL   7  -1.419   9.027   1.510
   49    H    CYS   8           HN       CYS   8   0.937   5.675  -0.464
   50    HA   CYS   8           HA       CYS   8   0.120   2.941  -0.613
   51   1HB   CYS   8          HB2       CYS   8   0.900   4.071  -2.579
   52   2HB   CYS   8          HB1       CYS   8   2.468   4.384  -1.858
   53    H    GLU   9           HN       GLU   9   3.146   4.391   0.677
   54    HA   GLU   9           HA       GLU   9   4.284   1.839   1.319
   55   1HB   GLU   9          HB2       GLU   9   4.835   4.694   2.085
   56   2HB   GLU   9          HB1       GLU   9   5.574   3.424   3.059
   57   1HG   GLU   9          HG2       GLU   9   6.659   2.478   1.110
   58   2HG   GLU   9          HG1       GLU   9   5.809   3.596   0.045
   59    H    PHE  10           HN       PHE  10   2.018   4.022   3.013
   60    HA   PHE  10           HA       PHE  10   2.312   2.717   5.547
   61   1HB   PHE  10          HB2       PHE  10   1.259   4.937   5.353
   62   2HB   PHE  10          HB1       PHE  10  -0.080   4.216   4.450
   63    HD1  PHE  10           HD1      PHE  10  -1.816   3.005   5.550
   64    HD2  PHE  10           HD2      PHE  10   1.679   4.230   7.720
   65    HE1  PHE  10           HE1      PHE  10  -2.898   2.319   7.680
   66    HE2  PHE  10           HE2      PHE  10   0.601   3.556   9.848
   67    HZ   PHE  10           HZ       PHE  10  -1.687   2.603   9.824
   68    H    LEU  11           HN       LEU  11  -0.073   2.273   2.900
   69    HA   LEU  11           HA       LEU  11  -1.515   0.135   4.168
   70   1HB   LEU  11          HB2       LEU  11  -1.081   0.734   1.222
   71   2HB   LEU  11          HB1       LEU  11  -2.182  -0.515   1.831
   72    HG   LEU  11           HG       LEU  11  -2.399   2.345   2.808
   73   1HD1  LEU  11          HD11      LEU  11  -4.100   2.728   1.039
   74   2HD1  LEU  11          HD12      LEU  11  -3.683   1.172   0.321
   75   3HD1  LEU  11          HD13      LEU  11  -2.492   2.472   0.360
   76   1HD2  LEU  11          HD21      LEU  11  -3.726   0.768   4.061
   77   2HD2  LEU  11          HD22      LEU  11  -4.297  -0.016   2.588
   78   3HD2  LEU  11          HD23      LEU  11  -4.832   1.614   2.982
   79    H    VAL  12           HN       VAL  12   1.325   0.085   1.961
   80    HA   VAL  12           HA       VAL  12   1.535  -2.735   1.790
   81    HB   VAL  12           HB       VAL  12   3.483  -0.433   1.577
   82   1HG1  VAL  12          HG11      VAL  12   5.134  -2.162   0.702
   83   2HG1  VAL  12          HG12      VAL  12   4.125  -3.386   1.480
   84   3HG1  VAL  12          HG13      VAL  12   4.912  -2.139   2.450
   85   1HG2  VAL  12          HG21      VAL  12   2.582  -2.534  -0.417
   86   2HG2  VAL  12          HG22      VAL  12   3.518  -1.079  -0.766
   87   3HG2  VAL  12          HG23      VAL  12   1.840  -0.943  -0.244
   88    H    LYS  13           HN       LYS  13   2.990  -0.455   4.131
   89    HA   LYS  13           HA       LYS  13   4.454  -2.326   5.661
   90   1HB   LYS  13          HB2       LYS  13   4.634   0.138   5.896
   91   2HB   LYS  13          HB1       LYS  13   3.021   0.189   6.591
   92   1HG   LYS  13          HG2       LYS  13   4.331   0.202   8.519
   93   2HG   LYS  13          HG1       LYS  13   4.026  -1.518   8.347
   94   1HD   LYS  13          HD2       LYS  13   6.336  -1.532   8.644
   95   2HD   LYS  13          HD1       LYS  13   6.244  -1.464   6.886
   96   1HE   LYS  13          HE2       LYS  13   6.542   0.970   6.937
   97   2HE   LYS  13          HE1       LYS  13   6.542   0.952   8.700
   98   1HZ   LYS  13          HZ1       LYS  13   8.756   0.855   7.276
   99   2HZ   LYS  13          HZ2       LYS  13   8.435  -0.811   7.358
  100   3HZ   LYS  13          HZ3       LYS  13   8.615   0.092   8.785
  101    H    GLU  14           HN       GLU  14   1.081  -1.268   5.974
  102    HA   GLU  14           HA       GLU  14   0.558  -2.882   8.328
  103   1HB   GLU  14          HB2       GLU  14  -1.246  -1.510   6.328
  104   2HB   GLU  14          HB1       GLU  14  -1.870  -2.440   7.689
  105   1HG   GLU  14          HG2       GLU  14  -0.344  -0.946   9.159
  106   2HG   GLU  14          HG1       GLU  14  -0.243   0.102   7.743
  107    H    VAL  15           HN       VAL  15   0.061  -3.396   4.832
  108    HA   VAL  15           HA       VAL  15  -1.436  -5.796   5.219
  109    HB   VAL  15           HB       VAL  15   0.135  -4.682   2.885
  110   1HG1  VAL  15          HG11      VAL  15  -0.878  -6.566   1.537
  111   2HG1  VAL  15          HG12      VAL  15  -1.294  -7.351   3.060
  112   3HG1  VAL  15          HG13      VAL  15   0.397  -7.078   2.642
  113   1HG2  VAL  15          HG21      VAL  15  -2.806  -5.275   3.330
  114   2HG2  VAL  15          HG22      VAL  15  -2.113  -4.516   1.898
  115   3HG2  VAL  15          HG23      VAL  15  -2.054  -3.684   3.451
  116    H    THR  16           HN       THR  16   2.109  -5.270   4.836
  117    HA   THR  16           HA       THR  16   2.610  -8.065   4.703
  118    HB   THR  16           HB       THR  16   4.835  -7.691   4.828
  119    HG1  THR  16           HG1      THR  16   4.815  -6.976   6.979
  120   1HG2  THR  16          HG21      THR  16   5.242  -5.969   3.392
  121   2HG2  THR  16          HG22      THR  16   4.480  -4.787   4.448
  122   3HG2  THR  16          HG23      THR  16   3.492  -5.792   3.392
  123    H    LYS  17           HN       LYS  17   2.378  -5.913   7.549
  124    HA   LYS  17           HA       LYS  17   3.246  -7.923   9.383
  125   1HB   LYS  17          HB2       LYS  17   3.081  -5.758  10.338
  126   2HB   LYS  17          HB1       LYS  17   1.447  -5.514   9.722
  127   1HG   LYS  17          HG2       LYS  17   0.491  -6.957  11.326
  128   2HG   LYS  17          HG1       LYS  17   2.025  -7.750  11.665
  129   1HD   LYS  17          HD2       LYS  17   2.852  -5.645  12.698
  130   2HD   LYS  17          HD1       LYS  17   1.264  -4.919  12.427
  131   1HE   LYS  17          HE2       LYS  17   0.193  -6.474  13.892
  132   2HE   LYS  17          HE1       LYS  17   1.614  -7.518  13.948
  133   1HZ   LYS  17          HZ1       LYS  17   2.680  -5.274  14.829
  134   2HZ   LYS  17          HZ2       LYS  17   1.928  -6.390  15.867
  135   3HZ   LYS  17          HZ3       LYS  17   1.085  -5.009  15.345
  136    H    LEU  18           HN       LEU  18   0.243  -7.192   7.780
  137    HA   LEU  18           HA       LEU  18  -1.424  -9.067   9.250
  138   1HB   LEU  18          HB2       LEU  18  -1.716  -7.698   6.563
  139   2HB   LEU  18          HB1       LEU  18  -2.942  -8.719   7.236
  140    HG   LEU  18           HG       LEU  18  -2.530  -5.902   7.693
  141   1HD1  LEU  18          HD11      LEU  18  -4.670  -5.997   8.752
  142   2HD1  LEU  18          HD12      LEU  18  -4.501  -7.714   9.082
  143   3HD1  LEU  18          HD13      LEU  18  -4.686  -7.153   7.419
  144   1HD2  LEU  18          HD21      LEU  18  -1.107  -6.626   9.660
  145   2HD2  LEU  18          HD22      LEU  18  -2.531  -7.427  10.318
  146   3HD2  LEU  18          HD23      LEU  18  -2.524  -5.687  10.085
  147    H    ILE  19           HN       ILE  19   0.535  -9.185   6.337
  148    HA   ILE  19           HA       ILE  19  -0.270 -11.866   5.580
  149    HB   ILE  19           HB       ILE  19   2.167 -10.178   4.880
  150   1HG1  ILE  19          HG12      ILE  19  -0.257 -11.005   3.241
  151   2HG1  ILE  19          HG11      ILE  19  -0.072  -9.442   4.012
  152   1HG2  ILE  19          HG21      ILE  19   2.840 -12.485   4.680
  153   2HG2  ILE  19          HG22      ILE  19   2.530 -11.871   3.063
  154   3HG2  ILE  19          HG23      ILE  19   1.338 -12.902   3.855
  155   1HD1  ILE  19          HD11      ILE  19   2.052  -9.120   2.698
  156   2HD1  ILE  19          HD12      ILE  19   0.603  -9.209   1.701
  157   3HD1  ILE  19          HD13      ILE  19   1.673 -10.603   1.828
  158    H    ASP  20           HN       ASP  20   2.140 -10.385   7.631
  159    HA   ASP  20           HA       ASP  20   3.624 -12.831   8.146
  160   1HB   ASP  20          HB2       ASP  20   3.558 -10.273   9.768
  161   2HB   ASP  20          HB1       ASP  20   4.812 -11.515   9.796
  162    H    ASN  21           HN       ASN  21   0.746 -11.342   9.518
  163    HA   ASN  21           HA       ASN  21   0.985 -13.043  11.918
  164   1HB   ASN  21          HB2       ASN  21   0.056 -10.702  12.110
  165   2HB   ASN  21          HB1       ASN  21  -1.328 -11.221  11.148
  166   1HD2  ASN  21          HD21      ASN  21  -2.664 -13.051  12.103
  167   2HD2  ASN  21          HD22      ASN  21  -2.741 -13.202  13.792
  168    H    ASN  22           HN       ASN  22   0.146 -13.655   8.859
  169    HA   ASN  22           HA       ASN  22  -0.696 -15.659   7.990
  170   1HB   ASN  22          HB2       ASN  22  -1.905 -16.436  10.631
  171   2HB   ASN  22          HB1       ASN  22  -1.255 -17.453   9.353
  172   1HD2  ASN  22          HD21      ASN  22  -0.507 -16.815  12.389
  173   2HD2  ASN  22          HD22      ASN  22   1.185 -16.700  12.313
  174    H    LYS  23           HN       LYS  23  -2.357 -13.273   7.811
  175    HA   LYS  23           HA       LYS  23  -5.108 -14.273   8.350
  176   1HB   LYS  23          HB2       LYS  23  -4.443 -11.652   7.132
  177   2HB   LYS  23          HB1       LYS  23  -5.884 -12.098   8.027
  178   1HG   LYS  23          HG2       LYS  23  -3.744 -12.564   9.830
  179   2HG   LYS  23          HG1       LYS  23  -3.339 -11.043   9.048
  180   1HD   LYS  23          HD2       LYS  23  -5.441 -10.052   9.752
  181   2HD   LYS  23          HD1       LYS  23  -6.032 -11.615  10.320
  182   1HE   LYS  23          HE2       LYS  23  -4.130 -11.665  11.955
  183   2HE   LYS  23          HE1       LYS  23  -3.737 -10.017  11.469
  184   1HZ   LYS  23          HZ1       LYS  23  -6.509 -10.527  12.175
  185   2HZ   LYS  23          HZ2       LYS  23  -5.529  -9.181  12.513
  186   3HZ   LYS  23          HZ3       LYS  23  -5.395 -10.590  13.452
  187    H    THR  24           HN       THR  24  -6.631 -14.503   6.593
  188    HA   THR  24           HA       THR  24  -5.444 -15.377   4.057
  189    HB   THR  24           HB       THR  24  -7.506 -16.332   3.601
  190    HG1  THR  24           HG1      THR  24  -8.434 -13.976   4.742
  191   1HG2  THR  24          HG21      THR  24  -6.710 -17.058   5.875
  192   2HG2  THR  24          HG22      THR  24  -8.449 -17.213   5.630
  193   3HG2  THR  24          HG23      THR  24  -7.809 -15.870   6.573
  194    H    GLU  25           HN       GLU  25  -6.312 -14.621   1.973
  195    HA   GLU  25           HA       GLU  25  -5.969 -11.815   1.589
  196   1HB   GLU  25          HB2       GLU  25  -5.698 -13.204  -0.328
  197   2HB   GLU  25          HB1       GLU  25  -7.260 -13.981  -0.095
  198   1HG   GLU  25          HG2       GLU  25  -7.263 -11.015  -0.529
  199   2HG   GLU  25          HG1       GLU  25  -6.884 -12.024  -1.920
  200    H    LYS  26           HN       LYS  26  -8.923 -13.774   1.904
  201    HA   LYS  26           HA       LYS  26 -10.840 -11.741   1.552
  202   1HB   LYS  26          HB2       LYS  26 -11.253 -14.239   1.799
  203   2HB   LYS  26          HB1       LYS  26 -11.094 -14.001   3.536
  204   1HG   LYS  26          HG2       LYS  26 -13.398 -13.759   3.297
  205   2HG   LYS  26          HG1       LYS  26 -12.890 -12.082   3.126
  206   1HD   LYS  26          HD2       LYS  26 -12.879 -12.371   0.647
  207   2HD   LYS  26          HD1       LYS  26 -13.468 -14.018   0.862
  208   1HE   LYS  26          HE2       LYS  26 -15.405 -12.684   0.440
  209   2HE   LYS  26          HE1       LYS  26 -15.412 -13.009   2.173
  210   1HZ   LYS  26          HZ1       LYS  26 -15.533 -10.552   1.008
  211   2HZ   LYS  26          HZ2       LYS  26 -13.909 -10.670   1.495
  212   3HZ   LYS  26          HZ3       LYS  26 -15.156 -10.862   2.633
  213    H    GLU  27           HN       GLU  27  -8.896 -12.463   4.399
  214    HA   GLU  27           HA       GLU  27 -10.457 -10.711   6.129
  215   1HB   GLU  27          HB2       GLU  27  -7.756 -12.030   6.402
  216   2HB   GLU  27          HB1       GLU  27  -8.383 -10.914   7.611
  217   1HG   GLU  27          HG2       GLU  27 -10.413 -12.339   7.818
  218   2HG   GLU  27          HG1       GLU  27  -9.667 -13.493   6.714
  219    H    ILE  28           HN       ILE  28  -7.498 -10.321   4.174
  220    HA   ILE  28           HA       ILE  28  -6.784  -7.767   5.261
  221    HB   ILE  28           HB       ILE  28  -6.242  -8.699   2.428
  222   1HG1  ILE  28          HG12      ILE  28  -5.449  -9.878   5.024
  223   2HG1  ILE  28          HG11      ILE  28  -5.516 -10.623   3.457
  224   1HG2  ILE  28          HG21      ILE  28  -4.536  -7.112   4.371
  225   2HG2  ILE  28          HG22      ILE  28  -5.525  -6.406   3.097
  226   3HG2  ILE  28          HG23      ILE  28  -4.173  -7.451   2.680
  227   1HD1  ILE  28          HD11      ILE  28  -3.231 -10.626   4.250
  228   2HD1  ILE  28          HD12      ILE  28  -3.287  -8.885   4.535
  229   3HD1  ILE  28          HD13      ILE  28  -3.350  -9.509   2.885
  230    H    LEU  29           HN       LEU  29  -8.880  -8.726   2.558
  231    HA   LEU  29           HA       LEU  29  -9.426  -5.997   1.767
  232   1HB   LEU  29          HB2       LEU  29 -11.076  -8.489   1.258
  233   2HB   LEU  29          HB1       LEU  29 -11.102  -6.990   0.325
  234    HG   LEU  29           HG       LEU  29  -8.679  -8.802   0.638
  235   1HD1  LEU  29          HD11      LEU  29 -10.228  -9.960  -0.751
  236   2HD1  LEU  29          HD12      LEU  29  -9.152  -9.134  -1.877
  237   3HD1  LEU  29          HD13      LEU  29 -10.754  -8.478  -1.547
  238   1HD2  LEU  29          HD21      LEU  29  -7.828  -6.641   0.221
  239   2HD2  LEU  29          HD22      LEU  29  -9.200  -6.185  -0.789
  240   3HD2  LEU  29          HD23      LEU  29  -7.984  -7.302  -1.405
  241    H    ASP  30           HN       ASP  30 -10.791  -8.251   4.068
  242    HA   ASP  30           HA       ASP  30 -13.251  -6.791   4.560
  243   1HB   ASP  30          HB2       ASP  30 -12.848  -9.183   5.251
  244   2HB   ASP  30          HB1       ASP  30 -11.736  -8.587   6.482
  245    H    ALA  31           HN       ALA  31 -10.054  -6.831   6.139
  246    HA   ALA  31           HA       ALA  31 -10.712  -4.879   8.130
  247   1HB   ALA  31          HB1       ALA  31  -7.993  -5.539   6.969
  248   2HB   ALA  31          HB2       ALA  31  -8.780  -6.437   8.266
  249   3HB   ALA  31          HB3       ALA  31  -8.308  -4.758   8.520
  250    H    PHE  32           HN       PHE  32  -9.703  -4.553   4.773
  251    HA   PHE  32           HA       PHE  32  -8.675  -1.928   4.719
  252   1HB   PHE  32          HB2       PHE  32 -10.383  -3.548   2.846
  253   2HB   PHE  32          HB1       PHE  32 -10.055  -1.873   2.459
  254    HD1  PHE  32           HD1      PHE  32  -7.341  -3.581   4.289
  255    HD2  PHE  32           HD2      PHE  32  -9.010  -2.820   0.391
  256    HE1  PHE  32           HE1      PHE  32  -5.189  -4.151   3.249
  257    HE2  PHE  32           HE2      PHE  32  -6.843  -3.420  -0.640
  258    HZ   PHE  32           HZ       PHE  32  -4.935  -4.091   0.787
  259    H    ASP  33           HN       ASP  33 -11.734  -2.969   5.804
  260    HA   ASP  33           HA       ASP  33 -13.169  -0.512   5.121
  261   1HB   ASP  33          HB2       ASP  33 -14.370  -2.645   5.266
  262   2HB   ASP  33          HB1       ASP  33 -13.910  -2.801   6.962
  263    H    LYS  34           HN       LYS  34 -11.162  -1.569   7.774
  264    HA   LYS  34           HA       LYS  34 -11.951   0.910   9.272
  265   1HB   LYS  34          HB2       LYS  34 -11.292  -0.381  11.360
  266   2HB   LYS  34          HB1       LYS  34 -12.792  -0.893  10.590
  267   1HG   LYS  34          HG2       LYS  34 -11.708  -2.777   9.559
  268   2HG   LYS  34          HG1       LYS  34 -10.117  -2.208  10.064
  269   1HD   LYS  34          HD2       LYS  34 -10.806  -3.967  11.585
  270   2HD   LYS  34          HD1       LYS  34 -10.854  -2.434  12.451
  271   1HE   LYS  34          HE2       LYS  34 -13.209  -2.331  12.387
  272   2HE   LYS  34          HE1       LYS  34 -13.319  -3.507  11.078
  273   1HZ   LYS  34          HZ1       LYS  34 -11.976  -4.584  13.343
  274   2HZ   LYS  34          HZ2       LYS  34 -13.342  -5.169  12.520
  275   3HZ   LYS  34          HZ3       LYS  34 -13.522  -4.023  13.761
  276    H    MET  35           HN       MET  35  -9.590  -0.173   7.377
  277    HA   MET  35           HA       MET  35  -7.305   0.371   9.166
  278   1HB   MET  35          HB2       MET  35  -7.634  -0.533   6.333
  279   2HB   MET  35          HB1       MET  35  -6.156   0.330   6.708
  280   1HG   MET  35          HG2       MET  35  -5.279  -1.557   7.583
  281   2HG   MET  35          HG1       MET  35  -6.555  -1.641   8.780
  282   1HE   MET  35          HE1       MET  35  -4.745  -3.733   7.025
  283   2HE   MET  35          HE2       MET  35  -5.159  -3.160   5.412
  284   3HE   MET  35          HE3       MET  35  -5.685  -4.759   5.932
  285    H    CYS  36           HN       CYS  36  -8.946   2.048   6.409
  286    HA   CYS  36           HA       CYS  36  -7.128   4.261   6.541
  287   1HB   CYS  36          HB2       CYS  36  -9.913   3.883   5.444
  288   2HB   CYS  36          HB1       CYS  36  -9.286   5.523   5.605
  289    H    SER  37           HN       SER  37  -9.237   2.994   8.751
  290    HA   SER  37           HA       SER  37 -10.049   5.562   9.978
  291   1HB   SER  37          HB2       SER  37 -11.419   3.423  10.082
  292   2HB   SER  37          HB1       SER  37 -10.222   2.808  11.217
  293    HG   SER  37           HG       SER  37 -10.892   5.265  11.961
  294    H    LYS  38           HN       LYS  38  -7.082   4.491   9.727
  295    HA   LYS  38           HA       LYS  38  -6.375   4.998  12.610
  296   1HB   LYS  38          HB2       LYS  38  -5.159   3.130  10.576
  297   2HB   LYS  38          HB1       LYS  38  -4.213   3.718  11.944
  298   1HG   LYS  38          HG2       LYS  38  -5.645   2.697  13.525
  299   2HG   LYS  38          HG1       LYS  38  -6.944   2.492  12.350
  300   1HD   LYS  38          HD2       LYS  38  -5.778   0.351  12.829
  301   2HD   LYS  38          HD1       LYS  38  -5.620   0.825  11.139
  302   1HE   LYS  38          HE2       LYS  38  -3.476   0.030  12.280
  303   2HE   LYS  38          HE1       LYS  38  -3.383   1.587  11.458
  304   1HZ   LYS  38          HZ1       LYS  38  -3.518   2.736  13.472
  305   2HZ   LYS  38          HZ2       LYS  38  -2.442   1.460  13.790
  306   3HZ   LYS  38          HZ3       LYS  38  -4.051   1.375  14.331
  307    H    LEU  39           HN       LEU  39  -6.409   6.458   9.664
  308    HA   LEU  39           HA       LEU  39  -3.813   7.896  10.096
  309   1HB   LEU  39          HB2       LEU  39  -5.618   7.829   7.658
  310   2HB   LEU  39          HB1       LEU  39  -4.055   8.625   7.744
  311    HG   LEU  39           HG       LEU  39  -4.487   5.652   8.129
  312   1HD1  LEU  39          HD11      LEU  39  -3.709   5.350   5.903
  313   2HD1  LEU  39          HD12      LEU  39  -3.206   7.032   5.774
  314   3HD1  LEU  39          HD13      LEU  39  -4.920   6.627   5.799
  315   1HD2  LEU  39          HD21      LEU  39  -1.925   5.740   7.659
  316   2HD2  LEU  39          HD22      LEU  39  -2.478   6.212   9.261
  317   3HD2  LEU  39          HD23      LEU  39  -2.054   7.445   8.073
  318    HA   PRO  40           HA       PRO  40  -6.058  11.418  11.604
  319   1HB   PRO  40          HB2       PRO  40  -4.542  13.238   9.836
  320   2HB   PRO  40          HB1       PRO  40  -4.552  13.162  11.604
  321   1HG   PRO  40          HG2       PRO  40  -2.491  12.204   9.871
  322   2HG   PRO  40          HG1       PRO  40  -2.599  11.965  11.622
  323   1HD   PRO  40          HD2       PRO  40  -2.926   9.982   9.570
  324   2HD   PRO  40          HD1       PRO  40  -3.089   9.751  11.317
  325    H    LYS  41           HN       LYS  41  -7.705  13.022  10.750
  326    HA   LYS  41           HA       LYS  41  -9.127  11.944   8.493
  327   1HB   LYS  41          HB2       LYS  41 -10.089  13.339  10.408
  328   2HB   LYS  41          HB1       LYS  41  -9.420  14.742   9.576
  329   1HG   LYS  41          HG2       LYS  41 -10.771  14.347   7.632
  330   2HG   LYS  41          HG1       LYS  41 -11.272  12.764   8.222
  331   1HD   LYS  41          HD2       LYS  41 -13.051  14.445   8.561
  332   2HD   LYS  41          HD1       LYS  41 -12.460  13.818  10.098
  333   1HE   LYS  41          HE2       LYS  41 -12.757  16.382   9.878
  334   2HE   LYS  41          HE1       LYS  41 -11.251  15.789  10.575
  335   1HZ   LYS  41          HZ1       LYS  41 -11.588  16.417   7.696
  336   2HZ   LYS  41          HZ2       LYS  41 -10.138  16.093   8.520
  337   3HZ   LYS  41          HZ3       LYS  41 -10.990  17.530   8.829
  338    H    SER  42           HN       SER  42  -6.479  14.123   8.603
  339    HA   SER  42           HA       SER  42  -7.182  15.552   6.200
  340   1HB   SER  42          HB2       SER  42  -5.626  16.682   7.584
  341   2HB   SER  42          HB1       SER  42  -4.615  15.249   7.757
  342    HG   SER  42           HG       SER  42  -3.675  15.706   5.926
  343    H    LEU  43           HN       LEU  43  -6.032  12.401   6.544
  344    HA   LEU  43           HA       LEU  43  -5.207  12.397   3.647
  345   1HB   LEU  43          HB2       LEU  43  -4.511  10.277   5.687
  346   2HB   LEU  43          HB1       LEU  43  -3.840  10.479   4.071
  347    HG   LEU  43           HG       LEU  43  -3.447  12.288   6.439
  348   1HD1  LEU  43          HD11      LEU  43  -1.673  10.388   4.932
  349   2HD1  LEU  43          HD12      LEU  43  -2.011  10.439   6.664
  350   3HD1  LEU  43          HD13      LEU  43  -1.011  11.687   5.925
  351   1HD2  LEU  43          HD21      LEU  43  -2.716  12.603   3.530
  352   2HD2  LEU  43          HD22      LEU  43  -1.823  13.444   4.796
  353   3HD2  LEU  43          HD23      LEU  43  -3.540  13.760   4.571
  354    H    SER  44           HN       SER  44  -7.747  11.677   5.662
  355    HA   SER  44           HA       SER  44  -8.682   9.150   5.267
  356   1HB   SER  44          HB2       SER  44 -10.133  10.738   6.327
  357   2HB   SER  44          HB1       SER  44 -10.195  11.747   4.886
  358    HG   SER  44           HG       SER  44 -10.984   9.082   4.647
  359    H    GLU  45           HN       GLU  45  -9.683  11.613   2.964
  360    HA   GLU  45           HA       GLU  45 -10.763  10.067   1.025
  361   1HB   GLU  45          HB2       GLU  45  -9.283  12.678   0.715
  362   2HB   GLU  45          HB1       GLU  45 -10.462  12.028  -0.428
  363   1HG   GLU  45          HG2       GLU  45 -11.077  12.584   2.490
  364   2HG   GLU  45          HG1       GLU  45 -11.438  13.702   1.176
  365    H    GLU  46           HN       GLU  46  -7.485  11.392   0.736
  366    HA   GLU  46           HA       GLU  46  -6.897  10.296  -1.788
  367   1HB   GLU  46          HB2       GLU  46  -4.504  10.443  -0.983
  368   2HB   GLU  46          HB1       GLU  46  -5.431  11.928  -0.780
  369   1HG   GLU  46          HG2       GLU  46  -5.877  11.324   1.561
  370   2HG   GLU  46          HG1       GLU  46  -4.956   9.834   1.353
  371    H    CYS  47           HN       CYS  47  -7.183   8.742   1.301
  372    HA   CYS  47           HA       CYS  47  -5.690   6.362   0.458
  373   1HB   CYS  47          HB2       CYS  47  -5.973   5.628   2.640
  374   2HB   CYS  47          HB1       CYS  47  -6.310   7.333   2.917
  375    H    GLN  48           HN       GLN  48  -9.094   7.294   0.833
  376    HA   GLN  48           HA       GLN  48 -10.292   4.839   0.166
  377   1HB   GLN  48          HB2       GLN  48 -11.133   7.671  -0.517
  378   2HB   GLN  48          HB1       GLN  48 -12.149   6.265  -0.836
  379   1HG   GLN  48          HG2       GLN  48 -12.117   5.676   1.543
  380   2HG   GLN  48          HG1       GLN  48 -11.063   7.050   1.880
  381   1HE2  GLN  48          HE21      GLN  48 -14.170   6.233   2.314
  382   2HE2  GLN  48          HE22      GLN  48 -14.937   7.722   2.041
  383    H    GLU  49           HN       GLU  49  -9.026   7.364  -1.999
  384    HA   GLU  49           HA       GLU  49  -9.817   6.037  -4.410
  385   1HB   GLU  49          HB2       GLU  49  -7.746   8.151  -3.804
  386   2HB   GLU  49          HB1       GLU  49  -8.037   7.554  -5.437
  387   1HG   GLU  49          HG2       GLU  49 -10.365   8.246  -5.330
  388   2HG   GLU  49          HG1       GLU  49 -10.184   8.713  -3.639
  389    H    VAL  50           HN       VAL  50  -6.809   5.958  -2.502
  390    HA   VAL  50           HA       VAL  50  -5.383   4.338  -4.398
  391    HB   VAL  50           HB       VAL  50  -4.903   4.523  -1.417
  392   1HG1  VAL  50          HG11      VAL  50  -3.146   3.644  -3.716
  393   2HG1  VAL  50          HG12      VAL  50  -3.776   2.622  -2.424
  394   3HG1  VAL  50          HG13      VAL  50  -2.594   3.875  -2.058
  395   1HG2  VAL  50          HG21      VAL  50  -3.611   6.436  -1.780
  396   2HG2  VAL  50          HG22      VAL  50  -4.867   6.685  -2.988
  397   3HG2  VAL  50          HG23      VAL  50  -3.306   6.037  -3.471
  398    H    VAL  51           HN       VAL  51  -6.992   3.525  -1.282
  399    HA   VAL  51           HA       VAL  51  -6.560   0.755  -1.557
  400    HB   VAL  51           HB       VAL  51  -8.855   2.114  -0.088
  401   1HG1  VAL  51          HG11      VAL  51  -7.497  -0.560   0.277
  402   2HG1  VAL  51          HG12      VAL  51  -9.172  -0.277  -0.204
  403   3HG1  VAL  51          HG13      VAL  51  -8.639   0.136   1.427
  404   1HG2  VAL  51          HG21      VAL  51  -6.550   3.008   0.465
  405   2HG2  VAL  51          HG22      VAL  51  -6.135   1.387   1.017
  406   3HG2  VAL  51          HG23      VAL  51  -7.408   2.296   1.832
  407    H    ASP  52           HN       ASP  52  -9.495   2.583  -2.342
  408    HA   ASP  52           HA       ASP  52 -10.967   0.380  -3.333
  409   1HB   ASP  52          HB2       ASP  52 -11.187   3.288  -4.140
  410   2HB   ASP  52          HB1       ASP  52 -12.425   2.051  -4.355
  411    H    THR  53           HN       THR  53  -8.860   2.663  -5.092
  412    HA   THR  53           HA       THR  53  -9.430   1.312  -7.649
  413    HB   THR  53           HB       THR  53  -7.423   3.491  -7.077
  414    HG1  THR  53           HG1      THR  53  -9.195   4.820  -7.875
  415   1HG2  THR  53          HG21      THR  53  -7.223   2.271  -9.240
  416   2HG2  THR  53          HG22      THR  53  -7.670   3.963  -9.457
  417   3HG2  THR  53          HG23      THR  53  -8.893   2.702  -9.605
  418    H    TYR  54           HN       TYR  54  -6.663   1.595  -5.407
  419    HA   TYR  54           HA       TYR  54  -5.255  -0.438  -7.110
  420   1HB   TYR  54          HB2       TYR  54  -4.191   1.582  -5.150
  421   2HB   TYR  54          HB1       TYR  54  -3.205   0.356  -5.940
  422    HD1  TYR  54           HD1      TYR  54  -5.195   3.402  -6.428
  423    HD2  TYR  54           HD2      TYR  54  -2.710   0.485  -8.336
  424    HE1  TYR  54           HE1      TYR  54  -5.008   4.879  -8.392
  425    HE2  TYR  54           HE2      TYR  54  -2.516   1.956 -10.325
  426    HH   TYR  54           HH       TYR  54  -2.840   4.853 -10.506
  427    H    GLY  55           HN       GLY  55  -7.284  -1.106  -5.077
  428   1HA   GLY  55          HA2       GLY  55  -5.822  -2.147  -2.781
  429   2HA   GLY  55          HA1       GLY  55  -7.535  -2.382  -3.109
  430    H    SER  56           HN       SER  56  -7.697  -3.807  -5.405
  431    HA   SER  56           HA       SER  56  -6.767  -6.369  -4.576
  432   1HB   SER  56          HB2       SER  56  -7.468  -5.801  -7.446
  433   2HB   SER  56          HB1       SER  56  -7.791  -7.244  -6.484
  434    HG   SER  56           HG       SER  56  -9.620  -5.784  -6.855
  435    H    SER  57           HN       SER  57  -5.434  -3.909  -6.636
  436    HA   SER  57           HA       SER  57  -3.530  -5.693  -7.873
  437   1HB   SER  57          HB2       SER  57  -2.540  -3.667  -8.869
  438   2HB   SER  57          HB1       SER  57  -4.295  -3.618  -9.012
  439    HG   SER  57           HG       SER  57  -4.217  -2.388  -6.986
  440    H    ILE  58           HN       ILE  58  -3.203  -3.243  -5.288
  441    HA   ILE  58           HA       ILE  58  -0.408  -3.617  -4.807
  442    HB   ILE  58           HB       ILE  58  -2.724  -2.875  -2.996
  443   1HG1  ILE  58          HG12      ILE  58  -0.328  -1.311  -4.017
  444   2HG1  ILE  58          HG11      ILE  58  -1.935  -1.243  -4.730
  445   1HG2  ILE  58          HG21      ILE  58   0.201  -3.296  -2.335
  446   2HG2  ILE  58          HG22      ILE  58  -1.208  -3.919  -1.482
  447   3HG2  ILE  58          HG23      ILE  58  -0.802  -2.210  -1.378
  448   1HD1  ILE  58          HD11      ILE  58  -2.064   0.594  -3.312
  449   2HD1  ILE  58          HD12      ILE  58  -0.949  -0.113  -2.143
  450   3HD1  ILE  58          HD13      ILE  58  -2.626  -0.658  -2.204
  451    H    LEU  59           HN       LEU  59  -3.219  -5.095  -3.319
  452    HA   LEU  59           HA       LEU  59  -1.856  -7.003  -1.724
  453   1HB   LEU  59          HB2       LEU  59  -4.173  -6.427  -1.312
  454   2HB   LEU  59          HB1       LEU  59  -4.647  -7.000  -2.907
  455    HG   LEU  59           HG       LEU  59  -4.094  -9.289  -2.313
  456   1HD1  LEU  59          HD11      LEU  59  -3.487  -9.669   0.205
  457   2HD1  LEU  59          HD12      LEU  59  -2.985  -7.979   0.176
  458   3HD1  LEU  59          HD13      LEU  59  -2.208  -9.148  -0.887
  459   1HD2  LEU  59          HD21      LEU  59  -5.612  -9.453  -0.154
  460   2HD2  LEU  59          HD22      LEU  59  -6.307  -8.908  -1.677
  461   3HD2  LEU  59          HD23      LEU  59  -5.869  -7.735  -0.437
  462    H    SER  60           HN       SER  60  -2.642  -7.038  -5.177
  463    HA   SER  60           HA       SER  60  -2.357  -9.905  -5.287
  464   1HB   SER  60          HB2       SER  60  -3.732  -8.945  -6.979
  465   2HB   SER  60          HB1       SER  60  -2.497  -7.768  -7.418
  466    HG   SER  60           HG       SER  60  -2.348  -9.345  -8.931
  467    H    ILE  61           HN       ILE  61  -0.313  -7.107  -5.875
  468    HA   ILE  61           HA       ILE  61   1.930  -8.453  -7.085
  469    HB   ILE  61           HB       ILE  61   2.002  -5.930  -5.413
  470   1HG1  ILE  61          HG12      ILE  61   0.444  -6.412  -7.820
  471   2HG1  ILE  61          HG11      ILE  61   0.603  -4.928  -6.894
  472   1HG2  ILE  61          HG21      ILE  61   3.886  -5.345  -6.871
  473   2HG2  ILE  61          HG22      ILE  61   3.679  -6.854  -7.764
  474   3HG2  ILE  61          HG23      ILE  61   4.166  -6.887  -6.070
  475   1HD1  ILE  61          HD11      ILE  61   2.491  -5.820  -9.085
  476   2HD1  ILE  61          HD12      ILE  61   2.614  -4.328  -8.149
  477   3HD1  ILE  61          HD13      ILE  61   1.246  -4.581  -9.229
  478    H    LEU  62           HN       LEU  62   1.336  -7.349  -3.733
  479    HA   LEU  62           HA       LEU  62   3.788  -8.167  -2.671
  480   1HB   LEU  62          HB2       LEU  62   1.290  -7.230  -1.670
  481   2HB   LEU  62          HB1       LEU  62   1.686  -8.653  -0.715
  482    HG   LEU  62           HG       LEU  62   3.609  -6.356  -1.216
  483   1HD1  LEU  62          HD11      LEU  62   1.424  -5.958   0.235
  484   2HD1  LEU  62          HD12      LEU  62   2.987  -5.373   0.788
  485   3HD1  LEU  62          HD13      LEU  62   2.327  -6.866   1.443
  486   1HD2  LEU  62          HD21      LEU  62   4.942  -8.207  -0.667
  487   2HD2  LEU  62          HD22      LEU  62   3.711  -8.921   0.372
  488   3HD2  LEU  62          HD23      LEU  62   4.628  -7.528   0.926
  489    H    LEU  63           HN       LEU  63   0.919 -10.091  -3.362
  490    HA   LEU  63           HA       LEU  63   1.919 -12.490  -2.044
  491   1HB   LEU  63          HB2       LEU  63  -0.179 -12.167  -4.214
  492   2HB   LEU  63          HB1       LEU  63   0.102 -13.632  -3.271
  493    HG   LEU  63           HG       LEU  63  -0.690 -10.943  -2.119
  494   1HD1  LEU  63          HD11      LEU  63  -2.487 -12.044  -3.437
  495   2HD1  LEU  63          HD12      LEU  63  -2.872 -11.983  -1.717
  496   3HD1  LEU  63          HD13      LEU  63  -2.307 -13.488  -2.441
  497   1HD2  LEU  63          HD21      LEU  63   0.434 -11.979  -0.364
  498   2HD2  LEU  63          HD22      LEU  63   0.034 -13.605  -0.918
  499   3HD2  LEU  63          HD23      LEU  63  -1.189 -12.618  -0.117
  500    H    GLU  64           HN       GLU  64   2.655 -10.924  -4.977
  501    HA   GLU  64           HA       GLU  64   3.631 -13.380  -6.257
  502   1HB   GLU  64          HB2       GLU  64   2.583 -11.348  -7.461
  503   2HB   GLU  64          HB1       GLU  64   4.116 -10.539  -7.179
  504   1HG   GLU  64          HG2       GLU  64   4.227 -11.523  -9.369
  505   2HG   GLU  64          HG1       GLU  64   5.248 -12.503  -8.319
  506    H    GLU  65           HN       GLU  65   4.661 -12.698  -3.721
  507    HA   GLU  65           HA       GLU  65   6.725 -12.499  -2.560
  508   1HB   GLU  65          HB2       GLU  65   7.481 -13.826  -5.155
  509   2HB   GLU  65          HB1       GLU  65   8.528 -13.744  -3.737
  510   1HG   GLU  65          HG2       GLU  65   5.724 -14.880  -3.648
  511   2HG   GLU  65          HG1       GLU  65   7.152 -15.873  -3.943
  512    H    VAL  66           HN       VAL  66   6.069 -10.117  -4.315
  513    HA   VAL  66           HA       VAL  66   8.765  -9.281  -5.275
  514    HB   VAL  66           HB       VAL  66   5.956  -8.268  -5.574
  515   1HG1  VAL  66          HG11      VAL  66   6.933  -6.215  -4.886
  516   2HG1  VAL  66          HG12      VAL  66   7.004  -6.168  -6.646
  517   3HG1  VAL  66          HG13      VAL  66   8.449  -6.566  -5.715
  518   1HG2  VAL  66          HG21      VAL  66   8.226  -8.342  -7.569
  519   2HG2  VAL  66          HG22      VAL  66   6.495  -8.314  -7.898
  520   3HG2  VAL  66          HG23      VAL  66   7.243  -9.764  -7.219
  521    H    SER  67           HN       SER  67   9.931  -7.602  -4.237
  522    HA   SER  67           HA       SER  67   9.826  -7.369  -1.468
  523   1HB   SER  67          HB2       SER  67  10.716  -4.990  -3.069
  524   2HB   SER  67          HB1       SER  67  11.482  -5.733  -1.671
  525    HG   SER  67           HG       SER  67  12.399  -6.106  -3.881
  526    HA   PRO  68           HA       PRO  68   6.294  -4.835  -0.664
  527   1HB   PRO  68          HB2       PRO  68   7.261  -3.369   1.571
  528   2HB   PRO  68          HB1       PRO  68   6.468  -4.942   1.620
  529   1HG   PRO  68          HG2       PRO  68   9.327  -4.309   1.979
  530   2HG   PRO  68          HG1       PRO  68   8.442  -5.772   2.440
  531   1HD   PRO  68          HD2       PRO  68  10.220  -5.528   0.245
  532   2HD   PRO  68          HD1       PRO  68   9.091  -6.865   0.545
  533    H    GLU  69           HN       GLU  69   9.396  -2.984  -0.556
  534    HA   GLU  69           HA       GLU  69   7.995  -0.476  -1.068
  535   1HB   GLU  69          HB2       GLU  69  10.597   0.153  -1.602
  536   2HB   GLU  69          HB1       GLU  69   9.929   0.087   0.026
  537   1HG   GLU  69          HG2       GLU  69  10.723  -2.186   0.326
  538   2HG   GLU  69          HG1       GLU  69  11.265  -2.261  -1.351
  539    H    LEU  70           HN       LEU  70   9.074  -3.016  -3.087
  540    HA   LEU  70           HA       LEU  70   9.536  -1.330  -5.419
  541   1HB   LEU  70          HB2       LEU  70   9.109  -4.311  -5.064
  542   2HB   LEU  70          HB1       LEU  70   9.234  -3.596  -6.658
  543    HG   LEU  70           HG       LEU  70  11.307  -3.254  -4.513
  544   1HD1  LEU  70          HD11      LEU  70  10.955  -5.650  -5.403
  545   2HD1  LEU  70          HD12      LEU  70  12.588  -4.995  -5.486
  546   3HD1  LEU  70          HD13      LEU  70  11.580  -5.030  -6.931
  547   1HD2  LEU  70          HD21      LEU  70  12.671  -2.782  -6.758
  548   2HD2  LEU  70          HD22      LEU  70  11.760  -1.509  -5.960
  549   3HD2  LEU  70          HD23      LEU  70  11.072  -2.342  -7.348
  550    H    VAL  71           HN       VAL  71   6.854  -2.408  -3.676
  551    HA   VAL  71           HA       VAL  71   4.935  -2.567  -5.784
  552    HB   VAL  71           HB       VAL  71   4.745  -2.119  -2.800
  553   1HG1  VAL  71          HG11      VAL  71   2.508  -1.721  -4.779
  554   2HG1  VAL  71          HG12      VAL  71   2.907  -0.748  -3.363
  555   3HG1  VAL  71          HG13      VAL  71   2.167  -2.330  -3.161
  556   1HG2  VAL  71          HG21      VAL  71   5.071  -4.396  -3.533
  557   2HG2  VAL  71          HG22      VAL  71   3.754  -4.259  -4.700
  558   3HG2  VAL  71          HG23      VAL  71   3.408  -4.241  -2.970
  559    H    CYS  72           HN       CYS  72   5.547   0.236  -3.570
  560    HA   CYS  72           HA       CYS  72   3.727   1.811  -5.064
  561   1HB   CYS  72          HB2       CYS  72   6.070   2.857  -3.430
  562   2HB   CYS  72          HB1       CYS  72   4.591   3.723  -3.813
  563    H    SER  73           HN       SER  73   7.111   1.069  -5.567
  564    HA   SER  73           HA       SER  73   7.538   3.219  -7.522
  565   1HB   SER  73          HB2       SER  73   9.146   0.668  -7.369
  566   2HB   SER  73          HB1       SER  73   9.681   2.260  -7.899
  567    HG   SER  73           HG       SER  73  10.212   1.493  -5.657
  568    H    MET  74           HN       MET  74   6.594  -0.210  -7.832
  569    HA   MET  74           HA       MET  74   6.725  -0.201 -10.763
  570   1HB   MET  74          HB2       MET  74   5.844  -2.073  -8.634
  571   2HB   MET  74          HB1       MET  74   4.986  -2.239 -10.163
  572   1HG   MET  74          HG2       MET  74   7.362  -2.279 -11.236
  573   2HG   MET  74          HG1       MET  74   7.922  -2.614  -9.604
  574   1HE   MET  74          HE1       MET  74   5.636  -5.721  -8.724
  575   2HE   MET  74          HE2       MET  74   4.828  -4.166  -8.896
  576   3HE   MET  74          HE3       MET  74   6.398  -4.254  -8.100
  577    H    LEU  75           HN       LEU  75   4.038   0.323  -8.459
  578    HA   LEU  75           HA       LEU  75   2.079   0.473 -10.585
  579   1HB   LEU  75          HB2       LEU  75   1.878   1.650  -7.806
  580   2HB   LEU  75          HB1       LEU  75   0.541   1.292  -8.896
  581    HG   LEU  75           HG       LEU  75   2.399  -0.694  -7.567
  582   1HD1  LEU  75          HD11      LEU  75   0.163  -1.583  -6.750
  583   2HD1  LEU  75          HD12      LEU  75  -0.544  -0.085  -7.350
  584   3HD1  LEU  75          HD13      LEU  75   0.673  -0.037  -6.075
  585   1HD2  LEU  75          HD21      LEU  75   0.768  -2.362  -8.740
  586   2HD2  LEU  75          HD22      LEU  75   2.086  -1.674  -9.684
  587   3HD2  LEU  75          HD23      LEU  75   0.453  -1.023  -9.844
  588    H    HIS  76           HN       HIS  76   4.549   2.299 -10.600
  589    HA   HIS  76           HA       HIS  76   5.066   4.523 -11.139
  590   1HB   HIS  76          HB2       HIS  76   3.790   5.428 -12.956
  591   2HB   HIS  76          HB1       HIS  76   3.779   3.678 -13.160
  592    HD1  HIS  76           HD1      HIS  76   1.587   6.374 -11.579
  593    HD2  HIS  76           HD2      HIS  76   1.230   2.639 -13.396
  594    HE1  HIS  76           HE1      HIS  76  -0.894   5.894 -11.746
  595    H    LEU  77           HN       LEU  77   3.345   4.047  -8.629
  596    HA   LEU  77           HA       LEU  77   1.768   6.540  -8.532
  597   1HB   LEU  77          HB2       LEU  77   2.320   4.344  -6.532
  598   2HB   LEU  77          HB1       LEU  77   1.485   5.809  -6.077
  599    HG   LEU  77           HG       LEU  77   0.587   3.675  -8.008
  600   1HD1  LEU  77          HD11      LEU  77  -1.320   3.526  -6.496
  601   2HD1  LEU  77          HD12      LEU  77  -0.733   4.912  -5.582
  602   3HD1  LEU  77          HD13      LEU  77   0.170   3.403  -5.561
  603   1HD2  LEU  77          HD21      LEU  77  -0.387   6.521  -7.732
  604   2HD2  LEU  77          HD22      LEU  77  -1.534   5.246  -8.137
  605   3HD2  LEU  77          HD23      LEU  77  -0.172   5.566  -9.200
  606    H    CYS  78           HN       CYS  78   4.988   5.673  -8.070
  607    HA   CYS  78           HA       CYS  78   5.468   8.241  -6.606
  608   1HB   CYS  78          HB2       CYS  78   5.928   5.710  -5.558
  609   2HB   CYS  78          HB1       CYS  78   7.515   6.157  -6.161
  610    H    SER  79           HN       SER  79   6.120   9.416  -8.465
  611    HA   SER  79           HA       SER  79   7.800   8.163 -10.447
  612   1HB   SER  79          HB2       SER  79   6.412   9.912 -11.277
  613   2HB   SER  79          HB1       SER  79   6.897  11.017  -9.992
  614    HG   SER  79           HG       SER  79   8.046  10.539 -12.401
  615    H    GLY  80           HN       GLY  80   9.989   9.588 -11.100
  616   1HA   GLY  80          HA2       GLY  80  11.686   9.329  -8.714
  617   2HA   GLY  80          HA1       GLY  80  12.228   9.779 -10.339
  618    H    LEU  81           HN       LEU  81   9.944  11.114  -7.897
  619    HA   LEU  81           HA       LEU  81  10.612  13.835  -8.770
  620   1HB   LEU  81          HB2       LEU  81   8.315  12.743  -7.832
  621   2HB   LEU  81          HB1       LEU  81   8.968  13.328  -6.306
  622    HG   LEU  81           HG       LEU  81   8.591  15.022  -8.798
  623   1HD1  LEU  81          HD11      LEU  81   6.452  14.314  -7.764
  624   2HD1  LEU  81          HD12      LEU  81   6.732  16.043  -7.559
  625   3HD1  LEU  81          HD13      LEU  81   7.008  14.940  -6.212
  626   1HD2  LEU  81          HD21      LEU  81  10.414  15.836  -7.393
  627   2HD2  LEU  81          HD22      LEU  81   9.407  15.695  -5.952
  628   3HD2  LEU  81          HD23      LEU  81   9.018  16.891  -7.187
  629    H    VAL  82           HN       VAL  82  12.675  12.273  -7.800
  630    HA   VAL  82           HA       VAL  82  13.613  12.332  -5.243
  631    HB   VAL  82           HB       VAL  82  15.879  12.914  -6.267
  632   1HG1  VAL  82          HG11      VAL  82  15.996  10.904  -7.556
  633   2HG1  VAL  82          HG12      VAL  82  14.287  10.997  -7.980
  634   3HG1  VAL  82          HG13      VAL  82  14.766  10.604  -6.329
  635   1HG2  VAL  82          HG21      VAL  82  15.953  13.313  -8.674
  636   2HG2  VAL  82          HG22      VAL  82  14.951  14.546  -7.911
  637   3HG2  VAL  82          HG23      VAL  82  14.195  13.204  -8.770
  638    HA   PRO  83           HA       PRO  83  13.525  16.380  -3.382
  639   1HB   PRO  83          HB2       PRO  83  16.460  16.271  -2.973
  640   2HB   PRO  83          HB1       PRO  83  15.159  16.427  -1.781
  641   1HG   PRO  83          HG2       PRO  83  16.631  14.068  -2.324
  642   2HG   PRO  83          HG1       PRO  83  15.130  14.162  -1.389
  643   1HD   PRO  83          HD2       PRO  83  15.506  12.961  -3.988
  644   2HD   PRO  83          HD1       PRO  83  14.006  13.063  -3.054
  645    H    ARG  84           HN       ARG  84  13.205  17.950  -4.994
  646    HA   ARG  84           HA       ARG  84  15.594  19.180  -6.187
  647   1HB   ARG  84          HB2       ARG  84  14.818  18.971  -8.500
  648   2HB   ARG  84          HB1       ARG  84  15.029  17.368  -7.797
  649   1HG   ARG  84          HG2       ARG  84  12.573  17.348  -7.263
  650   2HG   ARG  84          HG1       ARG  84  12.415  18.865  -8.149
  651   1HD   ARG  84          HD2       ARG  84  13.370  16.214  -9.265
  652   2HD   ARG  84          HD1       ARG  84  11.859  17.039  -9.650
  653    HE   ARG  84           HE       ARG  84  13.809  18.892 -10.311
  654   1HH1  ARG  84          HH21      ARG  84  13.141  15.591 -11.047
  655   2HH1  ARG  84          HH22      ARG  84  13.852  15.660 -12.624
  656   1HH2  ARG  84          HH11      ARG  84  14.741  19.002 -12.367
  657   2HH2  ARG  84          HH12      ARG  84  14.759  17.591 -13.372
  Start of MODEL    8
    1   1H    SER   1          HT1       SER   1   7.037  15.245  -1.127
    2   2H    SER   1          HT2       SER   1   7.960  16.116   0.004
    3   3H    SER   1          HT3       SER   1   6.968  16.940  -1.103
    4    HA   SER   1           HA       SER   1   6.213  15.418   1.300
    5   1HB   SER   1          HB2       SER   1   6.433  17.850   1.467
    6   2HB   SER   1          HB1       SER   1   5.373  18.066   0.078
    7    HG   SER   1           HG       SER   1   4.586  16.642   2.394
    8    H    ASP   2           HN       ASP   2   5.858  14.354  -1.444
    9    HA   ASP   2           HA       ASP   2   3.164  14.678  -2.343
   10   1HB   ASP   2          HB2       ASP   2   3.653  12.972  -3.859
   11   2HB   ASP   2          HB1       ASP   2   5.255  13.594  -3.485
   12    H    VAL   3           HN       VAL   3   1.356  14.112  -1.245
   13    HA   VAL   3           HA       VAL   3   1.463  12.413   1.093
   14    HB   VAL   3           HB       VAL   3  -0.631  13.193   1.578
   15   1HG1  VAL   3          HG11      VAL   3   0.840  15.122   0.829
   16   2HG1  VAL   3          HG12      VAL   3  -0.897  15.437   0.826
   17   3HG1  VAL   3          HG13      VAL   3  -0.058  15.105  -0.690
   18   1HG2  VAL   3          HG21      VAL   3  -1.275  12.979  -1.381
   19   2HG2  VAL   3          HG22      VAL   3  -2.372  13.707  -0.205
   20   3HG2  VAL   3          HG23      VAL   3  -1.927  12.006  -0.060
   21    H    TYR   4           HN       TYR   4   0.929  11.687  -2.296
   22    HA   TYR   4           HA       TYR   4  -0.738   9.422  -1.700
   23   1HB   TYR   4          HB2       TYR   4   0.576  10.528  -4.165
   24   2HB   TYR   4          HB1       TYR   4   0.058   8.852  -4.223
   25    HD1  TYR   4           HD1      TYR   4  -2.374   8.334  -3.491
   26    HD2  TYR   4           HD2      TYR   4  -0.983  12.252  -4.559
   27    HE1  TYR   4           HE1      TYR   4  -4.701   9.026  -3.952
   28    HE2  TYR   4           HE2      TYR   4  -3.318  12.956  -5.005
   29    HH   TYR   4           HH       TYR   4  -5.768  10.965  -5.537
   30    H    CYS   5           HN       CYS   5   2.713   9.658  -2.584
   31    HA   CYS   5           HA       CYS   5   3.214   6.849  -2.499
   32   1HB   CYS   5          HB2       CYS   5   4.788   8.896  -3.162
   33   2HB   CYS   5          HB1       CYS   5   5.357   8.703  -1.510
   34    H    GLU   6           HN       GLU   6   3.323   9.314   0.125
   35    HA   GLU   6           HA       GLU   6   4.300   7.653   2.177
   36   1HB   GLU   6          HB2       GLU   6   2.126   9.743   2.463
   37   2HB   GLU   6          HB1       GLU   6   3.182   9.148   3.744
   38   1HG   GLU   6          HG2       GLU   6   4.151  10.512   1.225
   39   2HG   GLU   6          HG1       GLU   6   3.952  11.321   2.781
   40    H    VAL   7           HN       VAL   7   0.986   7.994   0.954
   41    HA   VAL   7           HA       VAL   7  -0.144   6.143   2.896
   42    HB   VAL   7           HB       VAL   7  -1.106   7.197   0.215
   43   1HG1  VAL   7          HG11      VAL   7  -2.404   5.279   2.148
   44   2HG1  VAL   7          HG12      VAL   7  -2.244   5.135   0.399
   45   3HG1  VAL   7          HG13      VAL   7  -3.374   6.298   1.087
   46   1HG2  VAL   7          HG21      VAL   7  -2.817   8.297   1.852
   47   2HG2  VAL   7          HG22      VAL   7  -1.194   8.970   1.749
   48   3HG2  VAL   7          HG23      VAL   7  -1.623   7.920   3.094
   49    H    CYS   8           HN       CYS   8   1.057   5.660  -0.465
   50    HA   CYS   8           HA       CYS   8   0.236   2.945  -0.664
   51   1HB   CYS   8          HB2       CYS   8   1.741   2.801  -2.482
   52   2HB   CYS   8          HB1       CYS   8   1.193   4.472  -2.477
   53    H    GLU   9           HN       GLU   9   3.014   4.437   0.963
   54    HA   GLU   9           HA       GLU   9   4.283   1.854   1.444
   55   1HB   GLU   9          HB2       GLU   9   4.743   4.619   2.611
   56   2HB   GLU   9          HB1       GLU   9   5.720   3.208   3.014
   57   1HG   GLU   9          HG2       GLU   9   6.325   2.950   0.638
   58   2HG   GLU   9          HG1       GLU   9   5.361   4.376   0.244
   59    H    PHE  10           HN       PHE  10   1.955   3.985   3.098
   60    HA   PHE  10           HA       PHE  10   2.251   2.683   5.639
   61   1HB   PHE  10          HB2       PHE  10   1.224   4.926   5.401
   62   2HB   PHE  10          HB1       PHE  10  -0.136   4.197   4.542
   63    HD1  PHE  10           HD1      PHE  10  -1.888   3.099   5.712
   64    HD2  PHE  10           HD2      PHE  10   1.705   4.219   7.772
   65    HE1  PHE  10           HE1      PHE  10  -2.947   2.497   7.883
   66    HE2  PHE  10           HE2      PHE  10   0.655   3.632   9.941
   67    HZ   PHE  10           HZ       PHE  10  -1.674   2.777   9.995
   68    H    LEU  11           HN       LEU  11  -0.120   2.251   2.969
   69    HA   LEU  11           HA       LEU  11  -1.562   0.107   4.237
   70   1HB   LEU  11          HB2       LEU  11  -1.125   0.545   1.264
   71   2HB   LEU  11          HB1       LEU  11  -2.348  -0.502   1.990
   72    HG   LEU  11           HG       LEU  11  -2.171   2.469   2.582
   73   1HD1  LEU  11          HD11      LEU  11  -2.534   2.288   0.203
   74   2HD1  LEU  11          HD12      LEU  11  -4.087   2.662   0.951
   75   3HD1  LEU  11          HD13      LEU  11  -3.733   1.014   0.432
   76   1HD2  LEU  11          HD21      LEU  11  -4.665   2.010   3.068
   77   2HD2  LEU  11          HD22      LEU  11  -3.501   1.371   4.226
   78   3HD2  LEU  11          HD23      LEU  11  -4.238   0.300   3.034
   79    H    VAL  12           HN       VAL  12   1.277   0.067   2.017
   80    HA   VAL  12           HA       VAL  12   1.500  -2.750   1.856
   81    HB   VAL  12           HB       VAL  12   3.440  -0.441   1.636
   82   1HG1  VAL  12          HG11      VAL  12   4.081  -3.393   1.489
   83   2HG1  VAL  12          HG12      VAL  12   4.867  -2.169   2.489
   84   3HG1  VAL  12          HG13      VAL  12   5.086  -2.151   0.743
   85   1HG2  VAL  12          HG21      VAL  12   2.611  -2.532  -0.393
   86   2HG2  VAL  12          HG22      VAL  12   3.405  -0.985  -0.700
   87   3HG2  VAL  12          HG23      VAL  12   1.728  -1.022  -0.154
   88    H    LYS  13           HN       LYS  13   3.001  -0.460   4.177
   89    HA   LYS  13           HA       LYS  13   4.445  -2.358   5.704
   90   1HB   LYS  13          HB2       LYS  13   4.876  -0.048   6.101
   91   2HB   LYS  13          HB1       LYS  13   3.177   0.302   6.396
   92   1HG   LYS  13          HG2       LYS  13   3.209  -0.829   8.508
   93   2HG   LYS  13          HG1       LYS  13   4.790  -1.538   8.183
   94   1HD   LYS  13          HD2       LYS  13   4.497   1.463   8.202
   95   2HD   LYS  13          HD1       LYS  13   4.585   0.599   9.734
   96   1HE   LYS  13          HE2       LYS  13   6.642   0.478   7.507
   97   2HE   LYS  13          HE1       LYS  13   6.824   1.310   9.050
   98   1HZ   LYS  13          HZ1       LYS  13   6.247  -1.032   9.990
   99   2HZ   LYS  13          HZ2       LYS  13   7.832  -0.674   9.496
  100   3HZ   LYS  13          HZ3       LYS  13   6.804  -1.568   8.482
  101    H    GLU  14           HN       GLU  14   1.106  -1.226   6.032
  102    HA   GLU  14           HA       GLU  14   0.551  -2.818   8.387
  103   1HB   GLU  14          HB2       GLU  14  -0.839  -0.881   6.737
  104   2HB   GLU  14          HB1       GLU  14  -1.902  -2.258   7.007
  105   1HG   GLU  14          HG2       GLU  14  -0.417  -0.825   9.229
  106   2HG   GLU  14          HG1       GLU  14  -2.076  -0.455   8.760
  107    H    VAL  15           HN       VAL  15   0.113  -3.356   4.889
  108    HA   VAL  15           HA       VAL  15  -1.420  -5.747   5.271
  109    HB   VAL  15           HB       VAL  15   0.144  -4.635   2.934
  110   1HG1  VAL  15          HG11      VAL  15   0.455  -7.030   2.698
  111   2HG1  VAL  15          HG12      VAL  15  -0.835  -6.546   1.592
  112   3HG1  VAL  15          HG13      VAL  15  -1.234  -7.332   3.118
  113   1HG2  VAL  15          HG21      VAL  15  -2.086  -3.699   3.524
  114   2HG2  VAL  15          HG22      VAL  15  -2.788  -5.307   3.334
  115   3HG2  VAL  15          HG23      VAL  15  -2.087  -4.480   1.941
  116    H    THR  16           HN       THR  16   2.132  -5.259   4.873
  117    HA   THR  16           HA       THR  16   2.607  -8.057   4.748
  118    HB   THR  16           HB       THR  16   4.840  -7.702   4.905
  119    HG1  THR  16           HG1      THR  16   5.604  -5.754   6.108
  120   1HG2  THR  16          HG21      THR  16   3.503  -5.884   3.377
  121   2HG2  THR  16          HG22      THR  16   5.258  -6.010   3.424
  122   3HG2  THR  16          HG23      THR  16   4.437  -4.812   4.418
  123    H    LYS  17           HN       LYS  17   2.384  -5.907   7.590
  124    HA   LYS  17           HA       LYS  17   3.234  -7.914   9.435
  125   1HB   LYS  17          HB2       LYS  17   3.067  -5.744  10.375
  126   2HB   LYS  17          HB1       LYS  17   1.436  -5.502   9.747
  127   1HG   LYS  17          HG2       LYS  17   0.467  -6.923  11.359
  128   2HG   LYS  17          HG1       LYS  17   1.991  -7.736  11.700
  129   1HD   LYS  17          HD2       LYS  17   2.839  -5.630  12.727
  130   2HD   LYS  17          HD1       LYS  17   1.250  -4.901  12.468
  131   1HE   LYS  17          HE2       LYS  17   0.185  -6.464  13.931
  132   2HE   LYS  17          HE1       LYS  17   1.611  -7.502  13.983
  133   1HZ   LYS  17          HZ1       LYS  17   1.679  -4.697  14.929
  134   2HZ   LYS  17          HZ2       LYS  17   2.776  -5.952  15.262
  135   3HZ   LYS  17          HZ3       LYS  17   1.222  -5.973  15.948
  136    H    LEU  18           HN       LEU  18   0.240  -7.177   7.816
  137    HA   LEU  18           HA       LEU  18  -1.442  -9.043   9.282
  138   1HB   LEU  18          HB2       LEU  18  -1.704  -7.650   6.607
  139   2HB   LEU  18          HB1       LEU  18  -2.935  -8.691   7.235
  140    HG   LEU  18           HG       LEU  18  -2.574  -5.884   7.732
  141   1HD1  LEU  18          HD11      LEU  18  -4.719  -7.052   7.428
  142   2HD1  LEU  18          HD12      LEU  18  -4.702  -6.078   8.901
  143   3HD1  LEU  18          HD13      LEU  18  -4.513  -7.818   9.001
  144   1HD2  LEU  18          HD21      LEU  18  -2.556  -5.675  10.117
  145   2HD2  LEU  18          HD22      LEU  18  -1.138  -6.611   9.697
  146   3HD2  LEU  18          HD23      LEU  18  -2.563  -7.415  10.352
  147    H    ILE  19           HN       ILE  19   0.499  -9.164   6.345
  148    HA   ILE  19           HA       ILE  19  -0.303 -11.850   5.608
  149    HB   ILE  19           HB       ILE  19   2.135 -10.172   4.876
  150   1HG1  ILE  19          HG12      ILE  19  -0.325 -10.948   3.264
  151   2HG1  ILE  19          HG11      ILE  19  -0.129  -9.403   4.070
  152   1HG2  ILE  19          HG21      ILE  19   1.226 -12.868   3.838
  153   2HG2  ILE  19          HG22      ILE  19   2.753 -12.495   4.640
  154   3HG2  ILE  19          HG23      ILE  19   2.424 -11.853   3.035
  155   1HD1  ILE  19          HD11      ILE  19   1.940  -9.004   2.733
  156   2HD1  ILE  19          HD12      ILE  19   0.505  -9.168   1.727
  157   3HD1  ILE  19          HD13      ILE  19   1.639 -10.511   1.872
  158    H    ASP  20           HN       ASP  20   2.116 -10.350   7.637
  159    HA   ASP  20           HA       ASP  20   3.615 -12.791   8.143
  160   1HB   ASP  20          HB2       ASP  20   4.531 -10.441   8.344
  161   2HB   ASP  20          HB1       ASP  20   3.556 -10.262   9.804
  162    H    ASN  21           HN       ASN  21   0.726 -11.326   9.507
  163    HA   ASN  21           HA       ASN  21   0.983 -13.019  11.912
  164   1HB   ASN  21          HB2       ASN  21   0.042 -10.707  12.161
  165   2HB   ASN  21          HB1       ASN  21  -1.311 -11.172  11.126
  166   1HD2  ASN  21          HD21      ASN  21  -2.514 -10.540  13.264
  167   2HD2  ASN  21          HD22      ASN  21  -2.746 -11.785  14.395
  168    H    ASN  22           HN       ASN  22   0.182 -13.664   8.863
  169    HA   ASN  22           HA       ASN  22  -0.658 -15.669   7.995
  170   1HB   ASN  22          HB2       ASN  22  -1.874 -16.440  10.634
  171   2HB   ASN  22          HB1       ASN  22  -1.201 -17.460   9.369
  172   1HD2  ASN  22          HD21      ASN  22   1.275 -17.043   8.965
  173   2HD2  ASN  22          HD22      ASN  22   2.224 -16.804  10.352
  174    H    LYS  23           HN       LYS  23  -2.307 -13.305   7.772
  175    HA   LYS  23           HA       LYS  23  -5.067 -14.282   8.320
  176   1HB   LYS  23          HB2       LYS  23  -4.370 -11.677   7.070
  177   2HB   LYS  23          HB1       LYS  23  -5.815 -12.097   7.975
  178   1HG   LYS  23          HG2       LYS  23  -3.642 -12.547   9.770
  179   2HG   LYS  23          HG1       LYS  23  -3.280 -11.022   8.978
  180   1HD   LYS  23          HD2       LYS  23  -5.460 -10.116   9.653
  181   2HD   LYS  23          HD1       LYS  23  -5.909 -11.678  10.344
  182   1HE   LYS  23          HE2       LYS  23  -5.139 -10.207  12.126
  183   2HE   LYS  23          HE1       LYS  23  -3.971 -11.510  11.899
  184   1HZ   LYS  23          HZ1       LYS  23  -3.128  -9.603  10.169
  185   2HZ   LYS  23          HZ2       LYS  23  -2.480  -9.886  11.715
  186   3HZ   LYS  23          HZ3       LYS  23  -3.661  -8.685  11.492
  187    H    THR  24           HN       THR  24  -6.593 -14.526   6.570
  188    HA   THR  24           HA       THR  24  -5.418 -15.409   4.035
  189    HB   THR  24           HB       THR  24  -7.469 -16.377   3.599
  190    HG1  THR  24           HG1      THR  24  -9.424 -15.376   4.219
  191   1HG2  THR  24          HG21      THR  24  -6.719 -16.865   6.034
  192   2HG2  THR  24          HG22      THR  24  -8.366 -17.287   5.564
  193   3HG2  THR  24          HG23      THR  24  -8.066 -15.822   6.493
  194    H    GLU  25           HN       GLU  25  -6.664 -14.667   1.983
  195    HA   GLU  25           HA       GLU  25  -6.112 -11.852   1.585
  196   1HB   GLU  25          HB2       GLU  25  -6.128 -13.757  -0.172
  197   2HB   GLU  25          HB1       GLU  25  -7.880 -13.555  -0.195
  198   1HG   GLU  25          HG2       GLU  25  -7.388 -11.045  -0.595
  199   2HG   GLU  25          HG1       GLU  25  -5.750 -11.571  -0.991
  200    H    LYS  26           HN       LYS  26  -9.116 -13.728   1.918
  201    HA   LYS  26           HA       LYS  26 -10.987 -11.653   1.566
  202   1HB   LYS  26          HB2       LYS  26 -11.186 -14.295   2.044
  203   2HB   LYS  26          HB1       LYS  26 -11.561 -13.708   3.659
  204   1HG   LYS  26          HG2       LYS  26 -12.988 -12.964   1.084
  205   2HG   LYS  26          HG1       LYS  26 -13.630 -13.951   2.396
  206   1HD   LYS  26          HD2       LYS  26 -13.162 -11.863   3.890
  207   2HD   LYS  26          HD1       LYS  26 -13.081 -10.986   2.361
  208   1HE   LYS  26          HE2       LYS  26 -15.420 -12.676   3.291
  209   2HE   LYS  26          HE1       LYS  26 -15.361 -10.914   3.305
  210   1HZ   LYS  26          HZ1       LYS  26 -16.441 -12.108   1.317
  211   2HZ   LYS  26          HZ2       LYS  26 -14.845 -12.402   0.814
  212   3HZ   LYS  26          HZ3       LYS  26 -15.396 -10.807   1.014
  213    H    GLU  27           HN       GLU  27  -9.073 -12.411   4.422
  214    HA   GLU  27           HA       GLU  27 -10.595 -10.605   6.143
  215   1HB   GLU  27          HB2       GLU  27  -7.974 -12.059   6.429
  216   2HB   GLU  27          HB1       GLU  27  -8.513 -10.890   7.628
  217   1HG   GLU  27          HG2       GLU  27  -9.149 -13.306   8.113
  218   2HG   GLU  27          HG1       GLU  27 -10.481 -12.153   8.126
  219    H    ILE  28           HN       ILE  28  -7.617 -10.310   4.194
  220    HA   ILE  28           HA       ILE  28  -6.832  -7.777   5.287
  221    HB   ILE  28           HB       ILE  28  -6.345  -8.690   2.439
  222   1HG1  ILE  28          HG12      ILE  28  -5.590 -10.018   4.936
  223   2HG1  ILE  28          HG11      ILE  28  -5.458 -10.597   3.303
  224   1HG2  ILE  28          HG21      ILE  28  -4.254  -7.473   2.658
  225   2HG2  ILE  28          HG22      ILE  28  -4.614  -7.100   4.344
  226   3HG2  ILE  28          HG23      ILE  28  -5.608  -6.423   3.058
  227   1HD1  ILE  28          HD11      ILE  28  -3.271 -10.544   4.367
  228   2HD1  ILE  28          HD12      ILE  28  -3.455  -8.823   4.703
  229   3HD1  ILE  28          HD13      ILE  28  -3.327  -9.385   3.036
  230    H    LEU  29           HN       LEU  29  -8.952  -8.673   2.580
  231    HA   LEU  29           HA       LEU  29  -9.429  -5.930   1.795
  232   1HB   LEU  29          HB2       LEU  29 -11.125  -8.388   1.272
  233   2HB   LEU  29          HB1       LEU  29 -11.153  -6.876   0.361
  234    HG   LEU  29           HG       LEU  29  -8.727  -8.687   0.624
  235   1HD1  LEU  29          HD11      LEU  29 -10.819  -8.380  -1.544
  236   2HD1  LEU  29          HD12      LEU  29 -10.328  -9.855  -0.713
  237   3HD1  LEU  29          HD13      LEU  29  -9.231  -9.080  -1.856
  238   1HD2  LEU  29          HD21      LEU  29  -9.293  -6.087  -0.815
  239   2HD2  LEU  29          HD22      LEU  29  -8.080  -7.202  -1.442
  240   3HD2  LEU  29          HD23      LEU  29  -7.898  -6.523   0.172
  241    H    ASP  30           HN       ASP  30 -10.848  -8.137   4.098
  242    HA   ASP  30           HA       ASP  30 -13.282  -6.630   4.579
  243   1HB   ASP  30          HB2       ASP  30 -12.950  -9.014   5.292
  244   2HB   ASP  30          HB1       ASP  30 -11.788  -8.453   6.495
  245    H    ALA  31           HN       ALA  31 -10.079  -6.682   6.142
  246    HA   ALA  31           HA       ALA  31 -10.721  -4.694   8.121
  247   1HB   ALA  31          HB1       ALA  31  -8.381  -4.687   8.616
  248   2HB   ALA  31          HB2       ALA  31  -7.976  -5.323   7.018
  249   3HB   ALA  31          HB3       ALA  31  -8.805  -6.344   8.192
  250    H    PHE  32           HN       PHE  32  -9.736  -4.433   4.750
  251    HA   PHE  32           HA       PHE  32  -8.609  -1.858   4.661
  252   1HB   PHE  32          HB2       PHE  32 -10.360  -3.453   2.820
  253   2HB   PHE  32          HB1       PHE  32  -9.990  -1.793   2.405
  254    HD1  PHE  32           HD1      PHE  32  -7.342  -3.563   4.288
  255    HD2  PHE  32           HD2      PHE  32  -8.930  -2.772   0.358
  256    HE1  PHE  32           HE1      PHE  32  -5.191  -4.191   3.283
  257    HE2  PHE  32           HE2      PHE  32  -6.761  -3.434  -0.633
  258    HZ   PHE  32           HZ       PHE  32  -4.896  -4.148   0.830
  259    H    ASP  33           HN       ASP  33 -11.715  -2.744   5.762
  260    HA   ASP  33           HA       ASP  33 -12.937  -0.144   5.117
  261   1HB   ASP  33          HB2       ASP  33 -13.865  -2.605   6.601
  262   2HB   ASP  33          HB1       ASP  33 -14.802  -1.110   6.624
  263    H    LYS  34           HN       LYS  34 -11.212  -1.629   7.803
  264    HA   LYS  34           HA       LYS  34 -11.797   0.788   9.487
  265   1HB   LYS  34          HB2       LYS  34 -10.744  -1.924  10.341
  266   2HB   LYS  34          HB1       LYS  34 -11.133  -0.575  11.405
  267   1HG   LYS  34          HG2       LYS  34 -13.506  -0.713  10.340
  268   2HG   LYS  34          HG1       LYS  34 -13.000  -2.318   9.811
  269   1HD   LYS  34          HD2       LYS  34 -12.964  -1.339  12.679
  270   2HD   LYS  34          HD1       LYS  34 -14.179  -2.415  11.986
  271   1HE   LYS  34          HE2       LYS  34 -12.246  -3.962  11.351
  272   2HE   LYS  34          HE1       LYS  34 -11.231  -2.960  12.388
  273   1HZ   LYS  34          HZ1       LYS  34 -12.392  -3.572  14.268
  274   2HZ   LYS  34          HZ2       LYS  34 -12.381  -5.021  13.379
  275   3HZ   LYS  34          HZ3       LYS  34 -13.773  -4.047  13.405
  276    H    MET  35           HN       MET  35  -9.500  -0.314   7.389
  277    HA   MET  35           HA       MET  35  -7.137   0.235   9.039
  278   1HB   MET  35          HB2       MET  35  -7.624  -1.115   6.618
  279   2HB   MET  35          HB1       MET  35  -6.607   0.235   6.154
  280   1HG   MET  35          HG2       MET  35  -5.090  -0.457   8.091
  281   2HG   MET  35          HG1       MET  35  -6.033  -1.945   8.158
  282   1HE   MET  35          HE1       MET  35  -6.220  -3.680   6.361
  283   2HE   MET  35          HE2       MET  35  -4.759  -3.890   7.318
  284   3HE   MET  35          HE3       MET  35  -4.702  -4.141   5.576
  285    H    CYS  36           HN       CYS  36  -8.874   1.985   6.371
  286    HA   CYS  36           HA       CYS  36  -7.006   4.160   6.496
  287   1HB   CYS  36          HB2       CYS  36  -9.783   3.824   5.385
  288   2HB   CYS  36          HB1       CYS  36  -9.166   5.465   5.588
  289    H    SER  37           HN       SER  37  -8.929   2.924   8.804
  290    HA   SER  37           HA       SER  37  -9.875   5.435   9.996
  291   1HB   SER  37          HB2       SER  37  -9.627   2.780  11.408
  292   2HB   SER  37          HB1       SER  37 -10.751   4.093  11.746
  293    HG   SER  37           HG       SER  37 -11.511   3.679   9.511
  294    H    LYS  38           HN       LYS  38  -6.805   3.859   9.950
  295    HA   LYS  38           HA       LYS  38  -6.065   4.934  12.626
  296   1HB   LYS  38          HB2       LYS  38  -4.053   3.608  10.837
  297   2HB   LYS  38          HB1       LYS  38  -4.201   3.554  12.587
  298   1HG   LYS  38          HG2       LYS  38  -6.002   2.166  10.589
  299   2HG   LYS  38          HG1       LYS  38  -4.822   1.399  11.643
  300   1HD   LYS  38          HD2       LYS  38  -6.143   2.473  13.587
  301   2HD   LYS  38          HD1       LYS  38  -7.419   2.736  12.399
  302   1HE   LYS  38          HE2       LYS  38  -7.962   0.640  13.342
  303   2HE   LYS  38          HE1       LYS  38  -7.142   0.218  11.837
  304   1HZ   LYS  38          HZ1       LYS  38  -5.194  -0.320  12.964
  305   2HZ   LYS  38          HZ2       LYS  38  -6.416  -0.967  13.951
  306   3HZ   LYS  38          HZ3       LYS  38  -5.659   0.491  14.378
  307    H    LEU  39           HN       LEU  39  -6.294   6.300   9.632
  308    HA   LEU  39           HA       LEU  39  -3.824   7.975   9.939
  309   1HB   LEU  39          HB2       LEU  39  -5.721   7.751   7.593
  310   2HB   LEU  39          HB1       LEU  39  -4.209   8.653   7.617
  311    HG   LEU  39           HG       LEU  39  -4.426   5.660   8.051
  312   1HD1  LEU  39          HD11      LEU  39  -3.739   5.351   5.810
  313   2HD1  LEU  39          HD12      LEU  39  -3.289   7.041   5.629
  314   3HD1  LEU  39          HD13      LEU  39  -4.987   6.590   5.718
  315   1HD2  LEU  39          HD21      LEU  39  -2.121   7.608   7.900
  316   2HD2  LEU  39          HD22      LEU  39  -1.885   5.916   7.485
  317   3HD2  LEU  39          HD23      LEU  39  -2.417   6.358   9.102
  318    HA   PRO  40           HA       PRO  40  -6.261  11.292  11.670
  319   1HB   PRO  40          HB2       PRO  40  -4.951  13.216   9.833
  320   2HB   PRO  40          HB1       PRO  40  -4.897  13.151  11.599
  321   1HG   PRO  40          HG2       PRO  40  -2.826  12.345   9.815
  322   2HG   PRO  40          HG1       PRO  40  -2.877  12.070  11.562
  323   1HD   PRO  40          HD2       PRO  40  -3.121  10.108   9.474
  324   2HD   PRO  40          HD1       PRO  40  -3.210   9.833  11.222
  325    H    LYS  41           HN       LYS  41  -8.038  12.801  10.927
  326    HA   LYS  41           HA       LYS  41  -9.524  11.645   8.747
  327   1HB   LYS  41          HB2       LYS  41 -10.407  12.973  10.808
  328   2HB   LYS  41          HB1       LYS  41 -10.085  14.402   9.824
  329   1HG   LYS  41          HG2       LYS  41 -11.457  13.348   7.985
  330   2HG   LYS  41          HG1       LYS  41 -11.908  12.082   9.122
  331   1HD   LYS  41          HD2       LYS  41 -12.424  15.052   9.486
  332   2HD   LYS  41          HD1       LYS  41 -13.632  13.848   9.041
  333   1HE   LYS  41          HE2       LYS  41 -12.201  14.192  11.670
  334   2HE   LYS  41          HE1       LYS  41 -13.931  14.064  11.363
  335   1HZ   LYS  41          HZ1       LYS  41 -13.540  11.962  12.054
  336   2HZ   LYS  41          HZ2       LYS  41 -11.916  11.965  11.557
  337   3HZ   LYS  41          HZ3       LYS  41 -13.155  11.735  10.418
  338    H    SER  42           HN       SER  42  -7.170  14.174   8.746
  339    HA   SER  42           HA       SER  42  -8.183  15.444   6.366
  340   1HB   SER  42          HB2       SER  42  -6.030  16.666   6.376
  341   2HB   SER  42          HB1       SER  42  -6.803  16.677   7.959
  342    HG   SER  42           HG       SER  42  -4.431  15.595   7.169
  343    H    LEU  43           HN       LEU  43  -6.654  12.573   6.741
  344    HA   LEU  43           HA       LEU  43  -5.435  12.587   4.021
  345   1HB   LEU  43          HB2       LEU  43  -4.584  11.712   6.653
  346   2HB   LEU  43          HB1       LEU  43  -4.680  10.298   5.619
  347    HG   LEU  43           HG       LEU  43  -3.205  11.269   4.057
  348   1HD1  LEU  43          HD11      LEU  43  -3.787  13.794   5.474
  349   2HD1  LEU  43          HD12      LEU  43  -3.336  13.536   3.792
  350   3HD1  LEU  43          HD13      LEU  43  -2.091  13.594   5.031
  351   1HD2  LEU  43          HD21      LEU  43  -2.301  11.379   6.910
  352   2HD2  LEU  43          HD22      LEU  43  -1.170  11.735   5.609
  353   3HD2  LEU  43          HD23      LEU  43  -1.953  10.162   5.687
  354    H    SER  44           HN       SER  44  -8.049  11.659   5.800
  355    HA   SER  44           HA       SER  44  -8.792   9.083   5.349
  356   1HB   SER  44          HB2       SER  44 -10.333  10.639   6.359
  357   2HB   SER  44          HB1       SER  44 -10.472  11.552   4.860
  358    HG   SER  44           HG       SER  44 -11.682   9.212   5.641
  359    H    GLU  45           HN       GLU  45  -9.657  11.596   3.017
  360    HA   GLU  45           HA       GLU  45 -10.704  10.097   1.014
  361   1HB   GLU  45          HB2       GLU  45  -9.193  12.697   0.821
  362   2HB   GLU  45          HB1       GLU  45 -10.336  12.085  -0.380
  363   1HG   GLU  45          HG2       GLU  45 -12.136  12.086   1.295
  364   2HG   GLU  45          HG1       GLU  45 -11.008  12.653   2.525
  365    H    GLU  46           HN       GLU  46  -7.398  11.414   0.762
  366    HA   GLU  46           HA       GLU  46  -6.834  10.308  -1.777
  367   1HB   GLU  46          HB2       GLU  46  -4.996  10.844   0.567
  368   2HB   GLU  46          HB1       GLU  46  -4.443  10.483  -1.066
  369   1HG   GLU  46          HG2       GLU  46  -4.448  12.864  -0.919
  370   2HG   GLU  46          HG1       GLU  46  -5.896  12.452  -1.833
  371    H    CYS  47           HN       CYS  47  -7.102   8.769   1.302
  372    HA   CYS  47           HA       CYS  47  -5.606   6.395   0.462
  373   1HB   CYS  47          HB2       CYS  47  -5.859   5.707   2.653
  374   2HB   CYS  47          HB1       CYS  47  -6.267   7.405   2.911
  375    H    GLN  48           HN       GLN  48  -9.014   7.318   0.831
  376    HA   GLN  48           HA       GLN  48 -10.201   4.861   0.155
  377   1HB   GLN  48          HB2       GLN  48 -11.042   7.698  -0.504
  378   2HB   GLN  48          HB1       GLN  48 -12.054   6.297  -0.860
  379   1HG   GLN  48          HG2       GLN  48 -12.058   5.668   1.506
  380   2HG   GLN  48          HG1       GLN  48 -10.991   7.020   1.884
  381   1HE2  GLN  48          HE21      GLN  48 -13.634   6.748   3.037
  382   2HE2  GLN  48          HE22      GLN  48 -14.582   8.035   2.466
  383    H    GLU  49           HN       GLU  49  -8.914   7.386  -2.002
  384    HA   GLU  49           HA       GLU  49  -9.711   6.075  -4.419
  385   1HB   GLU  49          HB2       GLU  49  -9.174   8.443  -4.414
  386   2HB   GLU  49          HB1       GLU  49  -7.528   8.106  -3.879
  387   1HG   GLU  49          HG2       GLU  49  -6.976   7.033  -5.948
  388   2HG   GLU  49          HG1       GLU  49  -8.666   6.996  -6.453
  389    H    VAL  50           HN       VAL  50  -6.685   5.977  -2.523
  390    HA   VAL  50           HA       VAL  50  -5.285   4.352  -4.432
  391    HB   VAL  50           HB       VAL  50  -4.778   4.491  -1.454
  392   1HG1  VAL  50          HG11      VAL  50  -3.660   2.621  -2.534
  393   2HG1  VAL  50          HG12      VAL  50  -2.476   3.863  -2.130
  394   3HG1  VAL  50          HG13      VAL  50  -3.036   3.688  -3.792
  395   1HG2  VAL  50          HG21      VAL  50  -4.768   6.698  -2.956
  396   2HG2  VAL  50          HG22      VAL  50  -3.221   6.065  -3.496
  397   3HG2  VAL  50          HG23      VAL  50  -3.484   6.412  -1.787
  398    H    VAL  51           HN       VAL  51  -6.895   3.549  -1.322
  399    HA   VAL  51           HA       VAL  51  -6.494   0.775  -1.598
  400    HB   VAL  51           HB       VAL  51  -8.761   2.178  -0.128
  401   1HG1  VAL  51          HG11      VAL  51  -7.467  -0.529   0.229
  402   2HG1  VAL  51          HG12      VAL  51  -9.136  -0.205  -0.247
  403   3HG1  VAL  51          HG13      VAL  51  -8.589   0.192   1.382
  404   1HG2  VAL  51          HG21      VAL  51  -6.437   3.015   0.421
  405   2HG2  VAL  51          HG22      VAL  51  -6.055   1.381   0.965
  406   3HG2  VAL  51          HG23      VAL  51  -7.306   2.314   1.788
  407    H    ASP  52           HN       ASP  52  -9.403   2.640  -2.383
  408    HA   ASP  52           HA       ASP  52 -10.905   0.460  -3.381
  409   1HB   ASP  52          HB2       ASP  52 -11.085   3.371  -4.186
  410   2HB   ASP  52          HB1       ASP  52 -12.340   2.150  -4.397
  411    H    THR  53           HN       THR  53  -8.768   2.721  -5.131
  412    HA   THR  53           HA       THR  53  -9.348   1.389  -7.693
  413    HB   THR  53           HB       THR  53  -7.305   3.531  -7.093
  414    HG1  THR  53           HG1      THR  53  -9.941   3.869  -8.055
  415   1HG2  THR  53          HG21      THR  53  -8.748   2.755  -9.640
  416   2HG2  THR  53          HG22      THR  53  -7.083   2.323  -9.254
  417   3HG2  THR  53          HG23      THR  53  -7.525   4.015  -9.479
  418    H    TYR  54           HN       TYR  54  -6.594   1.613  -5.433
  419    HA   TYR  54           HA       TYR  54  -5.209  -0.440  -7.128
  420   1HB   TYR  54          HB2       TYR  54  -4.125   1.563  -5.161
  421   2HB   TYR  54          HB1       TYR  54  -3.154   0.317  -5.939
  422    HD1  TYR  54           HD1      TYR  54  -2.644   0.427  -8.334
  423    HD2  TYR  54           HD2      TYR  54  -5.076   3.402  -6.445
  424    HE1  TYR  54           HE1      TYR  54  -2.405   1.891 -10.323
  425    HE2  TYR  54           HE2      TYR  54  -4.846   4.871  -8.411
  426    HH   TYR  54           HH       TYR  54  -2.545   4.494 -10.716
  427    H    GLY  55           HN       GLY  55  -7.262  -1.091  -5.117
  428   1HA   GLY  55          HA2       GLY  55  -5.836  -2.153  -2.810
  429   2HA   GLY  55          HA1       GLY  55  -7.545  -2.375  -3.158
  430    H    SER  56           HN       SER  56  -7.638  -3.756  -5.506
  431    HA   SER  56           HA       SER  56  -6.775  -6.348  -4.660
  432   1HB   SER  56          HB2       SER  56  -7.440  -5.761  -7.535
  433   2HB   SER  56          HB1       SER  56  -7.795  -7.201  -6.578
  434    HG   SER  56           HG       SER  56  -9.604  -6.294  -6.037
  435    H    SER  57           HN       SER  57  -5.356  -3.905  -6.693
  436    HA   SER  57           HA       SER  57  -3.492  -5.743  -7.918
  437   1HB   SER  57          HB2       SER  57  -2.414  -3.725  -8.873
  438   2HB   SER  57          HB1       SER  57  -4.162  -3.663  -9.082
  439    HG   SER  57           HG       SER  57  -3.457  -2.625  -6.702
  440    H    ILE  58           HN       ILE  58  -3.126  -3.328  -5.307
  441    HA   ILE  58           HA       ILE  58  -0.344  -3.776  -4.811
  442    HB   ILE  58           HB       ILE  58  -2.633  -3.067  -2.950
  443   1HG1  ILE  58          HG12      ILE  58  -0.349  -1.378  -4.019
  444   2HG1  ILE  58          HG11      ILE  58  -1.949  -1.424  -4.751
  445   1HG2  ILE  58          HG21      ILE  58  -1.001  -4.041  -1.514
  446   2HG2  ILE  58          HG22      ILE  58  -0.667  -2.313  -1.433
  447   3HG2  ILE  58          HG23      ILE  58   0.335  -3.358  -2.437
  448   1HD1  ILE  58          HD11      ILE  58  -1.156  -0.395  -2.030
  449   2HD1  ILE  58          HD12      ILE  58  -2.829  -0.826  -2.379
  450   3HD1  ILE  58          HD13      ILE  58  -2.043   0.453  -3.299
  451    H    LEU  59           HN       LEU  59  -3.187  -5.144  -3.302
  452    HA   LEU  59           HA       LEU  59  -1.911  -7.103  -1.712
  453   1HB   LEU  59          HB2       LEU  59  -4.215  -6.442  -1.332
  454   2HB   LEU  59          HB1       LEU  59  -4.687  -7.000  -2.934
  455    HG   LEU  59           HG       LEU  59  -4.231  -9.304  -2.331
  456   1HD1  LEU  59          HD11      LEU  59  -2.360  -9.236  -0.881
  457   2HD1  LEU  59          HD12      LEU  59  -3.669  -9.705   0.195
  458   3HD1  LEU  59          HD13      LEU  59  -3.103  -8.036   0.174
  459   1HD2  LEU  59          HD21      LEU  59  -5.787  -9.397  -0.183
  460   2HD2  LEU  59          HD22      LEU  59  -6.438  -8.847  -1.722
  461   3HD2  LEU  59          HD23      LEU  59  -5.976  -7.674  -0.490
  462    H    SER  60           HN       SER  60  -2.653  -7.094  -5.171
  463    HA   SER  60           HA       SER  60  -2.402  -9.968  -5.288
  464   1HB   SER  60          HB2       SER  60  -3.776  -8.999  -6.976
  465   2HB   SER  60          HB1       SER  60  -2.536  -7.830  -7.419
  466    HG   SER  60           HG       SER  60  -1.385 -10.114  -7.732
  467    H    ILE  61           HN       ILE  61  -0.369  -7.163  -5.885
  468    HA   ILE  61           HA       ILE  61   1.884  -8.477  -7.100
  469    HB   ILE  61           HB       ILE  61   1.925  -5.971  -5.401
  470   1HG1  ILE  61          HG12      ILE  61   0.375  -6.414  -7.790
  471   2HG1  ILE  61          HG11      ILE  61   0.617  -4.905  -6.922
  472   1HG2  ILE  61          HG21      ILE  61   4.113  -6.872  -6.000
  473   2HG2  ILE  61          HG22      ILE  61   3.826  -5.360  -6.851
  474   3HG2  ILE  61          HG23      ILE  61   3.664  -6.896  -7.704
  475   1HD1  ILE  61          HD11      ILE  61   1.244  -4.706  -9.296
  476   2HD1  ILE  61          HD12      ILE  61   2.456  -5.965  -9.085
  477   3HD1  ILE  61          HD13      ILE  61   2.621  -4.426  -8.233
  478    H    LEU  62           HN       LEU  62   1.280  -7.412  -3.751
  479    HA   LEU  62           HA       LEU  62   3.728  -8.226  -2.659
  480   1HB   LEU  62          HB2       LEU  62   1.111  -7.407  -1.697
  481   2HB   LEU  62          HB1       LEU  62   1.726  -8.689  -0.662
  482    HG   LEU  62           HG       LEU  62   3.473  -6.336  -1.423
  483   1HD1  LEU  62          HD11      LEU  62   1.306  -6.477   0.651
  484   2HD1  LEU  62          HD12      LEU  62   1.705  -5.164  -0.447
  485   3HD1  LEU  62          HD13      LEU  62   2.739  -5.499   0.938
  486   1HD2  LEU  62          HD21      LEU  62   4.565  -8.292  -0.427
  487   2HD2  LEU  62          HD22      LEU  62   3.408  -8.291   0.901
  488   3HD2  LEU  62          HD23      LEU  62   4.556  -6.972   0.737
  489    H    LEU  63           HN       LEU  63   0.918 -10.165  -3.476
  490    HA   LEU  63           HA       LEU  63   1.898 -12.535  -2.056
  491   1HB   LEU  63          HB2       LEU  63  -0.271 -12.245  -4.155
  492   2HB   LEU  63          HB1       LEU  63   0.030 -13.687  -3.186
  493    HG   LEU  63           HG       LEU  63  -0.693 -10.959  -2.080
  494   1HD1  LEU  63          HD11      LEU  63  -2.305 -13.494  -2.463
  495   2HD1  LEU  63          HD12      LEU  63  -2.606 -11.920  -3.196
  496   3HD1  LEU  63          HD13      LEU  63  -2.833 -12.142  -1.462
  497   1HD2  LEU  63          HD21      LEU  63   0.492 -11.953  -0.338
  498   2HD2  LEU  63          HD22      LEU  63   0.055 -13.591  -0.827
  499   3HD2  LEU  63          HD23      LEU  63  -1.128 -12.567  -0.011
  500    H    GLU  64           HN       GLU  64   2.770 -11.100  -5.004
  501    HA   GLU  64           HA       GLU  64   3.532 -13.681  -6.211
  502   1HB   GLU  64          HB2       GLU  64   3.847 -10.791  -7.064
  503   2HB   GLU  64          HB1       GLU  64   4.651 -12.104  -7.927
  504   1HG   GLU  64          HG2       GLU  64   1.673 -12.054  -7.389
  505   2HG   GLU  64          HG1       GLU  64   2.396 -11.435  -8.872
  506    H    GLU  65           HN       GLU  65   4.617 -12.055  -3.686
  507    HA   GLU  65           HA       GLU  65   6.671 -12.382  -2.463
  508   1HB   GLU  65          HB2       GLU  65   6.699 -14.446  -4.172
  509   2HB   GLU  65          HB1       GLU  65   8.070 -13.555  -4.828
  510   1HG   GLU  65          HG2       GLU  65   8.985 -13.423  -2.476
  511   2HG   GLU  65          HG1       GLU  65   7.698 -14.524  -1.986
  512    H    VAL  66           HN       VAL  66   6.047 -10.042  -4.281
  513    HA   VAL  66           HA       VAL  66   8.741  -9.208  -5.237
  514    HB   VAL  66           HB       VAL  66   5.924  -8.229  -5.546
  515   1HG1  VAL  66          HG11      VAL  66   6.835  -6.154  -4.865
  516   2HG1  VAL  66          HG12      VAL  66   6.948  -6.109  -6.622
  517   3HG1  VAL  66          HG13      VAL  66   8.377  -6.476  -5.655
  518   1HG2  VAL  66          HG21      VAL  66   7.270  -9.694  -7.190
  519   2HG2  VAL  66          HG22      VAL  66   8.181  -8.230  -7.556
  520   3HG2  VAL  66          HG23      VAL  66   6.445  -8.287  -7.862
  521    H    SER  67           HN       SER  67   9.912  -7.528  -4.195
  522    HA   SER  67           HA       SER  67   9.747  -7.276  -1.422
  523   1HB   SER  67          HB2       SER  67  11.465  -6.354  -3.339
  524   2HB   SER  67          HB1       SER  67  10.750  -4.842  -2.793
  525    HG   SER  67           HG       SER  67  12.607  -6.310  -1.614
  526    HA   PRO  68           HA       PRO  68   6.270  -4.667  -0.720
  527   1HB   PRO  68          HB2       PRO  68   7.245  -3.122   1.463
  528   2HB   PRO  68          HB1       PRO  68   6.419  -4.674   1.568
  529   1HG   PRO  68          HG2       PRO  68   9.280  -4.090   1.946
  530   2HG   PRO  68          HG1       PRO  68   8.364  -5.531   2.418
  531   1HD   PRO  68          HD2       PRO  68  10.180  -5.336   0.236
  532   2HD   PRO  68          HD1       PRO  68   9.055  -6.670   0.566
  533    H    GLU  69           HN       GLU  69   9.375  -2.814  -0.627
  534    HA   GLU  69           HA       GLU  69   7.990  -0.334  -1.254
  535   1HB   GLU  69          HB2       GLU  69  10.305   0.593  -1.538
  536   2HB   GLU  69          HB1       GLU  69  10.014  -0.171   0.021
  537   1HG   GLU  69          HG2       GLU  69  11.061  -2.275  -0.905
  538   2HG   GLU  69          HG1       GLU  69  11.511  -1.347  -2.338
  539    H    LEU  70           HN       LEU  70   9.060  -2.942  -3.215
  540    HA   LEU  70           HA       LEU  70   9.578  -1.290  -5.550
  541   1HB   LEU  70          HB2       LEU  70   9.072  -4.261  -5.191
  542   2HB   LEU  70          HB1       LEU  70   9.244  -3.553  -6.781
  543    HG   LEU  70           HG       LEU  70  11.288  -3.370  -4.593
  544   1HD1  LEU  70          HD11      LEU  70  11.554  -4.943  -7.146
  545   2HD1  LEU  70          HD12      LEU  70  10.860  -5.667  -5.696
  546   3HD1  LEU  70          HD13      LEU  70  12.521  -5.073  -5.680
  547   1HD2  LEU  70          HD21      LEU  70  11.115  -2.203  -7.335
  548   2HD2  LEU  70          HD22      LEU  70  12.693  -2.769  -6.798
  549   3HD2  LEU  70          HD23      LEU  70  11.844  -1.533  -5.879
  550    H    VAL  71           HN       VAL  71   6.854  -2.321  -3.839
  551    HA   VAL  71           HA       VAL  71   4.948  -2.428  -5.962
  552    HB   VAL  71           HB       VAL  71   4.720  -1.918  -2.981
  553   1HG1  VAL  71          HG11      VAL  71   2.176  -2.178  -3.345
  554   2HG1  VAL  71          HG12      VAL  71   2.496  -1.732  -5.021
  555   3HG1  VAL  71          HG13      VAL  71   2.875  -0.607  -3.720
  556   1HG2  VAL  71          HG21      VAL  71   3.430  -4.080  -3.122
  557   2HG2  VAL  71          HG22      VAL  71   5.121  -4.209  -3.603
  558   3HG2  VAL  71          HG23      VAL  71   3.855  -4.154  -4.832
  559    H    CYS  72           HN       CYS  72   5.617   0.344  -3.735
  560    HA   CYS  72           HA       CYS  72   3.840   1.996  -5.138
  561   1HB   CYS  72          HB2       CYS  72   5.129   2.320  -2.847
  562   2HB   CYS  72          HB1       CYS  72   6.257   3.235  -3.827
  563    H    SER  73           HN       SER  73   7.165   1.138  -5.773
  564    HA   SER  73           HA       SER  73   7.600   3.251  -7.766
  565   1HB   SER  73          HB2       SER  73   9.395   1.954  -6.412
  566   2HB   SER  73          HB1       SER  73   9.193   0.699  -7.632
  567    HG   SER  73           HG       SER  73  10.018   1.999  -9.126
  568    H    MET  74           HN       MET  74   6.674  -0.206  -7.993
  569    HA   MET  74           HA       MET  74   6.749  -0.233 -10.915
  570   1HB   MET  74          HB2       MET  74   5.916  -2.105  -8.764
  571   2HB   MET  74          HB1       MET  74   5.050  -2.292 -10.286
  572   1HG   MET  74          HG2       MET  74   7.419  -2.303 -11.375
  573   2HG   MET  74          HG1       MET  74   7.995  -2.625  -9.745
  574   1HE   MET  74          HE1       MET  74   6.459  -4.283  -8.230
  575   2HE   MET  74          HE2       MET  74   5.731  -5.758  -8.850
  576   3HE   MET  74          HE3       MET  74   4.892  -4.225  -9.046
  577    H    LEU  75           HN       LEU  75   4.082   0.255  -8.565
  578    HA   LEU  75           HA       LEU  75   2.098   0.414 -10.676
  579   1HB   LEU  75          HB2       LEU  75   1.930   1.555  -7.876
  580   2HB   LEU  75          HB1       LEU  75   0.581   1.194  -8.950
  581    HG   LEU  75           HG       LEU  75   2.477  -0.786  -7.663
  582   1HD1  LEU  75          HD11      LEU  75   0.764  -0.186  -6.136
  583   2HD1  LEU  75          HD12      LEU  75   0.246  -1.714  -6.843
  584   3HD1  LEU  75          HD13      LEU  75  -0.467  -0.202  -7.396
  585   1HD2  LEU  75          HD21      LEU  75   2.148  -1.737  -9.793
  586   2HD2  LEU  75          HD22      LEU  75   0.503  -1.113  -9.918
  587   3HD2  LEU  75          HD23      LEU  75   0.856  -2.461  -8.839
  588    H    HIS  76           HN       HIS  76   4.606   2.264 -10.553
  589    HA   HIS  76           HA       HIS  76   5.118   4.485 -11.091
  590   1HB   HIS  76          HB2       HIS  76   2.405   4.344 -12.448
  591   2HB   HIS  76          HB1       HIS  76   3.708   5.469 -12.831
  592    HD1  HIS  76           HD1      HIS  76   2.662   3.504 -14.984
  593    HD2  HIS  76           HD2      HIS  76   5.911   2.707 -12.494
  594    HE1  HIS  76           HE1      HIS  76   4.061   1.755 -16.168
  595    H    LEU  77           HN       LEU  77   3.415   3.973  -8.576
  596    HA   LEU  77           HA       LEU  77   1.824   6.451  -8.442
  597   1HB   LEU  77          HB2       LEU  77   2.389   4.220  -6.478
  598   2HB   LEU  77          HB1       LEU  77   1.567   5.684  -5.984
  599    HG   LEU  77           HG       LEU  77   0.624   3.644  -8.007
  600   1HD1  LEU  77          HD11      LEU  77  -0.681   4.700  -5.491
  601   2HD1  LEU  77          HD12      LEU  77   0.323   3.257  -5.525
  602   3HD1  LEU  77          HD13      LEU  77  -1.183   3.308  -6.444
  603   1HD2  LEU  77          HD21      LEU  77  -0.291   6.474  -7.516
  604   2HD2  LEU  77          HD22      LEU  77  -1.501   5.251  -7.902
  605   3HD2  LEU  77          HD23      LEU  77  -0.201   5.586  -9.037
  606    H    CYS  78           HN       CYS  78   5.050   5.549  -7.957
  607    HA   CYS  78           HA       CYS  78   5.530   8.109  -6.472
  608   1HB   CYS  78          HB2       CYS  78   5.983   5.601  -5.417
  609   2HB   CYS  78          HB1       CYS  78   7.558   5.954  -6.112
  610    H    SER  79           HN       SER  79   7.578   9.166  -7.075
  611    HA   SER  79           HA       SER  79   8.097   8.925  -9.872
  612   1HB   SER  79          HB2       SER  79   9.695  10.337  -7.713
  613   2HB   SER  79          HB1       SER  79   9.935  10.562  -9.443
  614    HG   SER  79           HG       SER  79   7.651  11.161  -7.875
  615    H    GLY  80           HN       GLY  80   9.867   7.477 -10.875
  616   1HA   GLY  80          HA2       GLY  80  11.372   5.879  -8.875
  617   2HA   GLY  80          HA1       GLY  80  11.181   5.510 -10.587
  618    H    LEU  81           HN       LEU  81  13.659   5.263 -10.130
  619    HA   LEU  81           HA       LEU  81  15.139   7.807 -10.098
  620   1HB   LEU  81          HB2       LEU  81  16.269   5.061 -10.679
  621   2HB   LEU  81          HB1       LEU  81  17.113   6.470 -10.037
  622    HG   LEU  81           HG       LEU  81  14.910   4.945  -8.614
  623   1HD1  LEU  81          HD11      LEU  81  16.965   3.646  -8.693
  624   2HD1  LEU  81          HD12      LEU  81  16.776   4.310  -7.069
  625   3HD1  LEU  81          HD13      LEU  81  17.911   5.050  -8.198
  626   1HD2  LEU  81          HD21      LEU  81  15.811   6.390  -6.666
  627   2HD2  LEU  81          HD22      LEU  81  14.800   7.198  -7.864
  628   3HD2  LEU  81          HD23      LEU  81  16.552   7.389  -7.918
  629    H    VAL  82           HN       VAL  82  14.240   8.719 -12.078
  630    HA   VAL  82           HA       VAL  82  15.218   7.408 -14.595
  631    HB   VAL  82           HB       VAL  82  12.861   7.502 -14.680
  632   1HG1  VAL  82          HG11      VAL  82  11.495   9.337 -14.077
  633   2HG1  VAL  82          HG12      VAL  82  12.848  10.461 -14.073
  634   3HG1  VAL  82          HG13      VAL  82  12.697   9.259 -12.795
  635   1HG2  VAL  82          HG21      VAL  82  14.226   8.447 -16.659
  636   2HG2  VAL  82          HG22      VAL  82  13.640  10.027 -16.138
  637   3HG2  VAL  82          HG23      VAL  82  12.494   8.781 -16.631
  638    HA   PRO  83           HA       PRO  83  17.715  11.256 -14.172
  639   1HB   PRO  83          HB2       PRO  83  19.746  10.131 -15.873
  640   2HB   PRO  83          HB1       PRO  83  19.816  10.337 -14.117
  641   1HG   PRO  83          HG2       PRO  83  19.565   7.858 -15.580
  642   2HG   PRO  83          HG1       PRO  83  19.614   8.075 -13.824
  643   1HD   PRO  83          HD2       PRO  83  17.308   7.457 -15.507
  644   2HD   PRO  83          HD1       PRO  83  17.393   7.510 -13.735
  645    H    ARG  84           HN       ARG  84  15.816   9.985 -16.449
  646    HA   ARG  84           HA       ARG  84  15.123  10.651 -18.594
  647   1HB   ARG  84          HB2       ARG  84  14.881  12.789 -17.253
  648   2HB   ARG  84          HB1       ARG  84  16.467  13.265 -17.861
  649   1HG   ARG  84          HG2       ARG  84  15.627  13.028 -20.186
  650   2HG   ARG  84          HG1       ARG  84  14.032  12.622 -19.550
  651   1HD   ARG  84          HD2       ARG  84  13.898  14.807 -18.435
  652   2HD   ARG  84          HD1       ARG  84  15.512  15.214 -19.017
  653    HE   ARG  84           HE       ARG  84  14.111  14.619 -21.330
  654   1HH1  ARG  84          HH21      ARG  84  13.676  16.683 -18.603
  655   2HH1  ARG  84          HH22      ARG  84  12.800  17.887 -19.485
  656   1HH2  ARG  84          HH11      ARG  84  12.969  16.180 -22.499
  657   2HH2  ARG  84          HH12      ARG  84  12.399  17.603 -21.693
  Start of MODEL    9
    1   1H    SER   1          HT1       SER   1   7.210  17.124  -1.003
    2   2H    SER   1          HT2       SER   1   6.037  17.870  -1.979
    3   3H    SER   1          HT3       SER   1   6.301  16.195  -2.093
    4    HA   SER   1           HA       SER   1   5.708  16.292   0.458
    5   1HB   SER   1          HB2       SER   1   5.410  18.705   0.535
    6   2HB   SER   1          HB1       SER   1   4.295  18.648  -0.827
    7    HG   SER   1           HG       SER   1   3.843  17.170   1.538
    8    H    ASP   2           HN       ASP   2   5.446  14.846  -2.025
    9    HA   ASP   2           HA       ASP   2   2.686  14.634  -2.814
   10   1HB   ASP   2          HB2       ASP   2   4.385  13.893  -4.341
   11   2HB   ASP   2          HB1       ASP   2   5.057  12.786  -3.147
   12    H    VAL   3           HN       VAL   3   1.154  13.999  -1.445
   13    HA   VAL   3           HA       VAL   3   1.611  12.371   0.908
   14    HB   VAL   3           HB       VAL   3  -0.658  12.701   1.373
   15   1HG1  VAL   3          HG11      VAL   3   0.697  14.791   1.280
   16   2HG1  VAL   3          HG12      VAL   3  -1.015  15.071   0.962
   17   3HG1  VAL   3          HG13      VAL   3   0.136  15.046  -0.373
   18   1HG2  VAL   3          HG21      VAL   3  -2.235  13.562  -0.477
   19   2HG2  VAL   3          HG22      VAL   3  -1.785  11.857  -0.547
   20   3HG2  VAL   3          HG23      VAL   3  -1.003  13.020  -1.619
   21    H    TYR   4           HN       TYR   4   1.122  11.487  -2.443
   22    HA   TYR   4           HA       TYR   4  -0.451   9.164  -1.775
   23   1HB   TYR   4          HB2       TYR   4   0.928  10.117  -4.289
   24   2HB   TYR   4          HB1       TYR   4   0.391   8.444  -4.228
   25    HD1  TYR   4           HD1      TYR   4  -0.577  11.729  -5.079
   26    HD2  TYR   4           HD2      TYR   4  -2.092   8.113  -3.333
   27    HE1  TYR   4           HE1      TYR   4  -2.884  12.399  -5.686
   28    HE2  TYR   4           HE2      TYR   4  -4.390   8.768  -3.959
   29    HH   TYR   4           HH       TYR   4  -5.503  11.334  -4.405
   30    H    CYS   5           HN       CYS   5   2.980   9.583  -2.558
   31    HA   CYS   5           HA       CYS   5   3.745   6.849  -2.351
   32   1HB   CYS   5          HB2       CYS   5   5.080   9.287  -2.696
   33   2HB   CYS   5          HB1       CYS   5   5.702   8.714  -1.154
   34    H    GLU   6           HN       GLU   6   3.362   9.320   0.175
   35    HA   GLU   6           HA       GLU   6   4.274   7.764   2.368
   36   1HB   GLU   6          HB2       GLU   6   3.904  10.147   2.602
   37   2HB   GLU   6          HB1       GLU   6   2.186   9.956   2.254
   38   1HG   GLU   6          HG2       GLU   6   1.788   8.818   4.303
   39   2HG   GLU   6          HG1       GLU   6   3.510   8.553   4.579
   40    H    VAL   7           HN       VAL   7   0.949   8.069   1.064
   41    HA   VAL   7           HA       VAL   7  -0.135   6.248   3.057
   42    HB   VAL   7           HB       VAL   7  -1.246   7.180   0.380
   43   1HG1  VAL   7          HG11      VAL   7  -3.448   6.459   1.511
   44   2HG1  VAL   7          HG12      VAL   7  -2.429   5.523   2.604
   45   3HG1  VAL   7          HG13      VAL   7  -2.409   5.184   0.875
   46   1HG2  VAL   7          HG21      VAL   7  -1.137   9.097   1.745
   47   2HG2  VAL   7          HG22      VAL   7  -1.460   8.190   3.221
   48   3HG2  VAL   7          HG23      VAL   7  -2.761   8.497   2.072
   49    H    CYS   8           HN       CYS   8   1.068   5.731  -0.264
   50    HA   CYS   8           HA       CYS   8   0.163   3.048  -0.540
   51   1HB   CYS   8          HB2       CYS   8   1.603   2.955  -2.371
   52   2HB   CYS   8          HB1       CYS   8   1.376   4.691  -2.206
   53    H    GLU   9           HN       GLU   9   3.207   4.338   0.811
   54    HA   GLU   9           HA       GLU   9   4.246   1.767   1.492
   55   1HB   GLU   9          HB2       GLU   9   4.853   4.580   2.406
   56   2HB   GLU   9          HB1       GLU   9   5.655   3.200   3.155
   57   1HG   GLU   9          HG2       GLU   9   5.613   3.637   0.162
   58   2HG   GLU   9          HG1       GLU   9   6.897   4.253   1.201
   59    H    PHE  10           HN       PHE  10   2.017   4.002   3.169
   60    HA   PHE  10           HA       PHE  10   2.280   2.691   5.703
   61   1HB   PHE  10          HB2       PHE  10   1.256   4.921   5.526
   62   2HB   PHE  10          HB1       PHE  10  -0.085   4.231   4.604
   63    HD1  PHE  10           HD1      PHE  10   1.618   4.254   7.894
   64    HD2  PHE  10           HD2      PHE  10  -1.812   2.956   5.665
   65    HE1  PHE  10           HE1      PHE  10   0.521   3.554  10.006
   66    HE2  PHE  10           HE2      PHE  10  -2.919   2.247   7.781
   67    HZ   PHE  10           HZ       PHE  10  -1.750   2.557   9.947
   68    H    LEU  11           HN       LEU  11  -0.092   2.273   3.032
   69    HA   LEU  11           HA       LEU  11  -1.539   0.134   4.303
   70   1HB   LEU  11          HB2       LEU  11  -1.112   0.579   1.330
   71   2HB   LEU  11          HB1       LEU  11  -2.329  -0.477   2.055
   72    HG   LEU  11           HG       LEU  11  -2.180   2.476   2.719
   73   1HD1  LEU  11          HD11      LEU  11  -2.453   2.411   0.326
   74   2HD1  LEU  11          HD12      LEU  11  -4.041   2.728   1.024
   75   3HD1  LEU  11          HD13      LEU  11  -3.640   1.112   0.442
   76   1HD2  LEU  11          HD21      LEU  11  -4.668   2.028   3.115
   77   2HD2  LEU  11          HD22      LEU  11  -3.566   1.258   4.252
   78   3HD2  LEU  11          HD23      LEU  11  -4.295   0.313   2.954
   79    H    VAL  12           HN       VAL  12   1.290   0.093   2.068
   80    HA   VAL  12           HA       VAL  12   1.515  -2.723   1.912
   81    HB   VAL  12           HB       VAL  12   3.478  -0.428   1.711
   82   1HG1  VAL  12          HG11      VAL  12   4.054  -3.389   1.500
   83   2HG1  VAL  12          HG12      VAL  12   4.878  -2.199   2.509
   84   3HG1  VAL  12          HG13      VAL  12   5.078  -2.157   0.760
   85   1HG2  VAL  12          HG21      VAL  12   2.506  -2.449  -0.328
   86   2HG2  VAL  12          HG22      VAL  12   3.441  -0.987  -0.648
   87   3HG2  VAL  12          HG23      VAL  12   1.775  -0.862  -0.085
   88    H    LYS  13           HN       LYS  13   3.044  -0.418   4.217
   89    HA   LYS  13           HA       LYS  13   4.462  -2.342   5.747
   90   1HB   LYS  13          HB2       LYS  13   4.966  -0.040   6.108
   91   2HB   LYS  13          HB1       LYS  13   3.286   0.360   6.446
   92   1HG   LYS  13          HG2       LYS  13   3.337  -0.785   8.554
   93   2HG   LYS  13          HG1       LYS  13   4.897  -1.518   8.197
   94   1HD   LYS  13          HD2       LYS  13   4.394   1.459   8.530
   95   2HD   LYS  13          HD1       LYS  13   5.081   0.409   9.767
   96   1HE   LYS  13          HE2       LYS  13   6.332   1.447   7.251
   97   2HE   LYS  13          HE1       LYS  13   7.045   1.220   8.845
   98   1HZ   LYS  13          HZ1       LYS  13   6.907  -1.209   8.442
   99   2HZ   LYS  13          HZ2       LYS  13   7.957  -0.396   7.383
  100   3HZ   LYS  13          HZ3       LYS  13   6.420  -0.885   6.850
  101    H    GLU  14           HN       GLU  14   1.178  -1.073   6.114
  102    HA   GLU  14           HA       GLU  14   0.569  -2.630   8.473
  103   1HB   GLU  14          HB2       GLU  14  -0.602  -0.491   7.231
  104   2HB   GLU  14          HB1       GLU  14  -1.698  -1.777   6.737
  105   1HG   GLU  14          HG2       GLU  14  -0.877  -1.184   9.601
  106   2HG   GLU  14          HG1       GLU  14  -2.411  -0.725   8.869
  107    H    VAL  15           HN       VAL  15   0.072  -3.136   4.997
  108    HA   VAL  15           HA       VAL  15  -1.540  -5.498   5.359
  109    HB   VAL  15           HB       VAL  15  -0.023  -4.328   3.032
  110   1HG1  VAL  15          HG11      VAL  15  -1.328  -6.256   1.762
  111   2HG1  VAL  15          HG12      VAL  15  -1.188  -7.091   3.306
  112   3HG1  VAL  15          HG13      VAL  15   0.269  -6.575   2.453
  113   1HG2  VAL  15          HG21      VAL  15  -2.277  -4.070   2.123
  114   2HG2  VAL  15          HG22      VAL  15  -2.222  -3.382   3.745
  115   3HG2  VAL  15          HG23      VAL  15  -2.958  -4.964   3.484
  116    H    THR  16           HN       THR  16   1.998  -5.104   4.753
  117    HA   THR  16           HA       THR  16   2.409  -7.911   4.586
  118    HB   THR  16           HB       THR  16   4.676  -7.597   4.749
  119    HG1  THR  16           HG1      THR  16   4.360  -6.542   6.887
  120   1HG2  THR  16          HG21      THR  16   4.517  -4.767   4.110
  121   2HG2  THR  16          HG22      THR  16   3.267  -5.672   3.259
  122   3HG2  THR  16          HG23      THR  16   4.958  -6.111   3.063
  123    H    LYS  17           HN       LYS  17   2.274  -5.773   7.442
  124    HA   LYS  17           HA       LYS  17   3.175  -7.785   9.256
  125   1HB   LYS  17          HB2       LYS  17   3.046  -5.595  10.180
  126   2HB   LYS  17          HB1       LYS  17   1.382  -5.376   9.636
  127   1HG   LYS  17          HG2       LYS  17   0.507  -6.792  11.299
  128   2HG   LYS  17          HG1       LYS  17   2.047  -7.603  11.562
  129   1HD   LYS  17          HD2       LYS  17   2.919  -5.405  12.490
  130   2HD   LYS  17          HD1       LYS  17   1.253  -4.822  12.447
  131   1HE   LYS  17          HE2       LYS  17   0.648  -6.952  13.767
  132   2HE   LYS  17          HE1       LYS  17   2.381  -7.126  14.047
  133   1HZ   LYS  17          HZ1       LYS  17   1.752  -4.481  14.583
  134   2HZ   LYS  17          HZ2       LYS  17   2.183  -5.686  15.699
  135   3HZ   LYS  17          HZ3       LYS  17   0.547  -5.409  15.335
  136    H    LEU  18           HN       LEU  18   0.140  -7.047   7.722
  137    HA   LEU  18           HA       LEU  18  -1.489  -8.912   9.248
  138   1HB   LEU  18          HB2       LEU  18  -1.849  -7.522   6.577
  139   2HB   LEU  18          HB1       LEU  18  -3.051  -8.567   7.247
  140    HG   LEU  18           HG       LEU  18  -2.629  -5.754   7.760
  141   1HD1  LEU  18          HD11      LEU  18  -4.801  -6.887   7.404
  142   2HD1  LEU  18          HD12      LEU  18  -4.784  -5.911   8.876
  143   3HD1  LEU  18          HD13      LEU  18  -4.635  -7.657   8.981
  144   1HD2  LEU  18          HD21      LEU  18  -2.688  -7.347  10.345
  145   2HD2  LEU  18          HD22      LEU  18  -2.642  -5.601  10.156
  146   3HD2  LEU  18          HD23      LEU  18  -1.235  -6.557   9.731
  147    H    ILE  19           HN       ILE  19   0.451  -9.054   6.336
  148    HA   ILE  19           HA       ILE  19  -0.367 -11.742   5.599
  149    HB   ILE  19           HB       ILE  19   2.110 -10.115   4.875
  150   1HG1  ILE  19          HG12      ILE  19  -0.446 -10.702   3.333
  151   2HG1  ILE  19          HG11      ILE  19  -0.067  -9.177   4.106
  152   1HG2  ILE  19          HG21      ILE  19   1.039 -12.684   3.664
  153   2HG2  ILE  19          HG22      ILE  19   2.523 -12.530   4.603
  154   3HG2  ILE  19          HG23      ILE  19   2.391 -11.743   3.036
  155   1HD1  ILE  19          HD11      ILE  19   2.096  -9.217   2.676
  156   2HD1  ILE  19          HD12      ILE  19   0.578  -8.822   1.873
  157   3HD1  ILE  19          HD13      ILE  19   1.259 -10.440   1.721
  158    H    ASP  20           HN       ASP  20   2.071 -10.231   7.607
  159    HA   ASP  20           HA       ASP  20   3.567 -12.669   8.129
  160   1HB   ASP  20          HB2       ASP  20   4.498 -10.334   8.316
  161   2HB   ASP  20          HB1       ASP  20   3.501 -10.116   9.756
  162    H    ASN  21           HN       ASN  21   0.679 -11.207   9.492
  163    HA   ASN  21           HA       ASN  21   0.947 -12.889  11.905
  164   1HB   ASN  21          HB2       ASN  21   0.006 -10.595  12.184
  165   2HB   ASN  21          HB1       ASN  21  -1.323 -11.019  11.103
  166   1HD2  ASN  21          HD21      ASN  21  -0.175 -13.544  13.218
  167   2HD2  ASN  21          HD22      ASN  21  -1.468 -13.489  14.317
  168    H    ASN  22           HN       ASN  22   0.160 -13.557   8.866
  169    HA   ASN  22           HA       ASN  22  -0.679 -15.566   8.006
  170   1HB   ASN  22          HB2       ASN  22  -1.895 -16.325  10.649
  171   2HB   ASN  22          HB1       ASN  22  -1.214 -17.350   9.392
  172   1HD2  ASN  22          HD21      ASN  22  -0.462 -17.041  12.348
  173   2HD2  ASN  22          HD22      ASN  22   1.207 -16.737  12.323
  174    H    LYS  23           HN       LYS  23  -2.326 -13.203   7.774
  175    HA   LYS  23           HA       LYS  23  -5.087 -14.174   8.317
  176   1HB   LYS  23          HB2       LYS  23  -4.357 -11.581   7.065
  177   2HB   LYS  23          HB1       LYS  23  -5.832 -11.989   7.924
  178   1HG   LYS  23          HG2       LYS  23  -3.685 -12.436   9.771
  179   2HG   LYS  23          HG1       LYS  23  -3.351 -10.890   9.006
  180   1HD   LYS  23          HD2       LYS  23  -5.495  -9.998   9.699
  181   2HD   LYS  23          HD1       LYS  23  -6.035 -11.594  10.229
  182   1HE   LYS  23          HE2       LYS  23  -4.181 -11.613  11.908
  183   2HE   LYS  23          HE1       LYS  23  -3.798  -9.956  11.441
  184   1HZ   LYS  23          HZ1       LYS  23  -5.398 -10.416  13.413
  185   2HZ   LYS  23          HZ2       LYS  23  -6.554 -10.637  12.187
  186   3HZ   LYS  23          HZ3       LYS  23  -5.733  -9.156  12.329
  187    H    THR  24           HN       THR  24  -6.606 -14.427   6.560
  188    HA   THR  24           HA       THR  24  -5.420 -15.324   4.027
  189    HB   THR  24           HB       THR  24  -7.503 -16.232   3.537
  190    HG1  THR  24           HG1      THR  24  -9.294 -15.076   4.991
  191   1HG2  THR  24          HG21      THR  24  -8.476 -17.122   5.575
  192   2HG2  THR  24          HG22      THR  24  -7.695 -15.866   6.532
  193   3HG2  THR  24          HG23      THR  24  -6.719 -17.097   5.733
  194    H    GLU  25           HN       GLU  25  -6.533 -14.607   1.952
  195    HA   GLU  25           HA       GLU  25  -6.096 -11.784   1.556
  196   1HB   GLU  25          HB2       GLU  25  -5.987 -13.656  -0.206
  197   2HB   GLU  25          HB1       GLU  25  -7.748 -13.582  -0.243
  198   1HG   GLU  25          HG2       GLU  25  -7.391 -11.019  -0.626
  199   2HG   GLU  25          HG1       GLU  25  -5.749 -11.487  -1.071
  200    H    LYS  26           HN       LYS  26  -9.047 -13.758   1.856
  201    HA   LYS  26           HA       LYS  26 -10.981 -11.741   1.498
  202   1HB   LYS  26          HB2       LYS  26 -10.893 -14.376   2.888
  203   2HB   LYS  26          HB1       LYS  26 -12.221 -13.309   3.335
  204   1HG   LYS  26          HG2       LYS  26 -13.059 -13.237   1.115
  205   2HG   LYS  26          HG1       LYS  26 -11.570 -13.896   0.443
  206   1HD   LYS  26          HD2       LYS  26 -13.320 -15.624   0.508
  207   2HD   LYS  26          HD1       LYS  26 -12.000 -16.041   1.601
  208   1HE   LYS  26          HE2       LYS  26 -13.243 -15.413   3.522
  209   2HE   LYS  26          HE1       LYS  26 -14.433 -14.530   2.565
  210   1HZ   LYS  26          HZ1       LYS  26 -14.950 -16.910   3.436
  211   2HZ   LYS  26          HZ2       LYS  26 -14.054 -17.400   2.078
  212   3HZ   LYS  26          HZ3       LYS  26 -15.447 -16.446   1.882
  213    H    GLU  27           HN       GLU  27  -9.048 -12.446   4.353
  214    HA   GLU  27           HA       GLU  27 -10.605 -10.670   6.070
  215   1HB   GLU  27          HB2       GLU  27  -7.938 -12.043   6.371
  216   2HB   GLU  27          HB1       GLU  27  -8.572 -10.933   7.583
  217   1HG   GLU  27          HG2       GLU  27 -10.148 -13.299   6.559
  218   2HG   GLU  27          HG1       GLU  27  -9.108 -13.387   7.980
  219    H    ILE  28           HN       ILE  28  -7.607 -10.313   4.154
  220    HA   ILE  28           HA       ILE  28  -6.879  -7.764   5.253
  221    HB   ILE  28           HB       ILE  28  -6.365  -8.660   2.408
  222   1HG1  ILE  28          HG12      ILE  28  -5.582  -9.949   4.926
  223   2HG1  ILE  28          HG11      ILE  28  -5.486 -10.562   3.306
  224   1HG2  ILE  28          HG21      ILE  28  -4.670  -7.055   4.333
  225   2HG2  ILE  28          HG22      ILE  28  -5.678  -6.377   3.058
  226   3HG2  ILE  28          HG23      ILE  28  -4.307  -7.396   2.641
  227   1HD1  ILE  28          HD11      ILE  28  -3.270 -10.485   4.294
  228   2HD1  ILE  28          HD12      ILE  28  -3.456  -8.766   4.638
  229   3HD1  ILE  28          HD13      ILE  28  -3.366  -9.324   2.966
  230    H    LEU  29           HN       LEU  29  -8.997  -8.701   2.557
  231    HA   LEU  29           HA       LEU  29  -9.523  -5.967   1.766
  232   1HB   LEU  29          HB2       LEU  29 -11.176  -8.458   1.253
  233   2HB   LEU  29          HB1       LEU  29 -11.230  -6.949   0.337
  234    HG   LEU  29           HG       LEU  29  -8.777  -8.725   0.602
  235   1HD1  LEU  29          HD11      LEU  29  -9.278  -9.093  -1.893
  236   2HD1  LEU  29          HD12      LEU  29 -10.883  -8.442  -1.557
  237   3HD1  LEU  29          HD13      LEU  29 -10.341  -9.913  -0.750
  238   1HD2  LEU  29          HD21      LEU  29  -7.970  -6.554   0.159
  239   2HD2  LEU  29          HD22      LEU  29  -9.371  -6.123  -0.820
  240   3HD2  LEU  29          HD23      LEU  29  -8.152  -7.221  -1.462
  241    H    ASP  30           HN       ASP  30 -10.903  -8.195   4.076
  242    HA   ASP  30           HA       ASP  30 -13.360  -6.723   4.561
  243   1HB   ASP  30          HB2       ASP  30 -12.970  -9.107   5.277
  244   2HB   ASP  30          HB1       ASP  30 -11.837  -8.507   6.490
  245    H    ALA  31           HN       ALA  31 -10.152  -6.718   6.111
  246    HA   ALA  31           HA       ALA  31 -10.822  -4.732   8.082
  247   1HB   ALA  31          HB1       ALA  31  -8.871  -6.357   8.128
  248   2HB   ALA  31          HB2       ALA  31  -8.484  -4.698   8.576
  249   3HB   ALA  31          HB3       ALA  31  -8.068  -5.299   6.970
  250    H    PHE  32           HN       PHE  32  -9.864  -4.465   4.702
  251    HA   PHE  32           HA       PHE  32  -8.804  -1.854   4.601
  252   1HB   PHE  32          HB2       PHE  32 -10.515  -3.499   2.765
  253   2HB   PHE  32          HB1       PHE  32 -10.175  -1.832   2.346
  254    HD1  PHE  32           HD1      PHE  32  -9.099  -2.815   0.304
  255    HD2  PHE  32           HD2      PHE  32  -7.496  -3.538   4.243
  256    HE1  PHE  32           HE1      PHE  32  -6.917  -3.445  -0.681
  257    HE2  PHE  32           HE2      PHE  32  -5.332  -4.133   3.245
  258    HZ   PHE  32           HZ       PHE  32  -5.037  -4.107   0.789
  259    H    ASP  33           HN       ASP  33 -11.911  -2.854   5.645
  260    HA   ASP  33           HA       ASP  33 -13.230  -0.319   4.994
  261   1HB   ASP  33          HB2       ASP  33 -14.675  -2.192   4.993
  262   2HB   ASP  33          HB1       ASP  33 -14.044  -2.795   6.521
  263    H    LYS  34           HN       LYS  34 -11.380  -1.616   7.678
  264    HA   LYS  34           HA       LYS  34 -12.046   0.845   9.275
  265   1HB   LYS  34          HB2       LYS  34 -11.022  -1.775  10.390
  266   2HB   LYS  34          HB1       LYS  34 -11.676  -0.402  11.282
  267   1HG   LYS  34          HG2       LYS  34 -13.844  -0.811   9.921
  268   2HG   LYS  34          HG1       LYS  34 -13.141  -2.384   9.547
  269   1HD   LYS  34          HD2       LYS  34 -13.559  -1.307  12.349
  270   2HD   LYS  34          HD1       LYS  34 -14.617  -2.468  11.548
  271   1HE   LYS  34          HE2       LYS  34 -12.534  -3.920  11.221
  272   2HE   LYS  34          HE1       LYS  34 -11.731  -2.840  12.361
  273   1HZ   LYS  34          HZ1       LYS  34 -14.082  -3.417  13.584
  274   2HZ   LYS  34          HZ2       LYS  34 -12.588  -4.153  13.923
  275   3HZ   LYS  34          HZ3       LYS  34 -13.678  -4.891  12.850
  276    H    MET  35           HN       MET  35  -9.743  -0.224   7.267
  277    HA   MET  35           HA       MET  35  -7.400   0.182   8.991
  278   1HB   MET  35          HB2       MET  35  -7.843  -1.105   6.562
  279   2HB   MET  35          HB1       MET  35  -6.872   0.277   6.089
  280   1HG   MET  35          HG2       MET  35  -5.324  -0.392   8.026
  281   2HG   MET  35          HG1       MET  35  -6.203  -1.918   8.043
  282   1HE   MET  35          HE1       MET  35  -6.191  -3.689   6.187
  283   2HE   MET  35          HE2       MET  35  -4.795  -3.718   7.259
  284   3HE   MET  35          HE3       MET  35  -4.574  -3.988   5.534
  285    H    CYS  36           HN       CYS  36  -9.058   2.112   6.389
  286    HA   CYS  36           HA       CYS  36  -7.106   4.212   6.618
  287   1HB   CYS  36          HB2       CYS  36  -9.037   3.911   4.810
  288   2HB   CYS  36          HB1       CYS  36  -9.968   4.884   5.941
  289    H    SER  37           HN       SER  37  -9.157   2.934   8.809
  290    HA   SER  37           HA       SER  37  -9.967   5.435  10.145
  291   1HB   SER  37          HB2       SER  37 -11.246   3.213  10.205
  292   2HB   SER  37          HB1       SER  37 -10.022   2.663  11.345
  293    HG   SER  37           HG       SER  37 -10.597   4.838  12.384
  294    H    LYS  38           HN       LYS  38  -6.993   4.304   9.785
  295    HA   LYS  38           HA       LYS  38  -6.184   4.833  12.635
  296   1HB   LYS  38          HB2       LYS  38  -5.038   2.963  10.559
  297   2HB   LYS  38          HB1       LYS  38  -4.066   3.524  11.920
  298   1HG   LYS  38          HG2       LYS  38  -5.693   2.624  13.499
  299   2HG   LYS  38          HG1       LYS  38  -6.760   2.154  12.174
  300   1HD   LYS  38          HD2       LYS  38  -4.867   0.717  11.293
  301   2HD   LYS  38          HD1       LYS  38  -4.013   1.045  12.801
  302   1HE   LYS  38          HE2       LYS  38  -5.285  -1.095  12.884
  303   2HE   LYS  38          HE1       LYS  38  -5.841   0.064  14.093
  304   1HZ   LYS  38          HZ1       LYS  38  -7.608  -1.101  12.743
  305   2HZ   LYS  38          HZ2       LYS  38  -7.099  -0.159  11.424
  306   3HZ   LYS  38          HZ3       LYS  38  -7.716   0.590  12.819
  307    H    LEU  39           HN       LEU  39  -6.456   6.504   9.940
  308    HA   LEU  39           HA       LEU  39  -3.788   7.864  10.212
  309   1HB   LEU  39          HB2       LEU  39  -5.595   7.735   7.774
  310   2HB   LEU  39          HB1       LEU  39  -4.052   8.570   7.850
  311    HG   LEU  39           HG       LEU  39  -4.412   5.591   8.254
  312   1HD1  LEU  39          HD11      LEU  39  -3.163   6.991   5.895
  313   2HD1  LEU  39          HD12      LEU  39  -4.865   6.538   5.919
  314   3HD1  LEU  39          HD13      LEU  39  -3.619   5.297   6.030
  315   1HD2  LEU  39          HD21      LEU  39  -2.418   6.207   9.387
  316   2HD2  LEU  39          HD22      LEU  39  -2.020   7.436   8.185
  317   3HD2  LEU  39          HD23      LEU  39  -1.854   5.732   7.788
  318    HA   PRO  40           HA       PRO  40  -6.074  11.376  11.683
  319   1HB   PRO  40          HB2       PRO  40  -4.572  13.189   9.893
  320   2HB   PRO  40          HB1       PRO  40  -4.590  13.137  11.662
  321   1HG   PRO  40          HG2       PRO  40  -2.509  12.180   9.955
  322   2HG   PRO  40          HG1       PRO  40  -2.625  11.958  11.707
  323   1HD   PRO  40          HD2       PRO  40  -2.923   9.950   9.675
  324   2HD   PRO  40          HD1       PRO  40  -3.090   9.736  11.422
  325    H    LYS  41           HN       LYS  41  -7.741  12.962  10.801
  326    HA   LYS  41           HA       LYS  41  -9.122  11.824   8.542
  327   1HB   LYS  41          HB2       LYS  41 -10.026  13.305  10.507
  328   2HB   LYS  41          HB1       LYS  41  -9.577  14.649   9.461
  329   1HG   LYS  41          HG2       LYS  41 -10.928  13.548   7.619
  330   2HG   LYS  41          HG1       LYS  41 -11.495  12.390   8.817
  331   1HD   LYS  41          HD2       LYS  41 -13.209  13.920   9.046
  332   2HD   LYS  41          HD1       LYS  41 -12.072  14.686  10.151
  333   1HE   LYS  41          HE2       LYS  41 -12.560  15.388   7.242
  334   2HE   LYS  41          HE1       LYS  41 -12.901  16.388   8.653
  335   1HZ   LYS  41          HZ1       LYS  41 -10.244  15.571   7.625
  336   2HZ   LYS  41          HZ2       LYS  41 -10.476  16.312   9.135
  337   3HZ   LYS  41          HZ3       LYS  41 -10.880  17.141   7.709
  338    H    SER  42           HN       SER  42  -6.510  14.042   8.624
  339    HA   SER  42           HA       SER  42  -7.256  15.440   6.213
  340   1HB   SER  42          HB2       SER  42  -5.731  16.569   7.677
  341   2HB   SER  42          HB1       SER  42  -4.628  15.197   7.690
  342    HG   SER  42           HG       SER  42  -3.746  16.462   6.190
  343    H    LEU  43           HN       LEU  43  -6.011  12.333   6.580
  344    HA   LEU  43           HA       LEU  43  -5.145  12.322   3.689
  345   1HB   LEU  43          HB2       LEU  43  -4.447  10.205   5.728
  346   2HB   LEU  43          HB1       LEU  43  -3.724  10.470   4.144
  347    HG   LEU  43           HG       LEU  43  -3.485  12.246   6.565
  348   1HD1  LEU  43          HD11      LEU  43  -1.590  10.419   5.113
  349   2HD1  LEU  43          HD12      LEU  43  -2.010  10.426   6.826
  350   3HD1  LEU  43          HD13      LEU  43  -1.011  11.715   6.159
  351   1HD2  LEU  43          HD21      LEU  43  -2.566  12.614   3.710
  352   2HD2  LEU  43          HD22      LEU  43  -1.837  13.492   5.052
  353   3HD2  LEU  43          HD23      LEU  43  -3.541  13.718   4.675
  354    H    SER  44           HN       SER  44  -7.692  11.559   5.681
  355    HA   SER  44           HA       SER  44  -8.594   9.014   5.277
  356   1HB   SER  44          HB2       SER  44 -10.042  10.637   6.322
  357   2HB   SER  44          HB1       SER  44 -10.146  11.583   4.840
  358    HG   SER  44           HG       SER  44 -11.735   9.655   5.601
  359    H    GLU  45           HN       GLU  45  -9.451  11.529   2.959
  360    HA   GLU  45           HA       GLU  45 -10.568  10.033   1.000
  361   1HB   GLU  45          HB2       GLU  45  -8.991  12.587   0.730
  362   2HB   GLU  45          HB1       GLU  45 -10.164  11.981  -0.442
  363   1HG   GLU  45          HG2       GLU  45 -11.948  12.083   1.234
  364   2HG   GLU  45          HG1       GLU  45 -10.793  12.603   2.460
  365    H    GLU  46           HN       GLU  46  -7.223  11.205   0.757
  366    HA   GLU  46           HA       GLU  46  -6.682  10.065  -1.763
  367   1HB   GLU  46          HB2       GLU  46  -4.622  10.240   0.432
  368   2HB   GLU  46          HB1       GLU  46  -4.404  10.494  -1.296
  369   1HG   GLU  46          HG2       GLU  46  -5.850  12.308   0.649
  370   2HG   GLU  46          HG1       GLU  46  -4.386  12.663  -0.258
  371    H    CYS  47           HN       CYS  47  -7.013   8.539   1.344
  372    HA   CYS  47           HA       CYS  47  -5.567   6.131   0.511
  373   1HB   CYS  47          HB2       CYS  47  -5.905   5.403   2.700
  374   2HB   CYS  47          HB1       CYS  47  -6.164   7.128   2.966
  375    H    GLN  48           HN       GLN  48  -8.954   7.138   0.871
  376    HA   GLN  48           HA       GLN  48 -10.189   4.702   0.190
  377   1HB   GLN  48          HB2       GLN  48 -10.991   7.555  -0.428
  378   2HB   GLN  48          HB1       GLN  48 -12.020   6.175  -0.810
  379   1HG   GLN  48          HG2       GLN  48 -10.908   6.684   1.954
  380   2HG   GLN  48          HG1       GLN  48 -12.484   7.274   1.427
  381   1HE2  GLN  48          HE21      GLN  48 -14.202   5.714   1.143
  382   2HE2  GLN  48          HE22      GLN  48 -14.045   4.097   1.636
  383    H    GLU  49           HN       GLU  49  -8.996   7.274  -1.976
  384    HA   GLU  49           HA       GLU  49  -9.764   5.946  -4.378
  385   1HB   GLU  49          HB2       GLU  49  -9.248   8.326  -4.366
  386   2HB   GLU  49          HB1       GLU  49  -7.590   7.995  -3.865
  387   1HG   GLU  49          HG2       GLU  49  -7.076   6.927  -5.946
  388   2HG   GLU  49          HG1       GLU  49  -8.775   6.886  -6.418
  389    H    VAL  50           HN       VAL  50  -6.728   5.901  -2.501
  390    HA   VAL  50           HA       VAL  50  -5.307   4.285  -4.402
  391    HB   VAL  50           HB       VAL  50  -4.828   4.514  -1.424
  392   1HG1  VAL  50          HG11      VAL  50  -2.501   3.843  -2.091
  393   2HG1  VAL  50          HG12      VAL  50  -3.128   3.489  -3.699
  394   3HG1  VAL  50          HG13      VAL  50  -3.710   2.579  -2.306
  395   1HG2  VAL  50          HG21      VAL  50  -3.538   6.415  -1.828
  396   2HG2  VAL  50          HG22      VAL  50  -4.747   6.624  -3.093
  397   3HG2  VAL  50          HG23      VAL  50  -3.174   5.945  -3.487
  398    H    VAL  51           HN       VAL  51  -6.904   3.473  -1.290
  399    HA   VAL  51           HA       VAL  51  -6.485   0.692  -1.569
  400    HB   VAL  51           HB       VAL  51  -8.716   2.125  -0.069
  401   1HG1  VAL  51          HG11      VAL  51  -8.599   0.113   1.412
  402   2HG1  VAL  51          HG12      VAL  51  -7.510  -0.631   0.243
  403   3HG1  VAL  51          HG13      VAL  51  -9.171  -0.248  -0.216
  404   1HG2  VAL  51          HG21      VAL  51  -6.355   2.869   0.456
  405   2HG2  VAL  51          HG22      VAL  51  -6.020   1.216   0.968
  406   3HG2  VAL  51          HG23      VAL  51  -7.221   2.178   1.828
  407    H    ASP  52           HN       ASP  52  -9.390   2.573  -2.352
  408    HA   ASP  52           HA       ASP  52 -10.911   0.399  -3.343
  409   1HB   ASP  52          HB2       ASP  52 -11.081   3.321  -4.109
  410   2HB   ASP  52          HB1       ASP  52 -12.336   2.109  -4.363
  411    H    THR  53           HN       THR  53  -8.806   2.682  -5.112
  412    HA   THR  53           HA       THR  53  -9.389   1.349  -7.671
  413    HB   THR  53           HB       THR  53  -7.328   3.475  -7.080
  414    HG1  THR  53           HG1      THR  53 -10.026   3.567  -7.049
  415   1HG2  THR  53          HG21      THR  53  -7.571   3.971  -9.459
  416   2HG2  THR  53          HG22      THR  53  -8.814   2.730  -9.612
  417   3HG2  THR  53          HG23      THR  53  -7.150   2.271  -9.249
  418    H    TYR  54           HN       TYR  54  -6.628   1.564  -5.421
  419    HA   TYR  54           HA       TYR  54  -5.263  -0.500  -7.119
  420   1HB   TYR  54          HB2       TYR  54  -4.153   1.501  -5.162
  421   2HB   TYR  54          HB1       TYR  54  -3.196   0.254  -5.959
  422    HD1  TYR  54           HD1      TYR  54  -5.097   3.354  -6.421
  423    HD2  TYR  54           HD2      TYR  54  -2.747   0.356  -8.373
  424    HE1  TYR  54           HE1      TYR  54  -4.897   4.825  -8.388
  425    HE2  TYR  54           HE2      TYR  54  -2.538   1.821 -10.365
  426    HH   TYR  54           HH       TYR  54  -3.504   5.141 -10.310
  427    H    GLY  55           HN       GLY  55  -7.306  -1.148  -5.102
  428   1HA   GLY  55          HA2       GLY  55  -5.877  -2.199  -2.794
  429   2HA   GLY  55          HA1       GLY  55  -7.584  -2.434  -3.143
  430    H    SER  56           HN       SER  56  -7.716  -3.844  -5.447
  431    HA   SER  56           HA       SER  56  -6.801  -6.406  -4.604
  432   1HB   SER  56          HB2       SER  56  -7.479  -5.854  -7.484
  433   2HB   SER  56          HB1       SER  56  -7.823  -7.285  -6.511
  434    HG   SER  56           HG       SER  56  -9.711  -6.148  -6.654
  435    H    SER  57           HN       SER  57  -5.441  -3.944  -6.648
  436    HA   SER  57           HA       SER  57  -3.542  -5.738  -7.872
  437   1HB   SER  57          HB2       SER  57  -2.471  -3.645  -8.766
  438   2HB   SER  57          HB1       SER  57  -4.200  -3.727  -9.095
  439    HG   SER  57           HG       SER  57  -2.988  -1.779  -7.951
  440    H    ILE  58           HN       ILE  58  -3.218  -3.319  -5.268
  441    HA   ILE  58           HA       ILE  58  -0.428  -3.719  -4.774
  442    HB   ILE  58           HB       ILE  58  -2.734  -2.995  -2.943
  443   1HG1  ILE  58          HG12      ILE  58  -0.394  -1.355  -3.966
  444   2HG1  ILE  58          HG11      ILE  58  -1.989  -1.352  -4.706
  445   1HG2  ILE  58          HG21      ILE  58  -1.220  -3.949  -1.418
  446   2HG2  ILE  58          HG22      ILE  58  -0.731  -2.259  -1.402
  447   3HG2  ILE  58          HG23      ILE  58   0.191  -3.435  -2.337
  448   1HD1  ILE  58          HD11      ILE  58  -2.855  -0.751  -2.320
  449   2HD1  ILE  58          HD12      ILE  58  -2.057   0.515  -3.249
  450   3HD1  ILE  58          HD13      ILE  58  -1.171  -0.345  -1.983
  451    H    LEU  59           HN       LEU  59  -3.236  -5.109  -3.222
  452    HA   LEU  59           HA       LEU  59  -1.933  -7.053  -1.630
  453   1HB   LEU  59          HB2       LEU  59  -4.241  -6.414  -1.240
  454   2HB   LEU  59          HB1       LEU  59  -4.715  -6.980  -2.837
  455    HG   LEU  59           HG       LEU  59  -4.236  -9.281  -2.229
  456   1HD1  LEU  59          HD11      LEU  59  -3.118  -7.992   0.269
  457   2HD1  LEU  59          HD12      LEU  59  -2.360  -9.183  -0.783
  458   3HD1  LEU  59          HD13      LEU  59  -3.663  -9.668   0.294
  459   1HD2  LEU  59          HD21      LEU  59  -6.447  -8.817  -1.620
  460   2HD2  LEU  59          HD22      LEU  59  -5.981  -7.663  -0.372
  461   3HD2  LEU  59          HD23      LEU  59  -5.791  -9.389  -0.090
  462    H    SER  60           HN       SER  60  -2.661  -7.063  -5.083
  463    HA   SER  60           HA       SER  60  -2.442  -9.937  -5.205
  464   1HB   SER  60          HB2       SER  60  -2.584  -7.772  -7.288
  465   2HB   SER  60          HB1       SER  60  -2.283  -9.441  -7.763
  466    HG   SER  60           HG       SER  60  -4.248 -10.007  -7.060
  467    H    ILE  61           HN       ILE  61  -0.312  -7.183  -5.793
  468    HA   ILE  61           HA       ILE  61   1.893  -8.620  -6.977
  469    HB   ILE  61           HB       ILE  61   2.108  -6.084  -5.344
  470   1HG1  ILE  61          HG12      ILE  61   0.484  -6.524  -7.744
  471   2HG1  ILE  61          HG11      ILE  61   0.647  -5.071  -6.767
  472   1HG2  ILE  61          HG21      ILE  61   4.172  -7.211  -6.113
  473   2HG2  ILE  61          HG22      ILE  61   3.975  -5.616  -6.829
  474   3HG2  ILE  61          HG23      ILE  61   3.624  -7.062  -7.779
  475   1HD1  ILE  61          HD11      ILE  61   2.700  -4.466  -8.011
  476   2HD1  ILE  61          HD12      ILE  61   1.296  -4.605  -9.068
  477   3HD1  ILE  61          HD13      ILE  61   2.493  -5.897  -9.025
  478    H    LEU  62           HN       LEU  62   1.246  -7.524  -3.646
  479    HA   LEU  62           HA       LEU  62   3.581  -8.242  -2.370
  480   1HB   LEU  62          HB2       LEU  62   0.700  -8.424  -1.509
  481   2HB   LEU  62          HB1       LEU  62   1.995  -8.876  -0.403
  482    HG   LEU  62           HG       LEU  62   2.354  -6.259  -1.817
  483   1HD1  LEU  62          HD11      LEU  62   0.086  -5.872  -1.364
  484   2HD1  LEU  62          HD12      LEU  62   0.882  -5.213   0.063
  485   3HD1  LEU  62          HD13      LEU  62   0.126  -6.804   0.125
  486   1HD2  LEU  62          HD21      LEU  62   3.152  -5.606   0.436
  487   2HD2  LEU  62          HD22      LEU  62   3.958  -7.069  -0.132
  488   3HD2  LEU  62          HD23      LEU  62   2.666  -7.180   1.061
  489    H    LEU  63           HN       LEU  63   0.999 -10.425  -3.454
  490    HA   LEU  63           HA       LEU  63   2.149 -12.757  -2.124
  491   1HB   LEU  63          HB2       LEU  63   0.142 -12.753  -4.385
  492   2HB   LEU  63          HB1       LEU  63   0.392 -13.997  -3.161
  493    HG   LEU  63           HG       LEU  63  -0.684 -11.199  -2.713
  494   1HD1  LEU  63          HD11      LEU  63  -2.640 -12.572  -1.809
  495   2HD1  LEU  63          HD12      LEU  63  -1.873 -13.976  -2.550
  496   3HD1  LEU  63          HD13      LEU  63  -2.404 -12.630  -3.556
  497   1HD2  LEU  63          HD21      LEU  63   0.221 -13.347  -0.790
  498   2HD2  LEU  63          HD22      LEU  63  -0.995 -12.157  -0.320
  499   3HD2  LEU  63          HD23      LEU  63   0.621 -11.629  -0.787
  500    H    GLU  64           HN       GLU  64   2.924 -11.098  -5.020
  501    HA   GLU  64           HA       GLU  64   4.007 -13.530  -6.282
  502   1HB   GLU  64          HB2       GLU  64   3.931 -10.614  -7.078
  503   2HB   GLU  64          HB1       GLU  64   4.934 -11.771  -7.952
  504   1HG   GLU  64          HG2       GLU  64   2.879 -13.182  -8.289
  505   2HG   GLU  64          HG1       GLU  64   1.934 -11.866  -7.595
  506    H    GLU  65           HN       GLU  65   4.932 -12.674  -3.683
  507    HA   GLU  65           HA       GLU  65   6.985 -12.485  -2.490
  508   1HB   GLU  65          HB2       GLU  65   7.818 -13.819  -5.058
  509   2HB   GLU  65          HB1       GLU  65   8.855 -13.669  -3.640
  510   1HG   GLU  65          HG2       GLU  65   7.277 -14.921  -2.285
  511   2HG   GLU  65          HG1       GLU  65   6.113 -14.959  -3.610
  512    H    VAL  66           HN       VAL  66   6.284 -10.150  -4.288
  513    HA   VAL  66           HA       VAL  66   8.936  -9.205  -5.235
  514    HB   VAL  66           HB       VAL  66   6.078  -8.353  -5.540
  515   1HG1  VAL  66          HG11      VAL  66   8.450  -6.490  -5.732
  516   2HG1  VAL  66          HG12      VAL  66   6.953  -6.247  -4.832
  517   3HG1  VAL  66          HG13      VAL  66   6.941  -6.188  -6.594
  518   1HG2  VAL  66          HG21      VAL  66   8.314  -8.245  -7.565
  519   2HG2  VAL  66          HG22      VAL  66   6.581  -8.400  -7.852
  520   3HG2  VAL  66          HG23      VAL  66   7.490  -9.756  -7.184
  521    H    SER  67           HN       SER  67  10.012  -7.432  -4.205
  522    HA   SER  67           HA       SER  67   9.783  -7.192  -1.420
  523   1HB   SER  67          HB2       SER  67  11.667  -6.395  -3.047
  524   2HB   SER  67          HB1       SER  67  10.779  -4.876  -3.059
  525    HG   SER  67           HG       SER  67  12.015  -6.224  -0.910
  526    HA   PRO  68           HA       PRO  68   6.134  -4.720  -0.884
  527   1HB   PRO  68          HB2       PRO  68   7.101  -3.258   1.411
  528   2HB   PRO  68          HB1       PRO  68   6.045  -4.668   1.396
  529   1HG   PRO  68          HG2       PRO  68   8.851  -4.540   2.147
  530   2HG   PRO  68          HG1       PRO  68   7.740  -5.912   2.274
  531   1HD   PRO  68          HD2       PRO  68   9.887  -5.613   0.398
  532   2HD   PRO  68          HD1       PRO  68   8.661  -6.899   0.444
  533    H    GLU  69           HN       GLU  69   9.257  -2.942  -0.723
  534    HA   GLU  69           HA       GLU  69   7.911  -0.394  -1.227
  535   1HB   GLU  69          HB2       GLU  69  10.534   0.179  -1.730
  536   2HB   GLU  69          HB1       GLU  69   9.843   0.124  -0.112
  537   1HG   GLU  69          HG2       GLU  69  10.579  -2.172   0.188
  538   2HG   GLU  69          HG1       GLU  69  11.153  -2.245  -1.478
  539    H    LEU  70           HN       LEU  70   8.974  -2.948  -3.244
  540    HA   LEU  70           HA       LEU  70   9.484  -1.267  -5.567
  541   1HB   LEU  70          HB2       LEU  70   9.001  -4.237  -5.217
  542   2HB   LEU  70          HB1       LEU  70   9.138  -3.525  -6.810
  543    HG   LEU  70           HG       LEU  70  11.217  -3.247  -4.666
  544   1HD1  LEU  70          HD11      LEU  70  10.828  -5.613  -5.584
  545   2HD1  LEU  70          HD12      LEU  70  12.470  -4.984  -5.702
  546   3HD1  LEU  70          HD13      LEU  70  11.424  -4.987  -7.119
  547   1HD2  LEU  70          HD21      LEU  70  11.717  -1.484  -6.071
  548   2HD2  LEU  70          HD22      LEU  70  10.990  -2.260  -7.473
  549   3HD2  LEU  70          HD23      LEU  70  12.580  -2.763  -6.917
  550    H    VAL  71           HN       VAL  71   6.766  -2.293  -3.848
  551    HA   VAL  71           HA       VAL  71   4.852  -2.412  -5.964
  552    HB   VAL  71           HB       VAL  71   4.672  -1.969  -2.983
  553   1HG1  VAL  71          HG11      VAL  71   2.421  -1.532  -4.942
  554   2HG1  VAL  71          HG12      VAL  71   2.876  -0.536  -3.559
  555   3HG1  VAL  71          HG13      VAL  71   2.099  -2.091  -3.301
  556   1HG2  VAL  71          HG21      VAL  71   3.605  -4.068  -4.884
  557   2HG2  VAL  71          HG22      VAL  71   3.288  -4.052  -3.148
  558   3HG2  VAL  71          HG23      VAL  71   4.937  -4.248  -3.741
  559    H    CYS  72           HN       CYS  72   5.526   0.375  -3.752
  560    HA   CYS  72           HA       CYS  72   3.736   2.015  -5.180
  561   1HB   CYS  72          HB2       CYS  72   6.202   2.931  -3.639
  562   2HB   CYS  72          HB1       CYS  72   4.786   3.898  -4.009
  563    H    SER  73           HN       SER  73   7.071   1.133  -5.784
  564    HA   SER  73           HA       SER  73   7.539   3.247  -7.773
  565   1HB   SER  73          HB2       SER  73   9.095   0.671  -7.584
  566   2HB   SER  73          HB1       SER  73   9.658   2.247  -8.132
  567    HG   SER  73           HG       SER  73  10.308   2.388  -6.125
  568    H    MET  74           HN       MET  74   6.576  -0.194  -8.019
  569    HA   MET  74           HA       MET  74   6.673  -0.216 -10.945
  570   1HB   MET  74          HB2       MET  74   5.825  -2.079  -8.798
  571   2HB   MET  74          HB1       MET  74   4.937  -2.250 -10.309
  572   1HG   MET  74          HG2       MET  74   7.296  -2.295 -11.425
  573   2HG   MET  74          HG1       MET  74   7.881  -2.635  -9.802
  574   1HE   MET  74          HE1       MET  74   5.589  -5.731  -8.889
  575   2HE   MET  74          HE2       MET  74   4.786  -4.173  -9.048
  576   3HE   MET  74          HE3       MET  74   6.365  -4.267  -8.277
  577    H    LEU  75           HN       LEU  75   4.013   0.331  -8.617
  578    HA   LEU  75           HA       LEU  75   2.032   0.470 -10.728
  579   1HB   LEU  75          HB2       LEU  75   1.859   1.635  -7.936
  580   2HB   LEU  75          HB1       LEU  75   0.509   1.276  -9.009
  581    HG   LEU  75           HG       LEU  75   2.398  -0.712  -7.729
  582   1HD1  LEU  75          HD11      LEU  75   0.190  -1.614  -6.859
  583   2HD1  LEU  75          HD12      LEU  75  -0.541  -0.121  -7.438
  584   3HD1  LEU  75          HD13      LEU  75   0.704  -0.066  -6.191
  585   1HD2  LEU  75          HD21      LEU  75   0.409  -1.022  -9.970
  586   2HD2  LEU  75          HD22      LEU  75   0.729  -2.368  -8.881
  587   3HD2  LEU  75          HD23      LEU  75   2.038  -1.685  -9.840
  588    H    HIS  76           HN       HIS  76   4.520   2.357 -10.674
  589    HA   HIS  76           HA       HIS  76   4.972   4.608 -11.197
  590   1HB   HIS  76          HB2       HIS  76   2.331   4.222 -12.655
  591   2HB   HIS  76          HB1       HIS  76   3.451   5.557 -12.938
  592    HD1  HIS  76           HD1      HIS  76   3.070   3.938 -15.359
  593    HD2  HIS  76           HD2      HIS  76   5.809   2.776 -12.438
  594    HE1  HIS  76           HE1      HIS  76   4.716   2.385 -16.497
  595    H    LEU  77           HN       LEU  77   3.154   3.974  -8.778
  596    HA   LEU  77           HA       LEU  77   1.420   6.322  -8.613
  597   1HB   LEU  77          HB2       LEU  77   1.624   3.829  -7.289
  598   2HB   LEU  77          HB1       LEU  77   1.991   5.018  -6.057
  599    HG   LEU  77           HG       LEU  77  -0.101   6.120  -6.404
  600   1HD1  LEU  77          HD11      LEU  77  -0.896   6.165  -8.540
  601   2HD1  LEU  77          HD12      LEU  77  -1.707   4.663  -8.112
  602   3HD1  LEU  77          HD13      LEU  77  -0.156   4.622  -8.948
  603   1HD2  LEU  77          HD21      LEU  77  -1.554   4.494  -5.522
  604   2HD2  LEU  77          HD22      LEU  77   0.048   3.900  -5.100
  605   3HD2  LEU  77          HD23      LEU  77  -0.821   3.209  -6.465
  606    H    CYS  78           HN       CYS  78   4.759   5.817  -8.171
  607    HA   CYS  78           HA       CYS  78   4.899   8.427  -6.696
  608   1HB   CYS  78          HB2       CYS  78   5.567   6.157  -5.486
  609   2HB   CYS  78          HB1       CYS  78   7.083   6.394  -6.331
  610    H    SER  79           HN       SER  79   5.053   9.271  -8.952
  611    HA   SER  79           HA       SER  79   7.504  10.179  -9.291
  612   1HB   SER  79          HB2       SER  79   7.313   7.559 -10.677
  613   2HB   SER  79          HB1       SER  79   8.071   8.817 -11.649
  614    HG   SER  79           HG       SER  79   8.823   8.533  -8.966
  615    H    GLY  80           HN       GLY  80   4.773  10.877  -9.649
  616   1HA   GLY  80          HA2       GLY  80   4.119  11.321 -12.422
  617   2HA   GLY  80          HA1       GLY  80   3.368  12.139 -11.050
  618    H    LEU  81           HN       LEU  81   3.448  14.181 -12.153
  619    HA   LEU  81           HA       LEU  81   5.906  15.283 -13.187
  620   1HB   LEU  81          HB2       LEU  81   3.570  16.913 -12.175
  621   2HB   LEU  81          HB1       LEU  81   4.687  17.298 -13.485
  622    HG   LEU  81           HG       LEU  81   2.617  15.083 -13.484
  623   1HD1  LEU  81          HD11      LEU  81   1.660  17.306 -13.838
  624   2HD1  LEU  81          HD12      LEU  81   1.660  16.414 -15.359
  625   3HD1  LEU  81          HD13      LEU  81   2.876  17.657 -15.067
  626   1HD2  LEU  81          HD21      LEU  81   4.476  14.253 -14.723
  627   2HD2  LEU  81          HD22      LEU  81   4.813  15.836 -15.425
  628   3HD2  LEU  81          HD23      LEU  81   3.390  14.928 -15.937
  629    H    VAL  82           HN       VAL  82   7.072  14.494 -11.101
  630    HA   VAL  82           HA       VAL  82   7.203  16.800  -9.183
  631    HB   VAL  82           HB       VAL  82   7.829  14.880  -7.486
  632   1HG1  VAL  82          HG11      VAL  82   4.988  15.369  -8.437
  633   2HG1  VAL  82          HG12      VAL  82   5.865  16.332  -7.248
  634   3HG1  VAL  82          HG13      VAL  82   5.428  14.663  -6.882
  635   1HG2  VAL  82          HG21      VAL  82   6.849  12.750  -7.941
  636   2HG2  VAL  82          HG22      VAL  82   7.734  13.173  -9.406
  637   3HG2  VAL  82          HG23      VAL  82   5.983  13.366  -9.349
  638    HA   PRO  83           HA       PRO  83  11.379  15.997 -10.948
  639   1HB   PRO  83          HB2       PRO  83  12.224  18.620 -10.054
  640   2HB   PRO  83          HB1       PRO  83  11.927  18.085 -11.713
  641   1HG   PRO  83          HG2       PRO  83  10.308  19.885 -10.163
  642   2HG   PRO  83          HG1       PRO  83   9.967  19.267 -11.785
  643   1HD   PRO  83          HD2       PRO  83   8.706  18.517  -9.259
  644   2HD   PRO  83          HD1       PRO  83   8.245  18.035 -10.905
  645    H    ARG  84           HN       ARG  84  10.134  16.314  -7.894
  646    HA   ARG  84           HA       ARG  84  11.002  16.002  -5.730
  647   1HB   ARG  84          HB2       ARG  84  11.508  13.812  -6.834
  648   2HB   ARG  84          HB1       ARG  84  13.099  14.437  -7.265
  649   1HG   ARG  84          HG2       ARG  84  13.628  14.792  -4.896
  650   2HG   ARG  84          HG1       ARG  84  12.032  14.210  -4.436
  651   1HD   ARG  84          HD2       ARG  84  14.255  12.647  -5.755
  652   2HD   ARG  84          HD1       ARG  84  13.567  12.366  -4.161
  653    HE   ARG  84           HE       ARG  84  12.622  11.293  -6.656
  654   1HH1  ARG  84          HH21      ARG  84  11.441  12.712  -3.736
  655   2HH1  ARG  84          HH22      ARG  84   9.828  12.127  -3.964
  656   1HH2  ARG  84          HH11      ARG  84  10.539  10.520  -6.945
  657   2HH2  ARG  84          HH12      ARG  84   9.320  10.886  -5.771
  Start of MODEL   10
    1   1H    SER   1          HT1       SER   1   5.821  16.596  -1.734
    2   2H    SER   1          HT2       SER   1   6.929  17.009  -0.514
    3   3H    SER   1          HT3       SER   1   5.905  18.194  -1.174
    4    HA   SER   1           HA       SER   1   5.430  16.414   0.985
    5   1HB   SER   1          HB2       SER   1   3.563  17.966   1.362
    6   2HB   SER   1          HB1       SER   1   5.027  18.862   0.969
    7    HG   SER   1           HG       SER   1   4.270  19.112  -1.122
    8    H    ASP   2           HN       ASP   2   5.294  15.050  -1.543
    9    HA   ASP   2           HA       ASP   2   2.649  14.663  -2.508
   10   1HB   ASP   2          HB2       ASP   2   3.561  12.693  -3.605
   11   2HB   ASP   2          HB1       ASP   2   4.767  13.972  -3.650
   12    H    VAL   3           HN       VAL   3   1.039  14.153  -1.131
   13    HA   VAL   3           HA       VAL   3   1.339  12.479   1.211
   14    HB   VAL   3           HB       VAL   3  -0.820  13.071   1.722
   15   1HG1  VAL   3          HG11      VAL   3  -0.274  15.159  -0.390
   16   2HG1  VAL   3          HG12      VAL   3   0.623  15.081   1.127
   17   3HG1  VAL   3          HG13      VAL   3  -1.119  15.358   1.145
   18   1HG2  VAL   3          HG21      VAL   3  -2.546  13.670  -0.042
   19   2HG2  VAL   3          HG22      VAL   3  -2.056  11.977  -0.028
   20   3HG2  VAL   3          HG23      VAL   3  -1.413  13.072  -1.255
   21    H    TYR   4           HN       TYR   4   0.713  11.704  -2.174
   22    HA   TYR   4           HA       TYR   4  -0.872   9.406  -1.553
   23   1HB   TYR   4          HB2       TYR   4   0.455  10.503  -4.019
   24   2HB   TYR   4          HB1       TYR   4  -0.063   8.829  -4.064
   25    HD1  TYR   4           HD1      TYR   4  -2.500   8.299  -3.433
   26    HD2  TYR   4           HD2      TYR   4  -1.099  12.249  -4.363
   27    HE1  TYR   4           HE1      TYR   4  -4.819   9.000  -3.922
   28    HE2  TYR   4           HE2      TYR   4  -3.427  12.959  -4.837
   29    HH   TYR   4           HH       TYR   4  -5.636  11.615  -5.612
   30    H    CYS   5           HN       CYS   5   2.555   9.720  -2.444
   31    HA   CYS   5           HA       CYS   5   3.227   6.939  -2.324
   32   1HB   CYS   5          HB2       CYS   5   4.804   9.473  -1.754
   33   2HB   CYS   5          HB1       CYS   5   5.533   7.882  -1.531
   34    H    GLU   6           HN       GLU   6   3.142   9.392   0.321
   35    HA   GLU   6           HA       GLU   6   4.100   7.749   2.384
   36   1HB   GLU   6          HB2       GLU   6   1.783   9.678   2.682
   37   2HB   GLU   6          HB1       GLU   6   2.924   9.180   3.930
   38   1HG   GLU   6          HG2       GLU   6   4.757  10.242   2.723
   39   2HG   GLU   6          HG1       GLU   6   3.671  10.672   1.406
   40    H    VAL   7           HN       VAL   7   0.845   7.925   1.004
   41    HA   VAL   7           HA       VAL   7  -0.296   6.002   2.871
   42    HB   VAL   7           HB       VAL   7  -1.168   6.996   0.137
   43   1HG1  VAL   7          HG11      VAL   7  -3.428   6.033   0.923
   44   2HG1  VAL   7          HG12      VAL   7  -2.488   5.098   2.079
   45   3HG1  VAL   7          HG13      VAL   7  -2.223   4.886   0.349
   46   1HG2  VAL   7          HG21      VAL   7  -1.777   7.804   2.970
   47   2HG2  VAL   7          HG22      VAL   7  -2.998   8.044   1.723
   48   3HG2  VAL   7          HG23      VAL   7  -1.424   8.819   1.574
   49    H    CYS   8           HN       CYS   8   0.997   5.551  -0.491
   50    HA   CYS   8           HA       CYS   8   0.281   2.809  -0.639
   51   1HB   CYS   8          HB2       CYS   8   1.066   4.001  -2.576
   52   2HB   CYS   8          HB1       CYS   8   2.626   4.301  -1.835
   53    H    GLU   9           HN       GLU   9   3.238   4.337   0.730
   54    HA   GLU   9           HA       GLU   9   4.394   1.788   1.363
   55   1HB   GLU   9          HB2       GLU   9   4.950   4.650   2.082
   56   2HB   GLU   9          HB1       GLU   9   5.678   3.405   3.096
   57   1HG   GLU   9          HG2       GLU   9   5.915   3.352   0.082
   58   2HG   GLU   9          HG1       GLU   9   7.072   4.209   1.099
   59    H    PHE  10           HN       PHE  10   2.100   3.958   3.035
   60    HA   PHE  10           HA       PHE  10   2.401   2.681   5.582
   61   1HB   PHE  10          HB2       PHE  10   1.352   4.906   5.365
   62   2HB   PHE  10          HB1       PHE  10   0.020   4.185   4.460
   63    HD1  PHE  10           HD1      PHE  10  -1.605   2.717   5.549
   64    HD2  PHE  10           HD2      PHE  10   1.603   4.519   7.758
   65    HE1  PHE  10           HE1      PHE  10  -2.719   2.086   7.676
   66    HE2  PHE  10           HE2      PHE  10   0.497   3.889   9.887
   67    HZ   PHE  10           HZ       PHE  10  -1.662   2.669   9.845
   68    H    LEU  11           HN       LEU  11   0.047   2.247   2.925
   69    HA   LEU  11           HA       LEU  11  -1.412   0.112   4.173
   70   1HB   LEU  11          HB2       LEU  11  -0.951   0.725   1.233
   71   2HB   LEU  11          HB1       LEU  11  -2.078  -0.505   1.827
   72    HG   LEU  11           HG       LEU  11  -2.230   2.369   2.779
   73   1HD1  LEU  11          HD11      LEU  11  -3.570   1.149   0.345
   74   2HD1  LEU  11          HD12      LEU  11  -2.381   2.452   0.341
   75   3HD1  LEU  11          HD13      LEU  11  -3.979   2.718   1.038
   76   1HD2  LEU  11          HD21      LEU  11  -3.571   0.913   4.121
   77   2HD2  LEU  11          HD22      LEU  11  -4.127   0.002   2.719
   78   3HD2  LEU  11          HD23      LEU  11  -4.697   1.647   2.982
   79    H    VAL  12           HN       VAL  12   1.448   0.057   1.983
   80    HA   VAL  12           HA       VAL  12   1.638  -2.769   1.812
   81    HB   VAL  12           HB       VAL  12   3.618  -0.494   1.596
   82   1HG1  VAL  12          HG11      VAL  12   4.184  -3.462   1.447
   83   2HG1  VAL  12          HG12      VAL  12   5.010  -2.256   2.436
   84   3HG1  VAL  12          HG13      VAL  12   5.217  -2.250   0.689
   85   1HG2  VAL  12          HG21      VAL  12   2.704  -2.560  -0.425
   86   2HG2  VAL  12          HG22      VAL  12   3.578  -1.060  -0.746
   87   3HG2  VAL  12          HG23      VAL  12   1.903  -1.004  -0.196
   88    H    LYS  13           HN       LYS  13   3.194  -0.498   4.154
   89    HA   LYS  13           HA       LYS  13   4.568  -2.485   5.656
   90   1HB   LYS  13          HB2       LYS  13   5.148  -0.211   6.065
   91   2HB   LYS  13          HB1       LYS  13   3.479   0.238   6.404
   92   1HG   LYS  13          HG2       LYS  13   3.537  -0.597   8.568
   93   2HG   LYS  13          HG1       LYS  13   4.684  -1.873   8.161
   94   1HD   LYS  13          HD2       LYS  13   5.748  -0.197   9.608
   95   2HD   LYS  13          HD1       LYS  13   6.496  -0.190   8.010
   96   1HE   LYS  13          HE2       LYS  13   5.200   1.757   7.355
   97   2HE   LYS  13          HE1       LYS  13   4.292   1.705   8.866
   98   1HZ   LYS  13          HZ1       LYS  13   6.625   1.860   9.926
   99   2HZ   LYS  13          HZ2       LYS  13   5.902   3.267   9.307
  100   3HZ   LYS  13          HZ3       LYS  13   7.100   2.461   8.413
  101    H    GLU  14           HN       GLU  14   1.321  -1.133   6.056
  102    HA   GLU  14           HA       GLU  14   0.682  -2.704   8.395
  103   1HB   GLU  14          HB2       GLU  14  -0.479  -0.556   7.164
  104   2HB   GLU  14          HB1       GLU  14  -1.565  -1.834   6.629
  105   1HG   GLU  14          HG2       GLU  14  -0.813  -1.230   9.510
  106   2HG   GLU  14          HG1       GLU  14  -2.355  -0.851   8.744
  107    H    VAL  15           HN       VAL  15   0.142  -3.187   4.904
  108    HA   VAL  15           HA       VAL  15  -1.433  -5.557   5.266
  109    HB   VAL  15           HB       VAL  15   0.113  -4.385   2.957
  110   1HG1  VAL  15          HG11      VAL  15   0.510  -6.738   2.631
  111   2HG1  VAL  15          HG12      VAL  15  -0.832  -6.298   1.568
  112   3HG1  VAL  15          HG13      VAL  15  -1.148  -7.137   3.086
  113   1HG2  VAL  15          HG21      VAL  15  -2.149  -4.349   1.949
  114   2HG2  VAL  15          HG22      VAL  15  -2.118  -3.496   3.493
  115   3HG2  VAL  15          HG23      VAL  15  -2.799  -5.121   3.398
  116    H    THR  16           HN       THR  16   2.105  -5.108   4.764
  117    HA   THR  16           HA       THR  16   2.592  -7.896   4.636
  118    HB   THR  16           HB       THR  16   4.844  -7.540   4.885
  119    HG1  THR  16           HG1      THR  16   4.014  -5.500   6.604
  120   1HG2  THR  16          HG21      THR  16   3.439  -5.666   3.306
  121   2HG2  THR  16          HG22      THR  16   5.135  -6.108   3.154
  122   3HG2  THR  16          HG23      THR  16   4.672  -4.738   4.156
  123    H    LYS  17           HN       LYS  17   2.408  -5.730   7.444
  124    HA   LYS  17           HA       LYS  17   3.259  -7.656   9.362
  125   1HB   LYS  17          HB2       LYS  17   2.926  -5.247   9.894
  126   2HB   LYS  17          HB1       LYS  17   1.186  -5.470   9.743
  127   1HG   LYS  17          HG2       LYS  17   1.649  -7.451  11.495
  128   2HG   LYS  17          HG1       LYS  17   3.049  -6.460  11.879
  129   1HD   LYS  17          HD2       LYS  17   1.628  -4.576  12.428
  130   2HD   LYS  17          HD1       LYS  17   0.198  -5.436  11.855
  131   1HE   LYS  17          HE2       LYS  17   0.154  -5.715  14.218
  132   2HE   LYS  17          HE1       LYS  17   0.791  -7.246  13.608
  133   1HZ   LYS  17          HZ1       LYS  17   2.004  -6.053  15.522
  134   2HZ   LYS  17          HZ2       LYS  17   2.623  -5.042  14.306
  135   3HZ   LYS  17          HZ3       LYS  17   2.923  -6.714  14.259
  136    H    LEU  18           HN       LEU  18   0.230  -6.989   7.748
  137    HA   LEU  18           HA       LEU  18  -1.375  -8.883   9.262
  138   1HB   LEU  18          HB2       LEU  18  -1.738  -7.454   6.618
  139   2HB   LEU  18          HB1       LEU  18  -2.942  -8.512   7.269
  140    HG   LEU  18           HG       LEU  18  -2.444  -5.705   7.891
  141   1HD1  LEU  18          HD11      LEU  18  -4.601  -7.570   8.881
  142   2HD1  LEU  18          HD12      LEU  18  -4.629  -6.720   7.338
  143   3HD1  LEU  18          HD13      LEU  18  -4.666  -5.815   8.852
  144   1HD2  LEU  18          HD21      LEU  18  -2.618  -5.685  10.291
  145   2HD2  LEU  18          HD22      LEU  18  -1.215  -6.665   9.902
  146   3HD2  LEU  18          HD23      LEU  18  -2.731  -7.437  10.370
  147    H    ILE  19           HN       ILE  19   0.514  -8.991   6.302
  148    HA   ILE  19           HA       ILE  19  -0.290 -11.683   5.571
  149    HB   ILE  19           HB       ILE  19   2.159 -10.026   4.825
  150   1HG1  ILE  19          HG12      ILE  19  -0.347 -10.749   3.255
  151   2HG1  ILE  19          HG11      ILE  19  -0.075  -9.198   4.027
  152   1HG2  ILE  19          HG21      ILE  19   1.192 -12.702   3.777
  153   2HG2  ILE  19          HG22      ILE  19   2.722 -12.371   4.591
  154   3HG2  ILE  19          HG23      ILE  19   2.420 -11.713   2.987
  155   1HD1  ILE  19          HD11      ILE  19   1.528 -10.410   1.762
  156   2HD1  ILE  19          HD12      ILE  19   2.023  -8.965   2.640
  157   3HD1  ILE  19          HD13      ILE  19   0.530  -8.959   1.704
  158    H    ASP  20           HN       ASP  20   2.122 -10.166   7.592
  159    HA   ASP  20           HA       ASP  20   3.644 -12.589   8.105
  160   1HB   ASP  20          HB2       ASP  20   3.539 -10.004   9.683
  161   2HB   ASP  20          HB1       ASP  20   4.792 -11.242   9.778
  162    H    ASN  21           HN       ASN  21   0.746 -11.148   9.479
  163    HA   ASN  21           HA       ASN  21   1.026 -12.834  11.884
  164   1HB   ASN  21          HB2       ASN  21   0.055 -10.555  12.160
  165   2HB   ASN  21          HB1       ASN  21  -1.271 -11.000  11.085
  166   1HD2  ASN  21          HD21      ASN  21  -0.087 -13.509  13.193
  167   2HD2  ASN  21          HD22      ASN  21  -1.373 -13.469  14.299
  168    H    ASN  22           HN       ASN  22   0.183 -13.468   8.824
  169    HA   ASN  22           HA       ASN  22  -0.622 -15.503   7.979
  170   1HB   ASN  22          HB2       ASN  22  -0.134 -16.252  10.460
  171   2HB   ASN  22          HB1       ASN  22  -1.892 -16.286  10.585
  172   1HD2  ASN  22          HD21      ASN  22   0.127 -18.573  10.486
  173   2HD2  ASN  22          HD22      ASN  22  -0.412 -19.561   9.215
  174    H    LYS  23           HN       LYS  23  -2.263 -13.126   7.761
  175    HA   LYS  23           HA       LYS  23  -5.027 -14.098   8.278
  176   1HB   LYS  23          HB2       LYS  23  -4.295 -11.492   7.054
  177   2HB   LYS  23          HB1       LYS  23  -5.766 -11.909   7.914
  178   1HG   LYS  23          HG2       LYS  23  -3.634 -12.384   9.760
  179   2HG   LYS  23          HG1       LYS  23  -3.266 -10.843   9.002
  180   1HD   LYS  23          HD2       LYS  23  -5.401  -9.915   9.690
  181   2HD   LYS  23          HD1       LYS  23  -5.967 -11.502  10.216
  182   1HE   LYS  23          HE2       LYS  23  -4.106 -11.548  11.893
  183   2HE   LYS  23          HE1       LYS  23  -3.720  -9.888  11.438
  184   1HZ   LYS  23          HZ1       LYS  23  -6.097 -10.929  12.817
  185   2HZ   LYS  23          HZ2       LYS  23  -6.222  -9.506  11.898
  186   3HZ   LYS  23          HZ3       LYS  23  -5.135  -9.587  13.202
  187    H    THR  24           HN       THR  24  -6.528 -14.363   6.524
  188    HA   THR  24           HA       THR  24  -5.343 -15.230   3.987
  189    HB   THR  24           HB       THR  24  -7.415 -16.156   3.510
  190    HG1  THR  24           HG1      THR  24  -9.234 -14.957   4.890
  191   1HG2  THR  24          HG21      THR  24  -8.277 -17.145   5.463
  192   2HG2  THR  24          HG22      THR  24  -7.904 -15.735   6.449
  193   3HG2  THR  24          HG23      THR  24  -6.603 -16.780   5.880
  194    H    GLU  25           HN       GLU  25  -6.533 -14.473   1.922
  195    HA   GLU  25           HA       GLU  25  -6.049 -11.622   1.619
  196   1HB   GLU  25          HB2       GLU  25  -5.975 -13.517  -0.207
  197   2HB   GLU  25          HB1       GLU  25  -7.696 -13.188  -0.367
  198   1HG   GLU  25          HG2       GLU  25  -7.125 -10.752  -0.675
  199   2HG   GLU  25          HG1       GLU  25  -5.425 -11.221  -0.730
  200    H    LYS  26           HN       LYS  26  -9.001 -13.619   1.867
  201    HA   LYS  26           HA       LYS  26 -10.911 -11.573   1.508
  202   1HB   LYS  26          HB2       LYS  26 -11.418 -13.677   3.585
  203   2HB   LYS  26          HB1       LYS  26 -12.512 -13.029   2.372
  204   1HG   LYS  26          HG2       LYS  26 -10.221 -14.957   1.924
  205   2HG   LYS  26          HG1       LYS  26 -11.937 -15.293   1.763
  206   1HD   LYS  26          HD2       LYS  26 -10.360 -13.358   0.029
  207   2HD   LYS  26          HD1       LYS  26 -10.928 -14.952  -0.452
  208   1HE   LYS  26          HE2       LYS  26 -13.287 -14.070   0.219
  209   2HE   LYS  26          HE1       LYS  26 -12.546 -12.474   0.101
  210   1HZ   LYS  26          HZ1       LYS  26 -11.994 -14.275  -2.100
  211   2HZ   LYS  26          HZ2       LYS  26 -12.368 -12.618  -2.115
  212   3HZ   LYS  26          HZ3       LYS  26 -13.607 -13.770  -1.967
  213    H    GLU  27           HN       GLU  27  -8.989 -12.299   4.363
  214    HA   GLU  27           HA       GLU  27 -10.549 -10.528   6.083
  215   1HB   GLU  27          HB2       GLU  27  -7.906 -11.939   6.371
  216   2HB   GLU  27          HB1       GLU  27  -8.447 -10.762   7.563
  217   1HG   GLU  27          HG2       GLU  27 -10.139 -13.115   6.706
  218   2HG   GLU  27          HG1       GLU  27  -9.057 -13.167   8.093
  219    H    ILE  28           HN       ILE  28  -7.552 -10.155   4.162
  220    HA   ILE  28           HA       ILE  28  -6.846  -7.600   5.263
  221    HB   ILE  28           HB       ILE  28  -6.302  -8.495   2.422
  222   1HG1  ILE  28          HG12      ILE  28  -5.522  -9.759   4.964
  223   2HG1  ILE  28          HG11      ILE  28  -5.430 -10.390   3.350
  224   1HG2  ILE  28          HG21      ILE  28  -5.637  -6.195   3.096
  225   2HG2  ILE  28          HG22      ILE  28  -4.261  -7.208   2.672
  226   3HG2  ILE  28          HG23      ILE  28  -4.627  -6.885   4.366
  227   1HD1  ILE  28          HD11      ILE  28  -3.399  -8.577   4.652
  228   2HD1  ILE  28          HD12      ILE  28  -3.312  -9.159   2.988
  229   3HD1  ILE  28          HD13      ILE  28  -3.215 -10.301   4.333
  230    H    LEU  29           HN       LEU  29  -8.920  -8.560   2.540
  231    HA   LEU  29           HA       LEU  29  -9.485  -5.835   1.753
  232   1HB   LEU  29          HB2       LEU  29 -11.132  -8.324   1.228
  233   2HB   LEU  29          HB1       LEU  29 -11.135  -6.828   0.291
  234    HG   LEU  29           HG       LEU  29  -8.742  -8.669   0.635
  235   1HD1  LEU  29          HD11      LEU  29 -10.297  -9.785  -0.788
  236   2HD1  LEU  29          HD12      LEU  29  -9.160  -8.994  -1.878
  237   3HD1  LEU  29          HD13      LEU  29 -10.750  -8.287  -1.597
  238   1HD2  LEU  29          HD21      LEU  29  -9.189  -6.039  -0.788
  239   2HD2  LEU  29          HD22      LEU  29  -7.972  -7.173  -1.374
  240   3HD2  LEU  29          HD23      LEU  29  -7.850  -6.517   0.257
  241    H    ASP  30           HN       ASP  30 -10.818  -8.072   4.075
  242    HA   ASP  30           HA       ASP  30 -13.301  -6.622   4.545
  243   1HB   ASP  30          HB2       ASP  30 -11.747  -8.530   6.327
  244   2HB   ASP  30          HB1       ASP  30 -13.368  -7.929   6.678
  245    H    ALA  31           HN       ALA  31 -10.113  -6.654   6.144
  246    HA   ALA  31           HA       ALA  31 -10.786  -4.691   8.120
  247   1HB   ALA  31          HB1       ALA  31  -8.017  -5.181   7.017
  248   2HB   ALA  31          HB2       ALA  31  -8.809  -6.308   8.115
  249   3HB   ALA  31          HB3       ALA  31  -8.463  -4.663   8.643
  250    H    PHE  32           HN       PHE  32  -9.858  -4.380   4.749
  251    HA   PHE  32           HA       PHE  32  -8.826  -1.746   4.668
  252   1HB   PHE  32          HB2       PHE  32 -10.506  -3.417   2.825
  253   2HB   PHE  32          HB1       PHE  32 -10.206  -1.743   2.412
  254    HD1  PHE  32           HD1      PHE  32  -9.145  -2.720   0.362
  255    HD2  PHE  32           HD2      PHE  32  -7.463  -3.373   4.279
  256    HE1  PHE  32           HE1      PHE  32  -6.957  -3.275  -0.652
  257    HE2  PHE  32           HE2      PHE  32  -5.295  -3.908   3.250
  258    HZ   PHE  32           HZ       PHE  32  -5.037  -3.864   0.790
  259    H    ASP  33           HN       ASP  33 -11.906  -2.815   5.719
  260    HA   ASP  33           HA       ASP  33 -13.334  -0.363   5.023
  261   1HB   ASP  33          HB2       ASP  33 -14.501  -2.534   5.210
  262   2HB   ASP  33          HB1       ASP  33 -14.096  -2.594   6.927
  263    H    LYS  34           HN       LYS  34 -11.305  -1.371   7.660
  264    HA   LYS  34           HA       LYS  34 -12.049   1.140   9.114
  265   1HB   LYS  34          HB2       LYS  34 -11.516  -0.122  11.243
  266   2HB   LYS  34          HB1       LYS  34 -13.000  -0.621  10.433
  267   1HG   LYS  34          HG2       LYS  34 -11.920  -2.555   9.486
  268   2HG   LYS  34          HG1       LYS  34 -10.338  -2.010  10.044
  269   1HD   LYS  34          HD2       LYS  34 -11.237  -3.759  11.534
  270   2HD   LYS  34          HD1       LYS  34 -11.082  -2.223  12.384
  271   1HE   LYS  34          HE2       LYS  34 -13.688  -2.911  11.040
  272   2HE   LYS  34          HE1       LYS  34 -13.306  -3.608  12.613
  273   1HZ   LYS  34          HZ1       LYS  34 -12.640  -0.971  12.856
  274   2HZ   LYS  34          HZ2       LYS  34 -14.038  -1.714  13.470
  275   3HZ   LYS  34          HZ3       LYS  34 -14.078  -0.941  11.958
  276    H    MET  35           HN       MET  35  -9.737  -0.096   7.275
  277    HA   MET  35           HA       MET  35  -7.429   0.265   9.050
  278   1HB   MET  35          HB2       MET  35  -7.831  -1.041   6.637
  279   2HB   MET  35          HB1       MET  35  -6.876   0.340   6.138
  280   1HG   MET  35          HG2       MET  35  -5.333  -0.286   8.110
  281   2HG   MET  35          HG1       MET  35  -6.179  -1.831   8.103
  282   1HE   MET  35          HE1       MET  35  -4.685  -3.632   7.245
  283   2HE   MET  35          HE2       MET  35  -4.624  -3.839   5.499
  284   3HE   MET  35          HE3       MET  35  -6.170  -3.540   6.290
  285    H    CYS  36           HN       CYS  36  -9.022   2.199   6.427
  286    HA   CYS  36           HA       CYS  36  -7.059   4.279   6.643
  287   1HB   CYS  36          HB2       CYS  36  -8.990   3.972   4.841
  288   2HB   CYS  36          HB1       CYS  36  -9.931   4.938   5.969
  289    H    SER  37           HN       SER  37  -9.062   3.041   8.889
  290    HA   SER  37           HA       SER  37  -9.911   5.542  10.175
  291   1HB   SER  37          HB2       SER  37 -11.068   3.249  10.345
  292   2HB   SER  37          HB1       SER  37  -9.808   2.834  11.505
  293    HG   SER  37           HG       SER  37 -12.011   4.139  11.978
  294    H    LYS  38           HN       LYS  38  -6.880   4.355   9.850
  295    HA   LYS  38           HA       LYS  38  -6.064   5.074  12.654
  296   1HB   LYS  38          HB2       LYS  38  -4.831   3.246  10.592
  297   2HB   LYS  38          HB1       LYS  38  -3.882   3.884  11.935
  298   1HG   LYS  38          HG2       LYS  38  -5.496   2.936  13.533
  299   2HG   LYS  38          HG1       LYS  38  -6.459   2.307  12.195
  300   1HD   LYS  38          HD2       LYS  38  -4.370   1.059  11.441
  301   2HD   LYS  38          HD1       LYS  38  -3.655   1.499  12.991
  302   1HE   LYS  38          HE2       LYS  38  -6.190  -0.108  12.570
  303   2HE   LYS  38          HE1       LYS  38  -4.651  -0.715  13.182
  304   1HZ   LYS  38          HZ1       LYS  38  -6.450   1.253  14.479
  305   2HZ   LYS  38          HZ2       LYS  38  -4.877   0.915  15.024
  306   3HZ   LYS  38          HZ3       LYS  38  -6.060  -0.303  15.029
  307    H    LEU  39           HN       LEU  39  -6.230   6.385   9.601
  308    HA   LEU  39           HA       LEU  39  -3.732   8.007   9.915
  309   1HB   LEU  39          HB2       LEU  39  -5.634   7.832   7.565
  310   2HB   LEU  39          HB1       LEU  39  -4.077   8.655   7.584
  311    HG   LEU  39           HG       LEU  39  -4.465   5.683   8.034
  312   1HD1  LEU  39          HD11      LEU  39  -4.922   6.638   5.692
  313   2HD1  LEU  39          HD12      LEU  39  -3.747   5.329   5.812
  314   3HD1  LEU  39          HD13      LEU  39  -3.198   6.991   5.638
  315   1HD2  LEU  39          HD21      LEU  39  -1.901   5.796   7.526
  316   2HD2  LEU  39          HD22      LEU  39  -2.450   6.257   9.132
  317   3HD2  LEU  39          HD23      LEU  39  -2.053   7.498   7.949
  318    HA   PRO  40           HA       PRO  40  -6.111  11.353  11.629
  319   1HB   PRO  40          HB2       PRO  40  -4.810  13.267   9.771
  320   2HB   PRO  40          HB1       PRO  40  -4.730  13.206  11.537
  321   1HG   PRO  40          HG2       PRO  40  -2.693  12.369   9.719
  322   2HG   PRO  40          HG1       PRO  40  -2.713  12.116  11.471
  323   1HD   PRO  40          HD2       PRO  40  -3.001  10.127   9.417
  324   2HD   PRO  40          HD1       PRO  40  -3.080   9.878  11.169
  325    H    LYS  41           HN       LYS  41  -7.908  12.810  10.924
  326    HA   LYS  41           HA       LYS  41  -9.415  11.669   8.756
  327   1HB   LYS  41          HB2       LYS  41 -10.435  12.838  10.735
  328   2HB   LYS  41          HB1       LYS  41  -9.868  14.365  10.058
  329   1HG   LYS  41          HG2       LYS  41 -11.282  14.200   8.172
  330   2HG   LYS  41          HG1       LYS  41 -11.549  12.472   8.404
  331   1HD   LYS  41          HD2       LYS  41 -13.540  13.695   9.104
  332   2HD   LYS  41          HD1       LYS  41 -12.768  12.981  10.520
  333   1HE   LYS  41          HE2       LYS  41 -11.817  15.073  11.174
  334   2HE   LYS  41          HE1       LYS  41 -12.216  15.817   9.625
  335   1HZ   LYS  41          HZ1       LYS  41 -14.585  15.448  10.172
  336   2HZ   LYS  41          HZ2       LYS  41 -13.807  16.514  11.242
  337   3HZ   LYS  41          HZ3       LYS  41 -14.121  14.912  11.713
  338    H    SER  42           HN       SER  42  -7.086  14.215   8.747
  339    HA   SER  42           HA       SER  42  -8.119  15.469   6.371
  340   1HB   SER  42          HB2       SER  42  -6.726  16.730   7.920
  341   2HB   SER  42          HB1       SER  42  -5.381  15.624   7.655
  342    HG   SER  42           HG       SER  42  -6.113  17.769   6.232
  343    H    LEU  43           HN       LEU  43  -6.607  12.587   6.738
  344    HA   LEU  43           HA       LEU  43  -5.409  12.602   4.011
  345   1HB   LEU  43          HB2       LEU  43  -4.494  11.765   6.617
  346   2HB   LEU  43          HB1       LEU  43  -4.664  10.312   5.649
  347    HG   LEU  43           HG       LEU  43  -3.229  11.206   3.982
  348   1HD1  LEU  43          HD11      LEU  43  -1.978  13.487   4.878
  349   2HD1  LEU  43          HD12      LEU  43  -3.633  13.766   5.415
  350   3HD1  LEU  43          HD13      LEU  43  -3.294  13.482   3.711
  351   1HD2  LEU  43          HD21      LEU  43  -1.118  11.591   5.444
  352   2HD2  LEU  43          HD22      LEU  43  -1.973  10.061   5.590
  353   3HD2  LEU  43          HD23      LEU  43  -2.211  11.319   6.799
  354    H    SER  44           HN       SER  44  -8.010  11.664   5.818
  355    HA   SER  44           HA       SER  44  -8.761   9.088   5.380
  356   1HB   SER  44          HB2       SER  44 -10.302  10.631   6.396
  357   2HB   SER  44          HB1       SER  44 -10.433  11.567   4.911
  358    HG   SER  44           HG       SER  44 -12.025   9.714   5.584
  359    H    GLU  45           HN       GLU  45  -9.768  11.542   3.054
  360    HA   GLU  45           HA       GLU  45 -10.782  10.002   1.085
  361   1HB   GLU  45          HB2       GLU  45  -9.342  12.638   0.839
  362   2HB   GLU  45          HB1       GLU  45 -10.466  11.979  -0.353
  363   1HG   GLU  45          HG2       GLU  45 -11.212  12.439   2.549
  364   2HG   GLU  45          HG1       GLU  45 -11.512  13.615   1.270
  365    H    GLU  46           HN       GLU  46  -7.505  11.363   0.800
  366    HA   GLU  46           HA       GLU  46  -6.939  10.255  -1.738
  367   1HB   GLU  46          HB2       GLU  46  -5.099  10.816   0.594
  368   2HB   GLU  46          HB1       GLU  46  -4.554  10.466  -1.043
  369   1HG   GLU  46          HG2       GLU  46  -4.584  12.846  -0.900
  370   2HG   GLU  46          HG1       GLU  46  -6.042  12.419  -1.794
  371    H    CYS  47           HN       CYS  47  -7.208   8.701   1.337
  372    HA   CYS  47           HA       CYS  47  -5.652   6.368   0.494
  373   1HB   CYS  47          HB2       CYS  47  -5.898   5.665   2.679
  374   2HB   CYS  47          HB1       CYS  47  -6.294   7.367   2.931
  375    H    GLN  48           HN       GLN  48  -9.075   7.220   0.880
  376    HA   GLN  48           HA       GLN  48 -10.206   4.733   0.212
  377   1HB   GLN  48          HB2       GLN  48 -11.501   6.770   0.906
  378   2HB   GLN  48          HB1       GLN  48 -11.236   7.439  -0.704
  379   1HG   GLN  48          HG2       GLN  48 -12.427   5.590  -1.730
  380   2HG   GLN  48          HG1       GLN  48 -12.575   4.772  -0.174
  381   1HE2  GLN  48          HE21      GLN  48 -13.430   6.737   1.550
  382   2HE2  GLN  48          HE22      GLN  48 -14.897   7.409   1.024
  383    H    GLU  49           HN       GLU  49  -8.955   7.278  -1.942
  384    HA   GLU  49           HA       GLU  49  -9.745   5.970  -4.367
  385   1HB   GLU  49          HB2       GLU  49  -9.232   8.343  -4.354
  386   2HB   GLU  49          HB1       GLU  49  -7.585   8.022  -3.815
  387   1HG   GLU  49          HG2       GLU  49  -7.013   6.963  -5.883
  388   2HG   GLU  49          HG1       GLU  49  -8.700   6.903  -6.395
  389    H    VAL  50           HN       VAL  50  -6.710   5.903  -2.474
  390    HA   VAL  50           HA       VAL  50  -5.302   4.291  -4.387
  391    HB   VAL  50           HB       VAL  50  -4.775   4.396  -1.413
  392   1HG1  VAL  50          HG11      VAL  50  -3.641   2.572  -2.552
  393   2HG1  VAL  50          HG12      VAL  50  -2.474   3.819  -2.120
  394   3HG1  VAL  50          HG13      VAL  50  -3.039   3.683  -3.784
  395   1HG2  VAL  50          HG21      VAL  50  -4.816   6.638  -2.874
  396   2HG2  VAL  50          HG22      VAL  50  -3.259   6.043  -3.426
  397   3HG2  VAL  50          HG23      VAL  50  -3.526   6.351  -1.711
  398    H    VAL  51           HN       VAL  51  -6.877   3.481  -1.265
  399    HA   VAL  51           HA       VAL  51  -6.466   0.711  -1.537
  400    HB   VAL  51           HB       VAL  51  -8.705   2.142  -0.048
  401   1HG1  VAL  51          HG11      VAL  51  -9.169  -0.208  -0.133
  402   2HG1  VAL  51          HG12      VAL  51  -8.519   0.139   1.469
  403   3HG1  VAL  51          HG13      VAL  51  -7.492  -0.605   0.245
  404   1HG2  VAL  51          HG21      VAL  51  -5.926   1.357   0.869
  405   2HG2  VAL  51          HG22      VAL  51  -7.170   2.076   1.891
  406   3HG2  VAL  51          HG23      VAL  51  -6.476   3.003   0.560
  407    H    ASP  52           HN       ASP  52  -9.401   2.555  -2.306
  408    HA   ASP  52           HA       ASP  52 -10.885   0.361  -3.303
  409   1HB   ASP  52          HB2       ASP  52 -11.833   2.563  -2.686
  410   2HB   ASP  52          HB1       ASP  52 -11.108   3.261  -4.132
  411    H    THR  53           HN       THR  53  -8.788   2.655  -5.054
  412    HA   THR  53           HA       THR  53  -9.352   1.333  -7.622
  413    HB   THR  53           HB       THR  53  -7.284   3.447  -7.025
  414    HG1  THR  53           HG1      THR  53  -9.421   4.481  -8.131
  415   1HG2  THR  53          HG21      THR  53  -8.811   2.749  -9.547
  416   2HG2  THR  53          HG22      THR  53  -7.152   2.254  -9.208
  417   3HG2  THR  53          HG23      THR  53  -7.542   3.964  -9.395
  418    H    TYR  54           HN       TYR  54  -6.600   1.541  -5.358
  419    HA   TYR  54           HA       TYR  54  -5.224  -0.512  -7.061
  420   1HB   TYR  54          HB2       TYR  54  -4.131   1.492  -5.101
  421   2HB   TYR  54          HB1       TYR  54  -3.164   0.238  -5.871
  422    HD1  TYR  54           HD1      TYR  54  -2.686   0.316  -8.283
  423    HD2  TYR  54           HD2      TYR  54  -5.047   3.338  -6.385
  424    HE1  TYR  54           HE1      TYR  54  -2.446   1.765 -10.284
  425    HE2  TYR  54           HE2      TYR  54  -4.816   4.794  -8.357
  426    HH   TYR  54           HH       TYR  54  -2.741   4.775 -10.417
  427    H    GLY  55           HN       GLY  55  -7.273  -1.153  -5.041
  428   1HA   GLY  55          HA2       GLY  55  -5.836  -2.229  -2.743
  429   2HA   GLY  55          HA1       GLY  55  -7.552  -2.422  -3.071
  430    H    SER  56           HN       SER  56  -7.713  -3.806  -5.405
  431    HA   SER  56           HA       SER  56  -6.869  -6.404  -4.565
  432   1HB   SER  56          HB2       SER  56  -7.496  -6.050  -7.446
  433   2HB   SER  56          HB1       SER  56  -8.147  -7.197  -6.274
  434    HG   SER  56           HG       SER  56  -8.739  -4.417  -6.383
  435    H    SER  57           HN       SER  57  -5.467  -3.988  -6.644
  436    HA   SER  57           HA       SER  57  -3.627  -5.838  -7.885
  437   1HB   SER  57          HB2       SER  57  -2.593  -3.872  -8.915
  438   2HB   SER  57          HB1       SER  57  -4.344  -3.698  -8.982
  439    HG   SER  57           HG       SER  57  -3.439  -1.792  -8.216
  440    H    ILE  58           HN       ILE  58  -3.179  -3.380  -5.301
  441    HA   ILE  58           HA       ILE  58  -0.408  -3.875  -4.827
  442    HB   ILE  58           HB       ILE  58  -2.676  -3.157  -2.945
  443   1HG1  ILE  58          HG12      ILE  58  -0.333  -1.550  -4.022
  444   2HG1  ILE  58          HG11      ILE  58  -1.952  -1.496  -4.702
  445   1HG2  ILE  58          HG21      ILE  58  -0.696  -2.514  -1.404
  446   2HG2  ILE  58          HG22      ILE  58   0.283  -3.551  -2.442
  447   3HG2  ILE  58          HG23      ILE  58  -1.071  -4.232  -1.546
  448   1HD1  ILE  58          HD11      ILE  58  -2.591  -0.955  -2.143
  449   2HD1  ILE  58          HD12      ILE  58  -2.100   0.317  -3.261
  450   3HD1  ILE  58          HD13      ILE  58  -0.927  -0.367  -2.134
  451    H    LEU  59           HN       LEU  59  -3.305  -5.420  -3.577
  452    HA   LEU  59           HA       LEU  59  -2.036  -7.427  -1.988
  453   1HB   LEU  59          HB2       LEU  59  -4.725  -6.772  -2.982
  454   2HB   LEU  59          HB1       LEU  59  -4.482  -8.507  -2.935
  455    HG   LEU  59           HG       LEU  59  -5.502  -7.671  -0.888
  456   1HD1  LEU  59          HD11      LEU  59  -3.638  -9.560  -1.006
  457   2HD1  LEU  59          HD12      LEU  59  -4.276  -9.017   0.543
  458   3HD1  LEU  59          HD13      LEU  59  -2.722  -8.416  -0.024
  459   1HD2  LEU  59          HD21      LEU  59  -4.491  -6.093   0.545
  460   2HD2  LEU  59          HD22      LEU  59  -4.281  -5.407  -1.066
  461   3HD2  LEU  59          HD23      LEU  59  -2.932  -6.209  -0.263
  462    H    SER  60           HN       SER  60  -2.593  -7.308  -5.475
  463    HA   SER  60           HA       SER  60  -2.259 -10.152  -5.627
  464   1HB   SER  60          HB2       SER  60  -3.567  -9.282  -7.366
  465   2HB   SER  60          HB1       SER  60  -2.445  -7.955  -7.660
  466    HG   SER  60           HG       SER  60  -2.065 -10.715  -8.233
  467    H    ILE  61           HN       ILE  61  -0.243  -7.329  -6.094
  468    HA   ILE  61           HA       ILE  61   2.032  -8.660  -7.250
  469    HB   ILE  61           HB       ILE  61   1.971  -6.055  -5.714
  470   1HG1  ILE  61          HG12      ILE  61   0.795  -6.840  -8.339
  471   2HG1  ILE  61          HG11      ILE  61   0.423  -5.474  -7.305
  472   1HG2  ILE  61          HG21      ILE  61   3.793  -6.998  -7.951
  473   2HG2  ILE  61          HG22      ILE  61   4.213  -7.039  -6.239
  474   3HG2  ILE  61          HG23      ILE  61   3.934  -5.496  -7.034
  475   1HD1  ILE  61          HD11      ILE  61   2.478  -4.323  -8.113
  476   2HD1  ILE  61          HD12      ILE  61   1.305  -4.642  -9.392
  477   3HD1  ILE  61          HD13      ILE  61   2.738  -5.655  -9.245
  478    H    LEU  62           HN       LEU  62   1.331  -7.547  -3.935
  479    HA   LEU  62           HA       LEU  62   3.780  -8.258  -2.784
  480   1HB   LEU  62          HB2       LEU  62   1.110  -7.522  -1.906
  481   2HB   LEU  62          HB1       LEU  62   1.727  -8.783  -0.849
  482    HG   LEU  62           HG       LEU  62   3.401  -6.363  -1.562
  483   1HD1  LEU  62          HD11      LEU  62   1.193  -6.617   0.451
  484   2HD1  LEU  62          HD12      LEU  62   1.603  -5.260  -0.589
  485   3HD1  LEU  62          HD13      LEU  62   2.592  -5.615   0.823
  486   1HD2  LEU  62          HD21      LEU  62   3.421  -8.441   0.649
  487   2HD2  LEU  62          HD22      LEU  62   4.398  -6.986   0.696
  488   3HD2  LEU  62          HD23      LEU  62   4.652  -8.169  -0.580
  489    H    LEU  63           HN       LEU  63   0.955 -10.244  -3.501
  490    HA   LEU  63           HA       LEU  63   1.991 -12.611  -2.154
  491   1HB   LEU  63          HB2       LEU  63  -0.151 -12.360  -4.289
  492   2HB   LEU  63          HB1       LEU  63   0.145 -13.778  -3.278
  493    HG   LEU  63           HG       LEU  63  -0.596 -11.030  -2.235
  494   1HD1  LEU  63          HD11      LEU  63  -2.466 -12.060  -3.436
  495   2HD1  LEU  63          HD12      LEU  63  -2.777 -12.090  -1.699
  496   3HD1  LEU  63          HD13      LEU  63  -2.248 -13.555  -2.526
  497   1HD2  LEU  63          HD21      LEU  63   0.074 -13.660  -0.935
  498   2HD2  LEU  63          HD22      LEU  63  -1.096 -12.591  -0.155
  499   3HD2  LEU  63          HD23      LEU  63   0.545 -12.026  -0.462
  500    H    GLU  64           HN       GLU  64   2.773 -11.093  -5.098
  501    HA   GLU  64           HA       GLU  64   3.708 -13.599  -6.343
  502   1HB   GLU  64          HB2       GLU  64   3.755 -10.691  -7.169
  503   2HB   GLU  64          HB1       GLU  64   4.702 -11.900  -8.037
  504   1HG   GLU  64          HG2       GLU  64   2.684 -13.190  -8.501
  505   2HG   GLU  64          HG1       GLU  64   1.715 -12.049  -7.569
  506    H    GLU  65           HN       GLU  65   4.690 -12.814  -3.772
  507    HA   GLU  65           HA       GLU  65   6.759 -12.675  -2.584
  508   1HB   GLU  65          HB2       GLU  65   7.586 -13.979  -5.173
  509   2HB   GLU  65          HB1       GLU  65   8.563 -13.936  -3.706
  510   1HG   GLU  65          HG2       GLU  65   5.749 -15.047  -3.777
  511   2HG   GLU  65          HG1       GLU  65   7.183 -16.046  -4.014
  512    H    VAL  66           HN       VAL  66   6.094 -10.312  -4.376
  513    HA   VAL  66           HA       VAL  66   8.776  -9.439  -5.319
  514    HB   VAL  66           HB       VAL  66   5.949  -8.467  -5.622
  515   1HG1  VAL  66          HG11      VAL  66   6.881  -6.398  -4.927
  516   2HG1  VAL  66          HG12      VAL  66   6.964  -6.343  -6.687
  517   3HG1  VAL  66          HG13      VAL  66   8.410  -6.715  -5.746
  518   1HG2  VAL  66          HG21      VAL  66   8.206  -8.468  -7.632
  519   2HG2  VAL  66          HG22      VAL  66   6.472  -8.517  -7.940
  520   3HG2  VAL  66          HG23      VAL  66   7.292  -9.930  -7.271
  521    H    SER  67           HN       SER  67   9.917  -7.745  -4.290
  522    HA   SER  67           HA       SER  67   9.753  -7.513  -1.506
  523   1HB   SER  67          HB2       SER  67  10.797  -5.170  -3.058
  524   2HB   SER  67          HB1       SER  67  11.509  -6.002  -1.679
  525    HG   SER  67           HG       SER  67  11.461  -7.830  -3.431
  526    HA   PRO  68           HA       PRO  68   6.315  -4.829  -0.828
  527   1HB   PRO  68          HB2       PRO  68   7.293  -3.346   1.396
  528   2HB   PRO  68          HB1       PRO  68   6.433  -4.881   1.464
  529   1HG   PRO  68          HG2       PRO  68   9.303  -4.365   1.882
  530   2HG   PRO  68          HG1       PRO  68   8.348  -5.786   2.334
  531   1HD   PRO  68          HD2       PRO  68  10.192  -5.630   0.179
  532   2HD   PRO  68          HD1       PRO  68   9.019  -6.929   0.478
  533    H    GLU  69           HN       GLU  69   9.461  -3.044  -0.634
  534    HA   GLU  69           HA       GLU  69   8.163  -0.521  -1.210
  535   1HB   GLU  69          HB2       GLU  69  10.400   0.421  -1.368
  536   2HB   GLU  69          HB1       GLU  69  10.301  -0.648   0.025
  537   1HG   GLU  69          HG2       GLU  69  11.453  -1.447  -2.667
  538   2HG   GLU  69          HG1       GLU  69  12.406  -0.943  -1.279
  539    H    LEU  70           HN       LEU  70   9.133  -3.113  -3.227
  540    HA   LEU  70           HA       LEU  70   9.558  -1.445  -5.581
  541   1HB   LEU  70          HB2       LEU  70   9.087  -4.425  -5.228
  542   2HB   LEU  70          HB1       LEU  70   9.255  -3.699  -6.813
  543    HG   LEU  70           HG       LEU  70  11.298  -3.385  -4.639
  544   1HD1  LEU  70          HD11      LEU  70  10.948  -5.788  -5.395
  545   2HD1  LEU  70          HD12      LEU  70  12.577  -5.158  -5.622
  546   3HD1  LEU  70          HD13      LEU  70  11.477  -5.267  -6.993
  547   1HD2  LEU  70          HD21      LEU  70  12.729  -2.988  -6.830
  548   2HD2  LEU  70          HD22      LEU  70  11.768  -1.681  -6.153
  549   3HD2  LEU  70          HD23      LEU  70  11.161  -2.596  -7.527
  550    H    VAL  71           HN       VAL  71   6.886  -2.485  -3.794
  551    HA   VAL  71           HA       VAL  71   4.958  -2.614  -5.904
  552    HB   VAL  71           HB       VAL  71   4.755  -2.173  -2.917
  553   1HG1  VAL  71          HG11      VAL  71   2.191  -2.377  -3.283
  554   2HG1  VAL  71          HG12      VAL  71   2.528  -1.823  -4.924
  555   3HG1  VAL  71          HG13      VAL  71   2.929  -0.799  -3.545
  556   1HG2  VAL  71          HG21      VAL  71   5.101  -4.451  -3.682
  557   2HG2  VAL  71          HG22      VAL  71   3.759  -4.312  -4.816
  558   3HG2  VAL  71          HG23      VAL  71   3.451  -4.301  -3.080
  559    H    CYS  72           HN       CYS  72   5.600   0.156  -3.652
  560    HA   CYS  72           HA       CYS  72   3.814   1.782  -5.099
  561   1HB   CYS  72          HB2       CYS  72   6.225   2.770  -3.525
  562   2HB   CYS  72          HB1       CYS  72   4.762   3.678  -3.870
  563    H    SER  73           HN       SER  73   7.158   0.955  -5.666
  564    HA   SER  73           HA       SER  73   7.628   3.090  -7.627
  565   1HB   SER  73          HB2       SER  73   9.207   0.529  -7.532
  566   2HB   SER  73          HB1       SER  73   9.759   2.147  -7.952
  567    HG   SER  73           HG       SER  73  10.399   2.069  -5.924
  568    H    MET  74           HN       MET  74   6.609  -0.318  -7.918
  569    HA   MET  74           HA       MET  74   6.717  -0.278 -10.849
  570   1HB   MET  74          HB2       MET  74   5.872  -2.186  -8.737
  571   2HB   MET  74          HB1       MET  74   4.990  -2.330 -10.254
  572   1HG   MET  74          HG2       MET  74   7.353  -2.344 -11.365
  573   2HG   MET  74          HG1       MET  74   7.934  -2.716  -9.747
  574   1HE   MET  74          HE1       MET  74   5.664  -5.834  -8.897
  575   2HE   MET  74          HE2       MET  74   4.849  -4.278  -9.027
  576   3HE   MET  74          HE3       MET  74   6.432  -4.377  -8.259
  577    H    LEU  75           HN       LEU  75   4.060   0.233  -8.484
  578    HA   LEU  75           HA       LEU  75   2.075   0.410 -10.593
  579   1HB   LEU  75          HB2       LEU  75   1.905   1.531  -7.786
  580   2HB   LEU  75          HB1       LEU  75   0.557   1.185  -8.865
  581    HG   LEU  75           HG       LEU  75   2.446  -0.815  -7.602
  582   1HD1  LEU  75          HD11      LEU  75   0.213  -1.732  -6.773
  583   2HD1  LEU  75          HD12      LEU  75  -0.490  -0.206  -7.305
  584   3HD1  LEU  75          HD13      LEU  75   0.754  -0.216  -6.055
  585   1HD2  LEU  75          HD21      LEU  75   2.099  -1.758  -9.729
  586   2HD2  LEU  75          HD22      LEU  75   0.462  -1.107  -9.850
  587   3HD2  LEU  75          HD23      LEU  75   0.795  -2.465  -8.777
  588    H    HIS  76           HN       HIS  76   4.582   2.274 -10.446
  589    HA   HIS  76           HA       HIS  76   5.075   4.502 -10.970
  590   1HB   HIS  76          HB2       HIS  76   2.367   4.395 -12.337
  591   2HB   HIS  76          HB1       HIS  76   3.716   5.458 -12.739
  592    HD1  HIS  76           HD1      HIS  76   2.242   2.819 -14.287
  593    HD2  HIS  76           HD2      HIS  76   6.151   3.285 -12.912
  594    HE1  HIS  76           HE1      HIS  76   3.659   1.167 -15.582
  595    H    LEU  77           HN       LEU  77   3.288   3.952  -8.479
  596    HA   LEU  77           HA       LEU  77   1.727   6.451  -8.355
  597   1HB   LEU  77          HB2       LEU  77   2.255   4.224  -6.380
  598   2HB   LEU  77          HB1       LEU  77   1.438   5.693  -5.899
  599    HG   LEU  77           HG       LEU  77   0.520   3.645  -7.904
  600   1HD1  LEU  77          HD11      LEU  77  -0.729   4.710  -5.365
  601   2HD1  LEU  77          HD12      LEU  77   0.143   3.188  -5.494
  602   3HD1  LEU  77          HD13      LEU  77  -1.371   3.414  -6.369
  603   1HD2  LEU  77          HD21      LEU  77  -1.608   5.246  -7.858
  604   2HD2  LEU  77          HD22      LEU  77  -0.290   5.571  -8.974
  605   3HD2  LEU  77          HD23      LEU  77  -0.406   6.476  -7.464
  606    H    CYS  78           HN       CYS  78   4.927   5.510  -7.849
  607    HA   CYS  78           HA       CYS  78   5.453   8.059  -6.366
  608   1HB   CYS  78          HB2       CYS  78   6.644   5.318  -5.911
  609   2HB   CYS  78          HB1       CYS  78   7.439   6.788  -5.356
  610    H    SER  79           HN       SER  79   6.462   5.660  -8.683
  611    HA   SER  79           HA       SER  79   7.893   5.741 -10.489
  612   1HB   SER  79          HB2       SER  79   6.545   7.904 -10.835
  613   2HB   SER  79          HB1       SER  79   7.944   8.747 -10.175
  614    HG   SER  79           HG       SER  79   7.657   7.305 -12.561
  615    H    GLY  80           HN       GLY  80   8.823   6.862  -7.467
  616   1HA   GLY  80          HA2       GLY  80  11.037   6.452  -6.573
  617   2HA   GLY  80          HA1       GLY  80  11.701   6.589  -8.204
  618    H    LEU  81           HN       LEU  81  13.218   8.236  -7.550
  619    HA   LEU  81           HA       LEU  81  12.161  10.733  -6.394
  620   1HB   LEU  81          HB2       LEU  81  14.417   9.808  -5.764
  621   2HB   LEU  81          HB1       LEU  81  14.954  10.125  -7.411
  622    HG   LEU  81           HG       LEU  81  14.322  12.547  -7.074
  623   1HD1  LEU  81          HD11      LEU  81  13.707  11.480  -4.325
  624   2HD1  LEU  81          HD12      LEU  81  12.815  12.654  -5.291
  625   3HD1  LEU  81          HD13      LEU  81  14.312  13.127  -4.496
  626   1HD2  LEU  81          HD21      LEU  81  16.383  11.330  -5.210
  627   2HD2  LEU  81          HD22      LEU  81  16.315  13.036  -5.651
  628   3HD2  LEU  81          HD23      LEU  81  16.645  11.819  -6.885
  629    H    VAL  82           HN       VAL  82  10.701  11.097  -8.260
  630    HA   VAL  82           HA       VAL  82  12.003  11.932 -10.787
  631    HB   VAL  82           HB       VAL  82   9.555  12.286 -11.467
  632   1HG1  VAL  82          HG11      VAL  82  10.151   9.517 -10.396
  633   2HG1  VAL  82          HG12      VAL  82  10.910  10.160 -11.852
  634   3HG1  VAL  82          HG13      VAL  82   9.162   9.938 -11.793
  635   1HG2  VAL  82          HG21      VAL  82   7.831  11.495 -10.010
  636   2HG2  VAL  82          HG22      VAL  82   8.844  12.549  -9.024
  637   3HG2  VAL  82          HG23      VAL  82   9.002  10.799  -8.893
  638    HA   PRO  83           HA       PRO  83  12.154  16.240  -9.732
  639   1HB   PRO  83          HB2       PRO  83  10.704  17.091 -12.141
  640   2HB   PRO  83          HB1       PRO  83  12.406  17.349 -11.727
  641   1HG   PRO  83          HG2       PRO  83  11.364  15.481 -13.643
  642   2HG   PRO  83          HG1       PRO  83  13.050  15.654 -13.134
  643   1HD   PRO  83          HD2       PRO  83  11.264  13.474 -12.531
  644   2HD   PRO  83          HD1       PRO  83  12.931  13.687 -11.965
  645    H    ARG  84           HN       ARG  84   9.289  14.516 -10.228
  646    HA   ARG  84           HA       ARG  84   7.861  16.186  -8.318
  647   1HB   ARG  84          HB2       ARG  84   7.584  17.469 -10.452
  648   2HB   ARG  84          HB1       ARG  84   6.804  16.054 -11.158
  649   1HG   ARG  84          HG2       ARG  84   5.038  16.141  -9.472
  650   2HG   ARG  84          HG1       ARG  84   5.839  17.492  -8.669
  651   1HD   ARG  84          HD2       ARG  84   5.488  18.931 -10.566
  652   2HD   ARG  84          HD1       ARG  84   4.932  17.583 -11.557
  653    HE   ARG  84           HE       ARG  84   3.158  17.614  -9.428
  654   1HH1  ARG  84          HH21      ARG  84   4.341  19.885 -11.737
  655   2HH1  ARG  84          HH22      ARG  84   2.878  20.811 -11.774
  656   1HH2  ARG  84          HH11      ARG  84   1.239  18.812  -9.464
  657   2HH2  ARG  84          HH12      ARG  84   1.122  20.203 -10.488
  Start of MODEL   11
    1   1H    SER   1          HT1       SER   1   7.034  15.838  -1.447
    2   2H    SER   1          HT2       SER   1   6.865  17.520  -1.284
    3   3H    SER   1          HT3       SER   1   5.919  16.674  -2.414
    4    HA   SER   1           HA       SER   1   5.731  15.896   0.404
    5   1HB   SER   1          HB2       SER   1   4.298  18.282  -0.799
    6   2HB   SER   1          HB1       SER   1   4.063  17.634   0.822
    7    HG   SER   1           HG       SER   1   6.616  18.001   0.626
    8    H    ASP   2           HN       ASP   2   5.421  14.541  -2.134
    9    HA   ASP   2           HA       ASP   2   2.658  14.482  -2.944
   10   1HB   ASP   2          HB2       ASP   2   4.351  13.695  -4.467
   11   2HB   ASP   2          HB1       ASP   2   4.920  12.505  -3.301
   12    H    VAL   3           HN       VAL   3   1.233  14.102  -1.322
   13    HA   VAL   3           HA       VAL   3   1.541  12.365   0.900
   14    HB   VAL   3           HB       VAL   3  -0.716  12.752   1.340
   15   1HG1  VAL   3          HG11      VAL   3  -0.063  15.061  -0.494
   16   2HG1  VAL   3          HG12      VAL   3   0.736  14.827   1.062
   17   3HG1  VAL   3          HG13      VAL   3  -1.007  15.087   0.996
   18   1HG2  VAL   3          HG21      VAL   3  -1.069  12.989  -1.658
   19   2HG2  VAL   3          HG22      VAL   3  -2.295  13.555  -0.524
   20   3HG2  VAL   3          HG23      VAL   3  -1.844  11.849  -0.556
   21    H    TYR   4           HN       TYR   4   1.063  11.490  -2.460
   22    HA   TYR   4           HA       TYR   4  -0.499   9.158  -1.794
   23   1HB   TYR   4          HB2       TYR   4   0.880  10.123  -4.300
   24   2HB   TYR   4          HB1       TYR   4   0.388   8.437  -4.239
   25    HD1  TYR   4           HD1      TYR   4  -0.647  11.570  -5.312
   26    HD2  TYR   4           HD2      TYR   4  -2.108   8.151  -3.162
   27    HE1  TYR   4           HE1      TYR   4  -2.968  12.168  -5.931
   28    HE2  TYR   4           HE2      TYR   4  -4.420   8.746  -3.793
   29    HH   TYR   4           HH       TYR   4  -5.725  10.494  -4.560
   30    H    CYS   5           HN       CYS   5   2.931   9.610  -2.549
   31    HA   CYS   5           HA       CYS   5   3.753   6.891  -2.313
   32   1HB   CYS   5          HB2       CYS   5   5.161   9.491  -1.615
   33   2HB   CYS   5          HB1       CYS   5   5.946   7.915  -1.484
   34    H    GLU   6           HN       GLU   6   3.146   9.337   0.167
   35    HA   GLU   6           HA       GLU   6   4.084   7.810   2.384
   36   1HB   GLU   6          HB2       GLU   6   3.634  10.181   2.624
   37   2HB   GLU   6          HB1       GLU   6   1.930   9.937   2.242
   38   1HG   GLU   6          HG2       GLU   6   1.536   8.761   4.274
   39   2HG   GLU   6          HG1       GLU   6   3.261   8.563   4.581
   40    H    VAL   7           HN       VAL   7   0.781   7.979   0.972
   41    HA   VAL   7           HA       VAL   7  -0.254   6.118   2.953
   42    HB   VAL   7           HB       VAL   7  -1.435   6.854   0.249
   43   1HG1  VAL   7          HG11      VAL   7  -2.591   4.942   0.944
   44   2HG1  VAL   7          HG12      VAL   7  -3.569   6.236   1.627
   45   3HG1  VAL   7          HG13      VAL   7  -2.447   5.349   2.652
   46   1HG2  VAL   7          HG21      VAL   7  -1.315   8.904   1.391
   47   2HG2  VAL   7          HG22      VAL   7  -1.549   8.156   2.968
   48   3HG2  VAL   7          HG23      VAL   7  -2.908   8.312   1.854
   49    H    CYS   8           HN       CYS   8   0.890   5.617  -0.425
   50    HA   CYS   8           HA       CYS   8   0.118   2.886  -0.578
   51   1HB   CYS   8          HB2       CYS   8   1.525   2.772  -2.454
   52   2HB   CYS   8          HB1       CYS   8   1.007   4.452  -2.406
   53    H    GLU   9           HN       GLU   9   2.913   4.429   0.965
   54    HA   GLU   9           HA       GLU   9   4.215   1.853   1.437
   55   1HB   GLU   9          HB2       GLU   9   4.697   4.649   2.512
   56   2HB   GLU   9          HB1       GLU   9   5.679   3.253   2.954
   57   1HG   GLU   9          HG2       GLU   9   5.227   4.116   0.088
   58   2HG   GLU   9          HG1       GLU   9   6.607   4.646   1.050
   59    H    PHE  10           HN       PHE  10   1.909   3.986   3.105
   60    HA   PHE  10           HA       PHE  10   2.225   2.708   5.664
   61   1HB   PHE  10          HB2       PHE  10   1.181   4.937   5.414
   62   2HB   PHE  10          HB1       PHE  10  -0.172   4.195   4.559
   63    HD1  PHE  10           HD1      PHE  10   1.655   4.273   7.793
   64    HD2  PHE  10           HD2      PHE  10  -1.909   3.060   5.732
   65    HE1  PHE  10           HE1      PHE  10   0.608   3.685   9.962
   66    HE2  PHE  10           HE2      PHE  10  -2.964   2.469   7.904
   67    HZ   PHE  10           HZ       PHE  10  -1.702   2.787  10.018
   68    H    LEU  11           HN       LEU  11  -0.140   2.243   2.989
   69    HA   LEU  11           HA       LEU  11  -1.581   0.098   4.260
   70   1HB   LEU  11          HB2       LEU  11  -1.126   0.435   1.278
   71   2HB   LEU  11          HB1       LEU  11  -2.400  -0.503   2.054
   72    HG   LEU  11           HG       LEU  11  -2.084   2.474   2.514
   73   1HD1  LEU  11          HD11      LEU  11  -4.008   2.639   0.836
   74   2HD1  LEU  11          HD12      LEU  11  -3.584   1.001   0.341
   75   3HD1  LEU  11          HD13      LEU  11  -2.414   2.308   0.155
   76   1HD2  LEU  11          HD21      LEU  11  -3.496   1.411   4.150
   77   2HD2  LEU  11          HD22      LEU  11  -4.319   0.463   2.911
   78   3HD2  LEU  11          HD23      LEU  11  -4.567   2.205   2.997
   79    H    VAL  12           HN       VAL  12   1.268   0.053   2.047
   80    HA   VAL  12           HA       VAL  12   1.497  -2.766   1.901
   81    HB   VAL  12           HB       VAL  12   3.444  -0.464   1.673
   82   1HG1  VAL  12          HG11      VAL  12   5.068  -2.187   0.765
   83   2HG1  VAL  12          HG12      VAL  12   4.056  -3.423   1.518
   84   3HG1  VAL  12          HG13      VAL  12   4.860  -2.207   2.514
   85   1HG2  VAL  12          HG21      VAL  12   3.403  -1.030  -0.668
   86   2HG2  VAL  12          HG22      VAL  12   1.730  -1.002  -0.113
   87   3HG2  VAL  12          HG23      VAL  12   2.557  -2.544  -0.345
   88    H    LYS  13           HN       LYS  13   3.021  -0.455   4.213
   89    HA   LYS  13           HA       LYS  13   4.431  -2.392   5.743
   90   1HB   LYS  13          HB2       LYS  13   4.939  -0.088   6.117
   91   2HB   LYS  13          HB1       LYS  13   3.258   0.304   6.474
   92   1HG   LYS  13          HG2       LYS  13   3.348  -0.608   8.620
   93   2HG   LYS  13          HG1       LYS  13   4.642  -1.732   8.204
   94   1HD   LYS  13          HD2       LYS  13   5.403   0.124   9.697
   95   2HD   LYS  13          HD1       LYS  13   6.268   0.080   8.161
   96   1HE   LYS  13          HE2       LYS  13   5.418   2.377   8.970
   97   2HE   LYS  13          HE1       LYS  13   5.067   1.929   7.301
   98   1HZ   LYS  13          HZ1       LYS  13   2.874   1.606   7.747
   99   2HZ   LYS  13          HZ2       LYS  13   3.202   2.808   8.903
  100   3HZ   LYS  13          HZ3       LYS  13   3.136   1.174   9.366
  101    H    GLU  14           HN       GLU  14   1.136  -1.144   6.085
  102    HA   GLU  14           HA       GLU  14   0.532  -2.710   8.444
  103   1HB   GLU  14          HB2       GLU  14  -0.877  -0.851   6.650
  104   2HB   GLU  14          HB1       GLU  14  -1.926  -2.153   7.199
  105   1HG   GLU  14          HG2       GLU  14  -2.085  -0.321   8.777
  106   2HG   GLU  14          HG1       GLU  14  -1.222  -1.645   9.557
  107    H    VAL  15           HN       VAL  15   0.050  -3.237   4.950
  108    HA   VAL  15           HA       VAL  15  -1.509  -5.616   5.321
  109    HB   VAL  15           HB       VAL  15   0.053  -4.469   3.004
  110   1HG1  VAL  15          HG11      VAL  15   0.406  -6.821   2.683
  111   2HG1  VAL  15          HG12      VAL  15  -0.960  -6.384   1.647
  112   3HG1  VAL  15          HG13      VAL  15  -1.245  -7.199   3.184
  113   1HG2  VAL  15          HG21      VAL  15  -2.872  -5.167   3.401
  114   2HG2  VAL  15          HG22      VAL  15  -2.183  -4.338   2.005
  115   3HG2  VAL  15          HG23      VAL  15  -2.179  -3.556   3.585
  116    H    THR  16           HN       THR  16   2.029  -5.169   4.799
  117    HA   THR  16           HA       THR  16   2.512  -7.958   4.692
  118    HB   THR  16           HB       THR  16   4.763  -7.600   4.917
  119    HG1  THR  16           HG1      THR  16   5.621  -5.892   6.119
  120   1HG2  THR  16          HG21      THR  16   4.501  -4.775   4.214
  121   2HG2  THR  16          HG22      THR  16   3.366  -5.784   3.319
  122   3HG2  THR  16          HG23      THR  16   5.093  -6.112   3.234
  123    H    LYS  17           HN       LYS  17   2.287  -5.775   7.475
  124    HA   LYS  17           HA       LYS  17   3.142  -7.669   9.429
  125   1HB   LYS  17          HB2       LYS  17   2.797  -5.261   9.927
  126   2HB   LYS  17          HB1       LYS  17   1.061  -5.480   9.739
  127   1HG   LYS  17          HG2       LYS  17   1.478  -7.430  11.546
  128   2HG   LYS  17          HG1       LYS  17   2.875  -6.438  11.935
  129   1HD   LYS  17          HD2       LYS  17   1.484  -4.553  12.466
  130   2HD   LYS  17          HD1       LYS  17   0.052  -5.350  11.812
  131   1HE   LYS  17          HE2       LYS  17   0.334  -7.151  13.547
  132   2HE   LYS  17          HE1       LYS  17   1.639  -6.196  14.253
  133   1HZ   LYS  17          HZ1       LYS  17  -0.266  -5.601  15.440
  134   2HZ   LYS  17          HZ2       LYS  17  -1.230  -5.505  14.043
  135   3HZ   LYS  17          HZ3       LYS  17  -0.044  -4.325  14.344
  136    H    LEU  18           HN       LEU  18   0.117  -7.048   7.775
  137    HA   LEU  18           HA       LEU  18  -1.479  -8.946   9.301
  138   1HB   LEU  18          HB2       LEU  18  -1.862  -7.568   6.629
  139   2HB   LEU  18          HB1       LEU  18  -3.055  -8.617   7.322
  140    HG   LEU  18           HG       LEU  18  -2.561  -5.791   7.875
  141   1HD1  LEU  18          HD11      LEU  18  -4.752  -6.821   7.374
  142   2HD1  LEU  18          HD12      LEU  18  -4.770  -5.884   8.869
  143   3HD1  LEU  18          HD13      LEU  18  -4.700  -7.635   8.934
  144   1HD2  LEU  18          HD21      LEU  18  -2.716  -5.717  10.275
  145   2HD2  LEU  18          HD22      LEU  18  -1.315  -6.702   9.898
  146   3HD2  LEU  18          HD23      LEU  18  -2.823  -7.466  10.393
  147    H    ILE  19           HN       ILE  19   0.394  -9.050   6.322
  148    HA   ILE  19           HA       ILE  19  -0.368 -11.752   5.612
  149    HB   ILE  19           HB       ILE  19   2.089 -10.095   4.881
  150   1HG1  ILE  19          HG12      ILE  19  -0.422 -10.791   3.304
  151   2HG1  ILE  19          HG11      ILE  19  -0.124  -9.240   4.068
  152   1HG2  ILE  19          HG21      ILE  19   2.372 -11.773   3.052
  153   2HG2  ILE  19          HG22      ILE  19   1.106 -12.751   3.795
  154   3HG2  ILE  19          HG23      ILE  19   2.618 -12.460   4.654
  155   1HD1  ILE  19          HD11      ILE  19   1.614 -10.476   1.908
  156   2HD1  ILE  19          HD12      ILE  19   1.859  -8.898   2.652
  157   3HD1  ILE  19          HD13      ILE  19   0.438  -9.189   1.651
  158    H    ASP  20           HN       ASP  20   1.992 -10.210   7.665
  159    HA   ASP  20           HA       ASP  20   3.530 -12.619   8.202
  160   1HB   ASP  20          HB2       ASP  20   3.402  -9.993   9.709
  161   2HB   ASP  20          HB1       ASP  20   4.628 -11.244   9.915
  162    H    ASN  21           HN       ASN  21   0.619 -11.173   9.554
  163    HA   ASN  21           HA       ASN  21   0.894 -12.835  11.977
  164   1HB   ASN  21          HB2       ASN  21  -0.090 -10.537  12.183
  165   2HB   ASN  21          HB1       ASN  21  -1.437 -11.050  11.167
  166   1HD2  ASN  21          HD21      ASN  21  -0.235 -11.011  14.408
  167   2HD2  ASN  21          HD22      ASN  21  -1.445 -11.981  15.099
  168    H    ASN  22           HN       ASN  22   0.023 -13.481   8.913
  169    HA   ASN  22           HA       ASN  22  -0.765 -15.535   8.094
  170   1HB   ASN  22          HB2       ASN  22  -0.260 -16.255  10.579
  171   2HB   ASN  22          HB1       ASN  22  -2.016 -16.314  10.709
  172   1HD2  ASN  22          HD21      ASN  22   0.633 -17.498   8.560
  173   2HD2  ASN  22          HD22      ASN  22  -0.145 -18.955   8.165
  174    H    LYS  23           HN       LYS  23  -2.456 -13.147   7.920
  175    HA   LYS  23           HA       LYS  23  -5.190 -14.175   8.462
  176   1HB   LYS  23          HB2       LYS  23  -4.586 -11.555   7.219
  177   2HB   LYS  23          HB1       LYS  23  -5.990 -12.014   8.167
  178   1HG   LYS  23          HG2       LYS  23  -3.812 -12.436   9.916
  179   2HG   LYS  23          HG1       LYS  23  -3.409 -10.939   9.092
  180   1HD   LYS  23          HD2       LYS  23  -5.513  -9.925   9.811
  181   2HD   LYS  23          HD1       LYS  23  -6.054 -11.469  10.478
  182   1HE   LYS  23          HE2       LYS  23  -5.202 -10.057  12.276
  183   2HE   LYS  23          HE1       LYS  23  -4.133 -11.441  12.048
  184   1HZ   LYS  23          HZ1       LYS  23  -3.647  -8.628  11.568
  185   2HZ   LYS  23          HZ2       LYS  23  -3.071  -9.671  10.356
  186   3HZ   LYS  23          HZ3       LYS  23  -2.559  -9.866  11.964
  187    H    THR  24           HN       THR  24  -6.714 -14.442   6.709
  188    HA   THR  24           HA       THR  24  -5.516 -15.323   4.188
  189    HB   THR  24           HB       THR  24  -7.555 -16.323   3.758
  190    HG1  THR  24           HG1      THR  24  -9.529 -15.320   4.566
  191   1HG2  THR  24          HG21      THR  24  -8.067 -15.735   6.669
  192   2HG2  THR  24          HG22      THR  24  -6.797 -16.843   6.148
  193   3HG2  THR  24          HG23      THR  24  -8.484 -17.185   5.759
  194    H    GLU  25           HN       GLU  25  -6.240 -14.542   2.096
  195    HA   GLU  25           HA       GLU  25  -5.943 -11.743   1.731
  196   1HB   GLU  25          HB2       GLU  25  -5.879 -13.652  -0.045
  197   2HB   GLU  25          HB1       GLU  25  -7.624 -13.419  -0.147
  198   1HG   GLU  25          HG2       GLU  25  -7.111 -10.927  -0.493
  199   2HG   GLU  25          HG1       GLU  25  -5.440 -11.423  -0.759
  200    H    LYS  26           HN       LYS  26  -8.901 -13.703   1.984
  201    HA   LYS  26           HA       LYS  26 -10.807 -11.666   1.598
  202   1HB   LYS  26          HB2       LYS  26 -10.817 -14.386   2.384
  203   2HB   LYS  26          HB1       LYS  26 -11.683 -13.542   3.659
  204   1HG   LYS  26          HG2       LYS  26 -12.293 -13.227   0.702
  205   2HG   LYS  26          HG1       LYS  26 -13.147 -14.339   1.766
  206   1HD   LYS  26          HD2       LYS  26 -12.930 -11.433   2.542
  207   2HD   LYS  26          HD1       LYS  26 -14.120 -11.918   1.340
  208   1HE   LYS  26          HE2       LYS  26 -15.015 -13.600   2.958
  209   2HE   LYS  26          HE1       LYS  26 -13.886 -12.992   4.167
  210   1HZ   LYS  26          HZ1       LYS  26 -15.729 -11.751   4.624
  211   2HZ   LYS  26          HZ2       LYS  26 -16.247 -11.696   3.008
  212   3HZ   LYS  26          HZ3       LYS  26 -14.952 -10.723   3.522
  213    H    GLU  27           HN       GLU  27  -8.914 -12.382   4.478
  214    HA   GLU  27           HA       GLU  27 -10.499 -10.630   6.182
  215   1HB   GLU  27          HB2       GLU  27  -7.769 -11.892   6.490
  216   2HB   GLU  27          HB1       GLU  27  -8.453 -10.804   7.694
  217   1HG   GLU  27          HG2       GLU  27 -10.308 -12.267   8.086
  218   2HG   GLU  27          HG1       GLU  27  -9.871 -13.281   6.712
  219    H    ILE  28           HN       ILE  28  -7.554 -10.235   4.229
  220    HA   ILE  28           HA       ILE  28  -6.858  -7.662   5.288
  221    HB   ILE  28           HB       ILE  28  -6.263  -8.641   2.482
  222   1HG1  ILE  28          HG12      ILE  28  -5.453  -9.706   5.142
  223   2HG1  ILE  28          HG11      ILE  28  -5.686 -10.559   3.647
  224   1HG2  ILE  28          HG21      ILE  28  -4.209  -7.399   2.752
  225   2HG2  ILE  28          HG22      ILE  28  -4.558  -7.089   4.451
  226   3HG2  ILE  28          HG23      ILE  28  -5.542  -6.339   3.197
  227   1HD1  ILE  28          HD11      ILE  28  -3.353 -10.657   4.232
  228   2HD1  ILE  28          HD12      ILE  28  -3.282  -8.907   4.447
  229   3HD1  ILE  28          HD13      ILE  28  -3.514  -9.587   2.834
  230    H    LEU  29           HN       LEU  29  -8.877  -8.662   2.539
  231    HA   LEU  29           HA       LEU  29  -9.425  -5.955   1.704
  232   1HB   LEU  29          HB2       LEU  29 -11.086  -8.442   1.216
  233   2HB   LEU  29          HB1       LEU  29 -11.054  -6.971   0.239
  234    HG   LEU  29           HG       LEU  29  -8.688  -8.834   0.676
  235   1HD1  LEU  29          HD11      LEU  29 -10.222  -9.961  -0.764
  236   2HD1  LEU  29          HD12      LEU  29  -9.063  -9.193  -1.848
  237   3HD1  LEU  29          HD13      LEU  29 -10.654  -8.472  -1.603
  238   1HD2  LEU  29          HD21      LEU  29  -7.859  -7.388  -1.349
  239   2HD2  LEU  29          HD22      LEU  29  -7.761  -6.704   0.270
  240   3HD2  LEU  29          HD23      LEU  29  -9.072  -6.227  -0.810
  241    H    ASP  30           HN       ASP  30 -10.757  -8.137   4.057
  242    HA   ASP  30           HA       ASP  30 -13.249  -6.704   4.513
  243   1HB   ASP  30          HB2       ASP  30 -12.853  -9.075   5.243
  244   2HB   ASP  30          HB1       ASP  30 -11.711  -8.471   6.445
  245    H    ALA  31           HN       ALA  31 -10.051  -6.658   6.093
  246    HA   ALA  31           HA       ALA  31 -10.758  -4.665   8.047
  247   1HB   ALA  31          HB1       ALA  31  -7.981  -5.175   6.976
  248   2HB   ALA  31          HB2       ALA  31  -8.782  -6.277   8.096
  249   3HB   ALA  31          HB3       ALA  31  -8.445  -4.617   8.585
  250    H    PHE  32           HN       PHE  32  -9.773  -4.421   4.676
  251    HA   PHE  32           HA       PHE  32  -8.709  -1.825   4.540
  252   1HB   PHE  32          HB2       PHE  32 -10.417  -3.520   2.754
  253   2HB   PHE  32          HB1       PHE  32 -10.128  -1.858   2.291
  254    HD1  PHE  32           HD1      PHE  32  -7.390  -3.497   4.177
  255    HD2  PHE  32           HD2      PHE  32  -9.049  -2.809   0.257
  256    HE1  PHE  32           HE1      PHE  32  -5.226  -4.056   3.153
  257    HE2  PHE  32           HE2      PHE  32  -6.866  -3.392  -0.752
  258    HZ   PHE  32           HZ       PHE  32  -4.958  -4.013   0.698
  259    H    ASP  33           HN       ASP  33 -11.830  -2.763   5.614
  260    HA   ASP  33           HA       ASP  33 -13.105  -0.227   4.890
  261   1HB   ASP  33          HB2       ASP  33 -14.569  -2.084   4.934
  262   2HB   ASP  33          HB1       ASP  33 -13.966  -2.640   6.490
  263    H    LYS  34           HN       LYS  34 -11.148  -1.352   7.542
  264    HA   LYS  34           HA       LYS  34 -11.844   1.148   9.055
  265   1HB   LYS  34          HB2       LYS  34 -10.869  -1.421  10.323
  266   2HB   LYS  34          HB1       LYS  34 -11.540   0.000  11.122
  267   1HG   LYS  34          HG2       LYS  34 -13.678  -0.486   9.733
  268   2HG   LYS  34          HG1       LYS  34 -12.968  -2.080   9.475
  269   1HD   LYS  34          HD2       LYS  34 -13.451  -0.829  12.193
  270   2HD   LYS  34          HD1       LYS  34 -14.495  -2.035  11.440
  271   1HE   LYS  34          HE2       LYS  34 -12.416  -3.514  11.256
  272   2HE   LYS  34          HE1       LYS  34 -11.626  -2.364  12.337
  273   1HZ   LYS  34          HZ1       LYS  34 -13.589  -2.716  13.855
  274   2HZ   LYS  34          HZ2       LYS  34 -12.520  -4.028  13.706
  275   3HZ   LYS  34          HZ3       LYS  34 -14.005  -4.041  12.882
  276    H    MET  35           HN       MET  35  -9.553  -0.060   7.110
  277    HA   MET  35           HA       MET  35  -7.211   0.385   8.829
  278   1HB   MET  35          HB2       MET  35  -7.680  -1.017   6.456
  279   2HB   MET  35          HB1       MET  35  -6.641   0.298   5.942
  280   1HG   MET  35          HG2       MET  35  -5.164  -0.350   7.953
  281   2HG   MET  35          HG1       MET  35  -6.104  -1.841   7.991
  282   1HE   MET  35          HE1       MET  35  -6.188  -3.598   6.320
  283   2HE   MET  35          HE2       MET  35  -4.662  -3.786   7.176
  284   3HE   MET  35          HE3       MET  35  -4.719  -4.028   5.433
  285    H    CYS  36           HN       CYS  36  -8.758   2.203   6.060
  286    HA   CYS  36           HA       CYS  36  -6.776   4.275   6.228
  287   1HB   CYS  36          HB2       CYS  36  -9.685   4.589   5.388
  288   2HB   CYS  36          HB1       CYS  36  -8.386   5.722   5.042
  289    H    SER  37           HN       SER  37  -8.903   3.150   8.457
  290    HA   SER  37           HA       SER  37  -9.690   5.705   9.655
  291   1HB   SER  37          HB2       SER  37  -9.701   3.035  11.057
  292   2HB   SER  37          HB1       SER  37 -10.759   4.416  11.327
  293    HG   SER  37           HG       SER  37 -11.404   4.043   9.047
  294    H    LYS  38           HN       LYS  38  -6.770   3.880   9.736
  295    HA   LYS  38           HA       LYS  38  -6.052   4.858  12.445
  296   1HB   LYS  38          HB2       LYS  38  -4.117   3.412  10.651
  297   2HB   LYS  38          HB1       LYS  38  -4.248   3.380  12.404
  298   1HG   LYS  38          HG2       LYS  38  -6.162   2.117  10.425
  299   2HG   LYS  38          HG1       LYS  38  -5.059   1.274  11.511
  300   1HD   LYS  38          HD2       LYS  38  -6.294   2.505  13.419
  301   2HD   LYS  38          HD1       LYS  38  -7.531   2.858  12.213
  302   1HE   LYS  38          HE2       LYS  38  -7.784   0.451  11.753
  303   2HE   LYS  38          HE1       LYS  38  -6.538   0.089  12.946
  304   1HZ   LYS  38          HZ1       LYS  38  -8.014   0.252  14.571
  305   2HZ   LYS  38          HZ2       LYS  38  -9.240   0.392  13.403
  306   3HZ   LYS  38          HZ3       LYS  38  -8.519   1.786  14.052
  307    H    LEU  39           HN       LEU  39  -6.369   6.589   9.891
  308    HA   LEU  39           HA       LEU  39  -3.761   8.061  10.157
  309   1HB   LEU  39          HB2       LEU  39  -5.549   7.901   7.714
  310   2HB   LEU  39          HB1       LEU  39  -4.027   8.777   7.818
  311    HG   LEU  39           HG       LEU  39  -4.332   5.783   8.162
  312   1HD1  LEU  39          HD11      LEU  39  -2.985   7.206   5.877
  313   2HD1  LEU  39          HD12      LEU  39  -4.702   6.818   5.833
  314   3HD1  LEU  39          HD13      LEU  39  -3.508   5.527   5.968
  315   1HD2  LEU  39          HD21      LEU  39  -2.386   6.398   9.379
  316   2HD2  LEU  39          HD22      LEU  39  -1.966   7.661   8.231
  317   3HD2  LEU  39          HD23      LEU  39  -1.757   5.973   7.791
  318    HA   PRO  40           HA       PRO  40  -6.195  11.397  11.819
  319   1HB   PRO  40          HB2       PRO  40  -4.866  13.285   9.942
  320   2HB   PRO  40          HB1       PRO  40  -4.863  13.286  11.712
  321   1HG   PRO  40          HG2       PRO  40  -2.730  12.441  10.040
  322   2HG   PRO  40          HG1       PRO  40  -2.856  12.172  11.784
  323   1HD   PRO  40          HD2       PRO  40  -3.031  10.206   9.686
  324   2HD   PRO  40          HD1       PRO  40  -3.163   9.933  11.430
  325    H    LYS  41           HN       LYS  41  -7.995  12.846  11.086
  326    HA   LYS  41           HA       LYS  41  -9.479  11.675   8.917
  327   1HB   LYS  41          HB2       LYS  41 -10.547  12.840  10.857
  328   2HB   LYS  41          HB1       LYS  41  -9.951  14.370  10.214
  329   1HG   LYS  41          HG2       LYS  41 -11.295  14.222   8.272
  330   2HG   LYS  41          HG1       LYS  41 -11.604  12.502   8.499
  331   1HD   LYS  41          HD2       LYS  41 -12.514  14.361  10.681
  332   2HD   LYS  41          HD1       LYS  41 -13.421  14.383   9.171
  333   1HE   LYS  41          HE2       LYS  41 -14.422  12.764  10.707
  334   2HE   LYS  41          HE1       LYS  41 -13.714  11.918   9.333
  335   1HZ   LYS  41          HZ1       LYS  41 -11.998  11.113  10.589
  336   2HZ   LYS  41          HZ2       LYS  41 -13.243  11.123  11.746
  337   3HZ   LYS  41          HZ3       LYS  41 -12.082  12.364  11.732
  338    H    SER  42           HN       SER  42  -7.175  14.252   8.896
  339    HA   SER  42           HA       SER  42  -8.223  15.469   6.506
  340   1HB   SER  42          HB2       SER  42  -6.157  16.782   6.508
  341   2HB   SER  42          HB1       SER  42  -6.829  16.700   8.134
  342    HG   SER  42           HG       SER  42  -5.140  14.630   7.515
  343    H    LEU  43           HN       LEU  43  -6.646  12.628   6.912
  344    HA   LEU  43           HA       LEU  43  -5.445  12.633   4.189
  345   1HB   LEU  43          HB2       LEU  43  -4.489  11.890   6.804
  346   2HB   LEU  43          HB1       LEU  43  -4.637  10.403   5.887
  347    HG   LEU  43           HG       LEU  43  -3.172  11.188   4.234
  348   1HD1  LEU  43          HD11      LEU  43  -3.329  13.412   3.694
  349   2HD1  LEU  43          HD12      LEU  43  -2.070  13.630   4.902
  350   3HD1  LEU  43          HD13      LEU  43  -3.761  13.870   5.340
  351   1HD2  LEU  43          HD21      LEU  43  -2.263  10.457   6.531
  352   2HD2  LEU  43          HD22      LEU  43  -1.871  12.159   6.762
  353   3HD2  LEU  43          HD23      LEU  43  -1.140  11.260   5.436
  354    H    SER  44           HN       SER  44  -8.004  11.644   6.022
  355    HA   SER  44           HA       SER  44  -8.697   9.049   5.627
  356   1HB   SER  44          HB2       SER  44 -10.262  10.634   6.594
  357   2HB   SER  44          HB1       SER  44 -10.450  11.449   5.045
  358    HG   SER  44           HG       SER  44 -11.972  10.054   4.691
  359    H    GLU  45           HN       GLU  45  -9.570  11.493   3.241
  360    HA   GLU  45           HA       GLU  45 -10.623   9.980   1.264
  361   1HB   GLU  45          HB2       GLU  45  -9.059  12.543   1.020
  362   2HB   GLU  45          HB1       GLU  45 -10.190  11.925  -0.187
  363   1HG   GLU  45          HG2       GLU  45 -10.957  12.465   2.697
  364   2HG   GLU  45          HG1       GLU  45 -11.197  13.621   1.389
  365    H    GLU  46           HN       GLU  46  -7.268  11.157   1.021
  366    HA   GLU  46           HA       GLU  46  -6.718  10.013  -1.508
  367   1HB   GLU  46          HB2       GLU  46  -4.711  10.233   0.738
  368   2HB   GLU  46          HB1       GLU  46  -4.414  10.346  -0.993
  369   1HG   GLU  46          HG2       GLU  46  -4.427  12.606  -0.416
  370   2HG   GLU  46          HG1       GLU  46  -6.113  12.379  -0.858
  371    H    CYS  47           HN       CYS  47  -7.099   8.475   1.566
  372    HA   CYS  47           HA       CYS  47  -5.674   6.045   0.733
  373   1HB   CYS  47          HB2       CYS  47  -5.849   6.737   3.120
  374   2HB   CYS  47          HB1       CYS  47  -7.589   6.511   3.044
  375    H    GLN  48           HN       GLN  48  -9.054   7.115   1.036
  376    HA   GLN  48           HA       GLN  48 -10.283   4.677   0.326
  377   1HB   GLN  48          HB2       GLN  48 -11.443   6.828   1.036
  378   2HB   GLN  48          HB1       GLN  48 -11.227   7.397  -0.620
  379   1HG   GLN  48          HG2       GLN  48 -13.416   6.416  -0.514
  380   2HG   GLN  48          HG1       GLN  48 -12.393   5.271  -1.384
  381   1HE2  GLN  48          HE21      GLN  48 -11.916   3.236  -0.361
  382   2HE2  GLN  48          HE22      GLN  48 -12.642   2.755   1.096
  383    H    GLU  49           HN       GLU  49  -9.089   7.276  -1.841
  384    HA   GLU  49           HA       GLU  49  -9.842   5.956  -4.265
  385   1HB   GLU  49          HB2       GLU  49  -7.779   8.074  -3.638
  386   2HB   GLU  49          HB1       GLU  49  -8.091   7.505  -5.277
  387   1HG   GLU  49          HG2       GLU  49 -10.374   8.240  -5.189
  388   2HG   GLU  49          HG1       GLU  49 -10.267   8.554  -3.455
  389    H    VAL  50           HN       VAL  50  -6.750   5.909  -2.428
  390    HA   VAL  50           HA       VAL  50  -5.426   4.312  -4.403
  391    HB   VAL  50           HB       VAL  50  -4.779   4.399  -1.451
  392   1HG1  VAL  50          HG11      VAL  50  -2.515   3.812  -2.232
  393   2HG1  VAL  50          HG12      VAL  50  -3.127   3.692  -3.880
  394   3HG1  VAL  50          HG13      VAL  50  -3.699   2.574  -2.639
  395   1HG2  VAL  50          HG21      VAL  50  -4.864   6.640  -2.917
  396   2HG2  VAL  50          HG22      VAL  50  -3.320   6.046  -3.506
  397   3HG2  VAL  50          HG23      VAL  50  -3.546   6.357  -1.784
  398    H    VAL  51           HN       VAL  51  -6.980   3.483  -1.296
  399    HA   VAL  51           HA       VAL  51  -6.538   0.709  -1.572
  400    HB   VAL  51           HB       VAL  51  -8.733   2.186  -0.069
  401   1HG1  VAL  51          HG11      VAL  51  -8.814   0.171   1.344
  402   2HG1  VAL  51          HG12      VAL  51  -7.644  -0.611   0.284
  403   3HG1  VAL  51          HG13      VAL  51  -9.250  -0.204  -0.321
  404   1HG2  VAL  51          HG21      VAL  51  -6.367   2.809   0.487
  405   2HG2  VAL  51          HG22      VAL  51  -6.075   1.124   0.914
  406   3HG2  VAL  51          HG23      VAL  51  -7.239   2.077   1.832
  407    H    ASP  52           HN       ASP  52  -9.429   2.584  -2.393
  408    HA   ASP  52           HA       ASP  52 -10.937   0.410  -3.419
  409   1HB   ASP  52          HB2       ASP  52 -11.925   2.566  -2.822
  410   2HB   ASP  52          HB1       ASP  52 -11.075   3.342  -4.158
  411    H    THR  53           HN       THR  53  -8.781   2.695  -5.123
  412    HA   THR  53           HA       THR  53  -9.310   1.409  -7.701
  413    HB   THR  53           HB       THR  53  -7.207   3.459  -6.989
  414    HG1  THR  53           HG1      THR  53  -9.397   4.073  -6.470
  415   1HG2  THR  53          HG21      THR  53  -8.561   2.719  -9.598
  416   2HG2  THR  53          HG22      THR  53  -6.900   2.330  -9.155
  417   3HG2  THR  53          HG23      THR  53  -7.380   4.011  -9.390
  418    H    TYR  54           HN       TYR  54  -6.581   1.528  -5.399
  419    HA   TYR  54           HA       TYR  54  -5.251  -0.567  -7.085
  420   1HB   TYR  54          HB2       TYR  54  -4.103   1.395  -5.112
  421   2HB   TYR  54          HB1       TYR  54  -3.174   0.140  -5.929
  422    HD1  TYR  54           HD1      TYR  54  -4.386   3.470  -6.156
  423    HD2  TYR  54           HD2      TYR  54  -3.363   0.073  -8.549
  424    HE1  TYR  54           HE1      TYR  54  -4.203   4.945  -8.116
  425    HE2  TYR  54           HE2      TYR  54  -3.160   1.545 -10.538
  426    HH   TYR  54           HH       TYR  54  -4.303   4.762 -10.566
  427    H    GLY  55           HN       GLY  55  -7.319  -1.181  -5.095
  428   1HA   GLY  55          HA2       GLY  55  -5.938  -2.251  -2.762
  429   2HA   GLY  55          HA1       GLY  55  -7.648  -2.443  -3.128
  430    H    SER  56           HN       SER  56  -7.737  -3.832  -5.471
  431    HA   SER  56           HA       SER  56  -6.911  -6.433  -4.589
  432   1HB   SER  56          HB2       SER  56  -7.532  -6.070  -7.477
  433   2HB   SER  56          HB1       SER  56  -8.149  -7.254  -6.321
  434    HG   SER  56           HG       SER  56  -8.827  -4.492  -6.440
  435    H    SER  57           HN       SER  57  -5.481  -4.037  -6.677
  436    HA   SER  57           HA       SER  57  -3.647  -5.913  -7.889
  437   1HB   SER  57          HB2       SER  57  -2.551  -3.929  -8.877
  438   2HB   SER  57          HB1       SER  57  -4.300  -3.820  -9.055
  439    HG   SER  57           HG       SER  57  -2.763  -2.040  -7.996
  440    H    ILE  58           HN       ILE  58  -3.203  -3.448  -5.310
  441    HA   ILE  58           HA       ILE  58  -0.441  -3.942  -4.818
  442    HB   ILE  58           HB       ILE  58  -2.717  -3.291  -2.922
  443   1HG1  ILE  58          HG12      ILE  58  -0.437  -1.577  -3.963
  444   2HG1  ILE  58          HG11      ILE  58  -2.035  -1.601  -4.690
  445   1HG2  ILE  58          HG21      ILE  58  -1.065  -4.316  -1.546
  446   2HG2  ILE  58          HG22      ILE  58  -0.740  -2.588  -1.401
  447   3HG2  ILE  58          HG23      ILE  58   0.258  -3.590  -2.454
  448   1HD1  ILE  58          HD11      ILE  58  -1.199  -0.578  -1.988
  449   2HD1  ILE  58          HD12      ILE  58  -2.871  -1.071  -2.255
  450   3HD1  ILE  58          HD13      ILE  58  -2.175   0.234  -3.214
  451    H    LEU  59           HN       LEU  59  -3.334  -5.474  -3.577
  452    HA   LEU  59           HA       LEU  59  -2.099  -7.490  -1.986
  453   1HB   LEU  59          HB2       LEU  59  -4.766  -6.786  -2.967
  454   2HB   LEU  59          HB1       LEU  59  -4.554  -8.524  -3.031
  455    HG   LEU  59           HG       LEU  59  -5.568  -7.833  -0.937
  456   1HD1  LEU  59          HD11      LEU  59  -3.660  -9.683  -1.163
  457   2HD1  LEU  59          HD12      LEU  59  -4.347  -9.264   0.402
  458   3HD1  LEU  59          HD13      LEU  59  -2.793  -8.592  -0.080
  459   1HD2  LEU  59          HD21      LEU  59  -4.339  -5.548  -0.992
  460   2HD2  LEU  59          HD22      LEU  59  -3.021  -6.398  -0.182
  461   3HD2  LEU  59          HD23      LEU  59  -4.607  -6.308   0.575
  462    H    SER  60           HN       SER  60  -2.592  -7.370  -5.482
  463    HA   SER  60           HA       SER  60  -2.225 -10.214  -5.613
  464   1HB   SER  60          HB2       SER  60  -3.537  -9.362  -7.363
  465   2HB   SER  60          HB1       SER  60  -2.415  -8.040  -7.675
  466    HG   SER  60           HG       SER  60  -0.932  -9.991  -8.143
  467    H    ILE  61           HN       ILE  61  -0.253  -7.355  -6.098
  468    HA   ILE  61           HA       ILE  61   2.059  -8.642  -7.232
  469    HB   ILE  61           HB       ILE  61   1.987  -6.058  -5.664
  470   1HG1  ILE  61          HG12      ILE  61   0.735  -6.785  -8.264
  471   2HG1  ILE  61          HG11      ILE  61   0.420  -5.416  -7.209
  472   1HG2  ILE  61          HG21      ILE  61   3.752  -6.927  -7.972
  473   2HG2  ILE  61          HG22      ILE  61   4.212  -7.045  -6.275
  474   3HG2  ILE  61          HG23      ILE  61   3.921  -5.467  -6.996
  475   1HD1  ILE  61          HD11      ILE  61   2.655  -5.638  -9.237
  476   2HD1  ILE  61          HD12      ILE  61   2.502  -4.321  -8.071
  477   3HD1  ILE  61          HD13      ILE  61   1.259  -4.563  -9.298
  478    H    LEU  62           HN       LEU  62   1.289  -7.571  -3.920
  479    HA   LEU  62           HA       LEU  62   3.730  -8.218  -2.722
  480   1HB   LEU  62          HB2       LEU  62   0.998  -7.631  -1.890
  481   2HB   LEU  62          HB1       LEU  62   1.691  -8.843  -0.822
  482    HG   LEU  62           HG       LEU  62   3.204  -6.321  -1.542
  483   1HD1  LEU  62          HD11      LEU  62   1.021  -6.717   0.478
  484   2HD1  LEU  62          HD12      LEU  62   1.316  -5.347  -0.585
  485   3HD1  LEU  62          HD13      LEU  62   2.338  -5.601   0.826
  486   1HD2  LEU  62          HD21      LEU  62   4.568  -8.030  -0.540
  487   2HD2  LEU  62          HD22      LEU  62   3.350  -8.381   0.683
  488   3HD2  LEU  62          HD23      LEU  62   4.223  -6.860   0.726
  489    H    LEU  63           HN       LEU  63   0.994 -10.295  -3.525
  490    HA   LEU  63           HA       LEU  63   2.079 -12.642  -2.184
  491   1HB   LEU  63          HB2       LEU  63  -0.019 -12.436  -4.367
  492   2HB   LEU  63          HB1       LEU  63   0.297 -13.854  -3.364
  493    HG   LEU  63           HG       LEU  63  -0.575 -11.141  -2.331
  494   1HD1  LEU  63          HD11      LEU  63  -2.383 -12.235  -3.541
  495   2HD1  LEU  63          HD12      LEU  63  -2.705 -12.338  -1.811
  496   3HD1  LEU  63          HD13      LEU  63  -2.089 -13.744  -2.679
  497   1HD2  LEU  63          HD21      LEU  63   0.576 -12.070  -0.530
  498   2HD2  LEU  63          HD22      LEU  63   0.209 -13.727  -1.008
  499   3HD2  LEU  63          HD23      LEU  63  -1.035 -12.729  -0.255
  500    H    GLU  64           HN       GLU  64   2.854 -11.074  -5.115
  501    HA   GLU  64           HA       GLU  64   3.888 -13.548  -6.344
  502   1HB   GLU  64          HB2       GLU  64   3.833 -10.641  -7.174
  503   2HB   GLU  64          HB1       GLU  64   4.848 -11.804  -8.027
  504   1HG   GLU  64          HG2       GLU  64   1.883 -12.206  -7.579
  505   2HG   GLU  64          HG1       GLU  64   2.552 -11.471  -9.035
  506    H    GLU  65           HN       GLU  65   4.817 -12.687  -3.759
  507    HA   GLU  65           HA       GLU  65   6.864 -12.509  -2.549
  508   1HB   GLU  65          HB2       GLU  65   7.718 -13.843  -5.112
  509   2HB   GLU  65          HB1       GLU  65   8.732 -13.708  -3.675
  510   1HG   GLU  65          HG2       GLU  65   7.091 -14.937  -2.352
  511   2HG   GLU  65          HG1       GLU  65   5.987 -14.995  -3.727
  512    H    VAL  66           HN       VAL  66   6.176 -10.169  -4.341
  513    HA   VAL  66           HA       VAL  66   8.845  -9.242  -5.275
  514    HB   VAL  66           HB       VAL  66   5.996  -8.386  -5.636
  515   1HG1  VAL  66          HG11      VAL  66   6.828  -6.283  -4.876
  516   2HG1  VAL  66          HG12      VAL  66   6.882  -6.198  -6.636
  517   3HG1  VAL  66          HG13      VAL  66   8.359  -6.502  -5.721
  518   1HG2  VAL  66          HG21      VAL  66   6.592  -8.370  -7.939
  519   2HG2  VAL  66          HG22      VAL  66   7.451  -9.754  -7.261
  520   3HG2  VAL  66          HG23      VAL  66   8.312  -8.250  -7.574
  521    H    SER  67           HN       SER  67   9.926  -7.476  -4.256
  522    HA   SER  67           HA       SER  67   9.736  -7.223  -1.475
  523   1HB   SER  67          HB2       SER  67  10.677  -4.866  -3.088
  524   2HB   SER  67          HB1       SER  67  11.378  -5.568  -1.636
  525    HG   SER  67           HG       SER  67  11.768  -7.468  -3.037
  526    HA   PRO  68           HA       PRO  68   6.146  -4.708  -0.846
  527   1HB   PRO  68          HB2       PRO  68   7.087  -3.184   1.382
  528   2HB   PRO  68          HB1       PRO  68   6.227  -4.718   1.451
  529   1HG   PRO  68          HG2       PRO  68   9.084  -4.193   1.915
  530   2HG   PRO  68          HG1       PRO  68   8.133  -5.624   2.344
  531   1HD   PRO  68          HD2       PRO  68  10.019  -5.452   0.232
  532   2HD   PRO  68          HD1       PRO  68   8.836  -6.752   0.489
  533    H    GLU  69           HN       GLU  69   9.260  -2.941  -0.715
  534    HA   GLU  69           HA       GLU  69   8.034  -0.363  -1.239
  535   1HB   GLU  69          HB2       GLU  69  10.078  -0.341  -0.045
  536   2HB   GLU  69          HB1       GLU  69  10.872  -1.391  -1.217
  537   1HG   GLU  69          HG2       GLU  69  11.057   0.327  -2.819
  538   2HG   GLU  69          HG1       GLU  69   9.831   1.322  -2.031
  539    H    LEU  70           HN       LEU  70   9.058  -2.966  -3.261
  540    HA   LEU  70           HA       LEU  70   9.503  -1.320  -5.605
  541   1HB   LEU  70          HB2       LEU  70   9.009  -4.287  -5.245
  542   2HB   LEU  70          HB1       LEU  70   9.183  -3.582  -6.837
  543    HG   LEU  70           HG       LEU  70  11.225  -3.224  -4.670
  544   1HD1  LEU  70          HD11      LEU  70  11.416  -5.188  -6.956
  545   2HD1  LEU  70          HD12      LEU  70  10.856  -5.657  -5.352
  546   3HD1  LEU  70          HD13      LEU  70  12.493  -5.043  -5.569
  547   1HD2  LEU  70          HD21      LEU  70  12.673  -2.907  -6.846
  548   2HD2  LEU  70          HD22      LEU  70  11.682  -1.577  -6.262
  549   3HD2  LEU  70          HD23      LEU  70  11.117  -2.573  -7.596
  550    H    VAL  71           HN       VAL  71   6.785  -2.312  -3.880
  551    HA   VAL  71           HA       VAL  71   4.888  -2.435  -6.013
  552    HB   VAL  71           HB       VAL  71   4.647  -1.946  -3.036
  553   1HG1  VAL  71          HG11      VAL  71   2.429  -1.684  -5.072
  554   2HG1  VAL  71          HG12      VAL  71   2.817  -0.599  -3.736
  555   3HG1  VAL  71          HG13      VAL  71   2.096  -2.168  -3.409
  556   1HG2  VAL  71          HG21      VAL  71   5.020  -4.234  -3.732
  557   2HG2  VAL  71          HG22      VAL  71   3.712  -4.132  -4.911
  558   3HG2  VAL  71          HG23      VAL  71   3.350  -4.087  -3.185
  559    H    CYS  72           HN       CYS  72   5.534   0.379  -3.815
  560    HA   CYS  72           HA       CYS  72   3.761   1.991  -5.318
  561   1HB   CYS  72          HB2       CYS  72   5.095   2.353  -2.971
  562   2HB   CYS  72          HB1       CYS  72   6.062   3.397  -4.002
  563    H    SER  73           HN       SER  73   7.115   1.135  -5.824
  564    HA   SER  73           HA       SER  73   7.601   3.237  -7.817
  565   1HB   SER  73          HB2       SER  73   9.360   1.903  -6.421
  566   2HB   SER  73          HB1       SER  73   9.183   0.679  -7.677
  567    HG   SER  73           HG       SER  73  10.534   1.885  -8.740
  568    H    MET  74           HN       MET  74   6.627  -0.195  -8.049
  569    HA   MET  74           HA       MET  74   6.734  -0.207 -10.972
  570   1HB   MET  74          HB2       MET  74   5.847  -2.071  -8.832
  571   2HB   MET  74          HB1       MET  74   4.989  -2.237 -10.362
  572   1HG   MET  74          HG2       MET  74   7.357  -2.296 -11.438
  573   2HG   MET  74          HG1       MET  74   7.927  -2.614  -9.807
  574   1HE   MET  74          HE1       MET  74   6.365  -4.254  -8.283
  575   2HE   MET  74          HE2       MET  74   5.604  -5.712  -8.905
  576   3HE   MET  74          HE3       MET  74   4.804  -4.157  -9.106
  577    H    LEU  75           HN       LEU  75   4.077   0.350  -8.622
  578    HA   LEU  75           HA       LEU  75   2.104   0.540 -10.742
  579   1HB   LEU  75          HB2       LEU  75   1.933   1.669  -7.933
  580   2HB   LEU  75          HB1       LEU  75   0.588   1.355  -9.026
  581    HG   LEU  75           HG       LEU  75   2.395  -0.689  -7.717
  582   1HD1  LEU  75          HD11      LEU  75   0.622   0.026  -6.268
  583   2HD1  LEU  75          HD12      LEU  75   0.164  -1.549  -6.913
  584   3HD1  LEU  75          HD13      LEU  75  -0.561  -0.083  -7.572
  585   1HD2  LEU  75          HD21      LEU  75   0.470  -0.955 -10.023
  586   2HD2  LEU  75          HD22      LEU  75   0.771  -2.316  -8.943
  587   3HD2  LEU  75          HD23      LEU  75   2.099  -1.617  -9.867
  588    H    HIS  76           HN       HIS  76   4.619   2.331 -10.683
  589    HA   HIS  76           HA       HIS  76   5.170   4.584 -11.136
  590   1HB   HIS  76          HB2       HIS  76   3.765   5.628 -12.873
  591   2HB   HIS  76          HB1       HIS  76   4.123   3.948 -13.261
  592    HD1  HIS  76           HD1      HIS  76   1.333   6.059 -11.767
  593    HD2  HIS  76           HD2      HIS  76   1.870   2.362 -13.615
  594    HE1  HIS  76           HE1      HIS  76  -0.982   5.100 -12.138
  595    H    LEU  77           HN       LEU  77   3.547   4.075  -8.667
  596    HA   LEU  77           HA       LEU  77   1.849   6.478  -8.510
  597   1HB   LEU  77          HB2       LEU  77   1.921   3.919  -7.211
  598   2HB   LEU  77          HB1       LEU  77   2.167   5.126  -5.959
  599    HG   LEU  77           HG       LEU  77   0.120   6.230  -6.524
  600   1HD1  LEU  77          HD11      LEU  77   0.357   4.765  -9.067
  601   2HD1  LEU  77          HD12      LEU  77  -0.461   6.282  -8.715
  602   3HD1  LEU  77          HD13      LEU  77  -1.280   4.757  -8.407
  603   1HD2  LEU  77          HD21      LEU  77   0.186   3.830  -5.324
  604   2HD2  LEU  77          HD22      LEU  77  -0.844   3.416  -6.691
  605   3HD2  LEU  77          HD23      LEU  77  -1.318   4.701  -5.593
  606    H    CYS  78           HN       CYS  78   5.082   5.604  -7.943
  607    HA   CYS  78           HA       CYS  78   5.525   8.184  -6.471
  608   1HB   CYS  78          HB2       CYS  78   6.792   5.473  -6.007
  609   2HB   CYS  78          HB1       CYS  78   7.591   6.960  -5.505
  610    H    SER  79           HN       SER  79   5.851   9.027  -8.693
  611    HA   SER  79           HA       SER  79   7.609   7.885 -10.532
  612   1HB   SER  79          HB2       SER  79   6.090   9.805 -11.043
  613   2HB   SER  79          HB1       SER  79   7.186  10.872 -10.169
  614    HG   SER  79           HG       SER  79   8.819   9.844 -11.687
  615    H    GLY  80           HN       GLY  80   8.431   9.203  -7.544
  616   1HA   GLY  80          HA2       GLY  80  10.679   8.976  -6.648
  617   2HA   GLY  80          HA1       GLY  80  11.326   9.151  -8.282
  618    H    LEU  81           HN       LEU  81  12.669  10.865  -7.066
  619    HA   LEU  81           HA       LEU  81  11.355  13.288  -6.192
  620   1HB   LEU  81          HB2       LEU  81  14.203  12.579  -6.908
  621   2HB   LEU  81          HB1       LEU  81  13.750  14.245  -6.545
  622    HG   LEU  81           HG       LEU  81  12.921  13.590  -4.350
  623   1HD1  LEU  81          HD11      LEU  81  13.540  10.806  -5.355
  624   2HD1  LEU  81          HD12      LEU  81  12.015  11.420  -4.716
  625   3HD1  LEU  81          HD13      LEU  81  13.384  11.163  -3.634
  626   1HD2  LEU  81          HD21      LEU  81  15.651  12.421  -4.973
  627   2HD2  LEU  81          HD22      LEU  81  15.061  12.784  -3.352
  628   3HD2  LEU  81          HD23      LEU  81  15.311  14.089  -4.513
  629    H    VAL  82           HN       VAL  82   9.906  13.647  -8.000
  630    HA   VAL  82           HA       VAL  82  11.140  14.489 -10.566
  631    HB   VAL  82           HB       VAL  82   8.682  14.706 -11.243
  632   1HG1  VAL  82          HG11      VAL  82   9.362  11.985 -10.106
  633   2HG1  VAL  82          HG12      VAL  82  10.139  12.624 -11.554
  634   3HG1  VAL  82          HG13      VAL  82   8.397  12.349 -11.537
  635   1HG2  VAL  82          HG21      VAL  82   8.228  13.308  -8.593
  636   2HG2  VAL  82          HG22      VAL  82   7.003  13.808  -9.759
  637   3HG2  VAL  82          HG23      VAL  82   7.907  15.023  -8.856
  638    HA   PRO  83           HA       PRO  83  11.090  18.806  -9.538
  639   1HB   PRO  83          HB2       PRO  83   9.570  19.555 -11.944
  640   2HB   PRO  83          HB1       PRO  83  11.256  19.915 -11.543
  641   1HG   PRO  83          HG2       PRO  83  10.317  17.974 -13.440
  642   2HG   PRO  83          HG1       PRO  83  11.991  18.246 -12.936
  643   1HD   PRO  83          HD2       PRO  83  10.332  15.975 -12.310
  644   2HD   PRO  83          HD1       PRO  83  11.985  16.284 -11.751
  645    H    ARG  84           HN       ARG  84   9.645  18.580  -7.760
  646    HA   ARG  84           HA       ARG  84   6.753  18.542  -8.227
  647   1HB   ARG  84          HB2       ARG  84   8.075  17.499  -6.229
  648   2HB   ARG  84          HB1       ARG  84   8.074  19.134  -5.576
  649   1HG   ARG  84          HG2       ARG  84   6.106  18.312  -4.639
  650   2HG   ARG  84          HG1       ARG  84   5.472  19.019  -6.123
  651   1HD   ARG  84          HD2       ARG  84   5.889  16.667  -7.160
  652   2HD   ARG  84          HD1       ARG  84   5.985  16.115  -5.488
  653    HE   ARG  84           HE       ARG  84   3.630  17.566  -5.563
  654   1HH1  ARG  84          HH21      ARG  84   5.038  14.998  -7.381
  655   2HH1  ARG  84          HH22      ARG  84   3.519  14.264  -7.774
  656   1HH2  ARG  84          HH11      ARG  84   1.637  16.622  -6.064
  657   2HH2  ARG  84          HH12      ARG  84   1.594  15.184  -7.028
  Start of MODEL   12
    1   1H    SER   1          HT1       SER   1   5.916  17.480  -1.783
    2   2H    SER   1          HT2       SER   1   6.581  15.947  -1.478
    3   3H    SER   1          HT3       SER   1   7.133  17.303  -0.616
    4    HA   SER   1           HA       SER   1   5.697  16.040   0.804
    5   1HB   SER   1          HB2       SER   1   5.568  18.482   1.000
    6   2HB   SER   1          HB1       SER   1   4.373  18.540  -0.292
    7    HG   SER   1           HG       SER   1   2.892  17.706   1.020
    8    H    ASP   2           HN       ASP   2   5.337  14.796  -1.771
    9    HA   ASP   2           HA       ASP   2   2.590  14.798  -2.597
   10   1HB   ASP   2          HB2       ASP   2   4.281  13.984  -4.104
   11   2HB   ASP   2          HB1       ASP   2   4.808  12.771  -2.939
   12    H    VAL   3           HN       VAL   3   0.979  14.222  -1.290
   13    HA   VAL   3           HA       VAL   3   1.279  12.520   1.021
   14    HB   VAL   3           HB       VAL   3  -0.901  13.073   1.525
   15   1HG1  VAL   3          HG11      VAL   3  -1.170  15.388   1.029
   16   2HG1  VAL   3          HG12      VAL   3  -0.274  15.243  -0.483
   17   3HG1  VAL   3          HG13      VAL   3   0.569  15.092   1.059
   18   1HG2  VAL   3          HG21      VAL   3  -2.568  13.780  -0.281
   19   2HG2  VAL   3          HG22      VAL   3  -2.123  12.074  -0.271
   20   3HG2  VAL   3          HG23      VAL   3  -1.411  13.164  -1.462
   21    H    TYR   4           HN       TYR   4   0.719  11.763  -2.360
   22    HA   TYR   4           HA       TYR   4  -0.907   9.468  -1.752
   23   1HB   TYR   4          HB2       TYR   4   0.350  10.625  -4.218
   24   2HB   TYR   4          HB1       TYR   4  -0.073   8.925  -4.290
   25    HD1  TYR   4           HD1      TYR   4  -2.488   8.290  -3.493
   26    HD2  TYR   4           HD2      TYR   4  -1.295  12.239  -4.683
   27    HE1  TYR   4           HE1      TYR   4  -4.847   8.851  -3.973
   28    HE2  TYR   4           HE2      TYR   4  -3.662  12.813  -5.141
   29    HH   TYR   4           HH       TYR   4  -6.064  10.561  -5.485
   30    H    CYS   5           HN       CYS   5   2.514   9.773  -2.695
   31    HA   CYS   5           HA       CYS   5   3.121   6.988  -2.609
   32   1HB   CYS   5          HB2       CYS   5   4.591   9.095  -3.301
   33   2HB   CYS   5          HB1       CYS   5   5.170   8.972  -1.642
   34    H    GLU   6           HN       GLU   6   3.188   9.450   0.023
   35    HA   GLU   6           HA       GLU   6   4.240   7.793   2.040
   36   1HB   GLU   6          HB2       GLU   6   2.048   9.845   2.425
   37   2HB   GLU   6          HB1       GLU   6   3.198   9.283   3.640
   38   1HG   GLU   6          HG2       GLU   6   3.940  10.704   1.071
   39   2HG   GLU   6          HG1       GLU   6   3.874  11.463   2.664
   40    H    VAL   7           HN       VAL   7   0.882   8.083   0.909
   41    HA   VAL   7           HA       VAL   7  -0.140   6.245   2.918
   42    HB   VAL   7           HB       VAL   7  -1.245   7.284   0.284
   43   1HG1  VAL   7          HG11      VAL   7  -2.437   5.366   2.287
   44   2HG1  VAL   7          HG12      VAL   7  -2.367   5.220   0.532
   45   3HG1  VAL   7          HG13      VAL   7  -3.466   6.381   1.276
   46   1HG2  VAL   7          HG21      VAL   7  -2.894   8.346   2.073
   47   2HG2  VAL   7          HG22      VAL   7  -1.328   9.088   1.770
   48   3HG2  VAL   7          HG23      VAL   7  -1.553   8.061   3.182
   49    H    CYS   8           HN       CYS   8   1.030   5.715  -0.434
   50    HA   CYS   8           HA       CYS   8   0.160   2.985  -0.601
   51   1HB   CYS   8          HB2       CYS   8   0.930   4.094  -2.579
   52   2HB   CYS   8          HB1       CYS   8   2.500   4.422  -1.870
   53    H    GLU   9           HN       GLU   9   3.221   4.407   0.641
   54    HA   GLU   9           HA       GLU   9   4.347   1.856   1.284
   55   1HB   GLU   9          HB2       GLU   9   4.908   4.707   2.063
   56   2HB   GLU   9          HB1       GLU   9   5.656   3.428   3.017
   57   1HG   GLU   9          HG2       GLU   9   6.665   2.476   0.997
   58   2HG   GLU   9          HG1       GLU   9   5.876   3.703   0.008
   59    H    PHE  10           HN       PHE  10   2.091   4.037   2.987
   60    HA   PHE  10           HA       PHE  10   2.391   2.732   5.519
   61   1HB   PHE  10          HB2       PHE  10   1.367   4.965   5.331
   62   2HB   PHE  10          HB1       PHE  10   0.018   4.268   4.428
   63    HD1  PHE  10           HD1      PHE  10   1.674   4.473   7.713
   64    HD2  PHE  10           HD2      PHE  10  -1.644   2.875   5.510
   65    HE1  PHE  10           HE1      PHE  10   0.586   3.813   9.844
   66    HE2  PHE  10           HE2      PHE  10  -2.741   2.215   7.640
   67    HZ   PHE  10           HZ       PHE  10  -1.626   2.690   9.804
   68    H    LEU  11           HN       LEU  11   0.006   2.318   2.870
   69    HA   LEU  11           HA       LEU  11  -1.466   0.198   4.123
   70   1HB   LEU  11          HB2       LEU  11  -0.961   0.631   1.153
   71   2HB   LEU  11          HB1       LEU  11  -2.203  -0.427   1.846
   72    HG   LEU  11           HG       LEU  11  -2.078   2.522   2.537
   73   1HD1  LEU  11          HD11      LEU  11  -3.850   2.810   0.756
   74   2HD1  LEU  11          HD12      LEU  11  -3.427   1.202   0.168
   75   3HD1  LEU  11          HD13      LEU  11  -2.231   2.497   0.130
   76   1HD2  LEU  11          HD21      LEU  11  -3.534   1.250   3.967
   77   2HD2  LEU  11          HD22      LEU  11  -4.229   0.382   2.598
   78   3HD2  LEU  11          HD23      LEU  11  -4.568   2.096   2.820
   79    H    VAL  12           HN       VAL  12   1.439   0.129   2.003
   80    HA   VAL  12           HA       VAL  12   1.598  -2.701   1.812
   81    HB   VAL  12           HB       VAL  12   3.592  -0.437   1.619
   82   1HG1  VAL  12          HG11      VAL  12   5.187  -2.188   0.704
   83   2HG1  VAL  12          HG12      VAL  12   4.148  -3.403   1.453
   84   3HG1  VAL  12          HG13      VAL  12   4.972  -2.205   2.450
   85   1HG2  VAL  12          HG21      VAL  12   1.905  -0.887  -0.193
   86   2HG2  VAL  12          HG22      VAL  12   2.638  -2.476  -0.414
   87   3HG2  VAL  12          HG23      VAL  12   3.578  -1.017  -0.734
   88    H    LYS  13           HN       LYS  13   3.144  -0.480   4.192
   89    HA   LYS  13           HA       LYS  13   4.527  -2.483   5.662
   90   1HB   LYS  13          HB2       LYS  13   5.062  -0.198   6.093
   91   2HB   LYS  13          HB1       LYS  13   3.390   0.200   6.482
   92   1HG   LYS  13          HG2       LYS  13   3.530  -0.665   8.625
   93   2HG   LYS  13          HG1       LYS  13   4.655  -1.939   8.156
   94   1HD   LYS  13          HD2       LYS  13   5.786  -0.323   9.604
   95   2HD   LYS  13          HD1       LYS  13   6.467  -0.248   7.980
   96   1HE   LYS  13          HE2       LYS  13   5.145   1.723   7.460
   97   2HE   LYS  13          HE1       LYS  13   4.304   1.608   9.007
   98   1HZ   LYS  13          HZ1       LYS  13   7.244   1.856   8.863
   99   2HZ   LYS  13          HZ2       LYS  13   6.216   2.176  10.178
  100   3HZ   LYS  13          HZ3       LYS  13   6.241   3.223   8.840
  101    H    GLU  14           HN       GLU  14   1.215  -1.270   6.041
  102    HA   GLU  14           HA       GLU  14   0.670  -2.876   8.395
  103   1HB   GLU  14          HB2       GLU  14  -1.121  -1.464   6.408
  104   2HB   GLU  14          HB1       GLU  14  -1.758  -2.384   7.772
  105   1HG   GLU  14          HG2       GLU  14  -0.115  -0.896   9.198
  106   2HG   GLU  14          HG1       GLU  14  -0.151   0.165   7.792
  107    H    VAL  15           HN       VAL  15   0.132  -3.369   4.905
  108    HA   VAL  15           HA       VAL  15  -1.408  -5.749   5.285
  109    HB   VAL  15           HB       VAL  15   0.152  -4.639   2.945
  110   1HG1  VAL  15          HG11      VAL  15  -1.341  -7.273   3.114
  111   2HG1  VAL  15          HG12      VAL  15   0.354  -7.041   2.681
  112   3HG1  VAL  15          HG13      VAL  15  -0.919  -6.485   1.595
  113   1HG2  VAL  15          HG21      VAL  15  -2.096  -3.710   3.728
  114   2HG2  VAL  15          HG22      VAL  15  -2.796  -5.253   3.236
  115   3HG2  VAL  15          HG23      VAL  15  -2.019  -4.216   2.040
  116    H    THR  16           HN       THR  16   2.143  -5.282   4.873
  117    HA   THR  16           HA       THR  16   2.589  -8.089   4.706
  118    HB   THR  16           HB       THR  16   4.821  -7.752   4.794
  119    HG1  THR  16           HG1      THR  16   5.737  -6.051   6.111
  120   1HG2  THR  16          HG21      THR  16   5.257  -5.983   3.414
  121   2HG2  THR  16          HG22      THR  16   4.471  -4.831   4.485
  122   3HG2  THR  16          HG23      THR  16   3.505  -5.825   3.400
  123    H    LYS  17           HN       LYS  17   2.388  -5.962   7.571
  124    HA   LYS  17           HA       LYS  17   3.258  -7.999   9.377
  125   1HB   LYS  17          HB2       LYS  17   3.129  -5.841  10.358
  126   2HB   LYS  17          HB1       LYS  17   1.491  -5.570   9.759
  127   1HG   LYS  17          HG2       LYS  17   0.535  -7.027  11.354
  128   2HG   LYS  17          HG1       LYS  17   2.068  -7.829  11.680
  129   1HD   LYS  17          HD2       LYS  17   2.909  -5.746  12.731
  130   2HD   LYS  17          HD1       LYS  17   1.335  -4.993  12.453
  131   1HE   LYS  17          HE2       LYS  17   0.231  -6.526  13.912
  132   2HE   LYS  17          HE1       LYS  17   1.626  -7.604  13.963
  133   1HZ   LYS  17          HZ1       LYS  17   1.037  -5.473  15.663
  134   2HZ   LYS  17          HZ2       LYS  17   2.419  -5.033  14.779
  135   3HZ   LYS  17          HZ3       LYS  17   2.407  -6.473  15.682
  136    H    LEU  18           HN       LEU  18   0.255  -7.213   7.806
  137    HA   LEU  18           HA       LEU  18  -1.429  -9.076   9.270
  138   1HB   LEU  18          HB2       LEU  18  -1.712  -7.690   6.590
  139   2HB   LEU  18          HB1       LEU  18  -2.950  -8.696   7.265
  140    HG   LEU  18           HG       LEU  18  -2.476  -5.887   7.739
  141   1HD1  LEU  18          HD11      LEU  18  -4.627  -5.947   8.788
  142   2HD1  LEU  18          HD12      LEU  18  -4.502  -7.676   9.079
  143   3HD1  LEU  18          HD13      LEU  18  -4.659  -7.072   7.428
  144   1HD2  LEU  18          HD21      LEU  18  -2.490  -5.698  10.134
  145   2HD2  LEU  18          HD22      LEU  18  -1.090  -6.661   9.714
  146   3HD2  LEU  18          HD23      LEU  18  -2.538  -7.440  10.348
  147    H    ILE  19           HN       ILE  19   0.514  -9.199   6.348
  148    HA   ILE  19           HA       ILE  19  -0.320 -11.869   5.583
  149    HB   ILE  19           HB       ILE  19   2.141 -10.213   4.886
  150   1HG1  ILE  19          HG12      ILE  19  -0.317 -10.967   3.262
  151   2HG1  ILE  19          HG11      ILE  19  -0.080  -9.415   4.039
  152   1HG2  ILE  19          HG21      ILE  19   2.748 -12.546   4.664
  153   2HG2  ILE  19          HG22      ILE  19   2.476 -11.885   3.057
  154   3HG2  ILE  19          HG23      ILE  19   1.244 -12.898   3.812
  155   1HD1  ILE  19          HD11      ILE  19   2.052  -9.162   2.707
  156   2HD1  ILE  19          HD12      ILE  19   0.583  -9.167   1.736
  157   3HD1  ILE  19          HD13      ILE  19   1.589 -10.611   1.818
  158    H    ASP  20           HN       ASP  20   2.111 -10.421   7.633
  159    HA   ASP  20           HA       ASP  20   3.574 -12.882   8.133
  160   1HB   ASP  20          HB2       ASP  20   4.529 -10.556   8.349
  161   2HB   ASP  20          HB1       ASP  20   3.541 -10.355   9.797
  162    H    ASN  21           HN       ASN  21   0.705 -11.393   9.518
  163    HA   ASN  21           HA       ASN  21   0.951 -13.103  11.913
  164   1HB   ASN  21          HB2       ASN  21   0.030 -10.767  12.138
  165   2HB   ASN  21          HB1       ASN  21  -1.350 -11.259  11.155
  166   1HD2  ASN  21          HD21      ASN  21  -2.711 -13.092  12.068
  167   2HD2  ASN  21          HD22      ASN  21  -2.806 -13.268  13.753
  168    H    ASN  22           HN       ASN  22   0.041 -13.663   8.837
  169    HA   ASN  22           HA       ASN  22  -0.794 -15.678   7.980
  170   1HB   ASN  22          HB2       ASN  22  -0.303 -16.472  10.444
  171   2HB   ASN  22          HB1       ASN  22  -2.059 -16.475  10.585
  172   1HD2  ASN  22          HD21      ASN  22  -0.001 -18.767  10.375
  173   2HD2  ASN  22          HD22      ASN  22  -0.603 -19.740   9.121
  174    H    LYS  23           HN       LYS  23  -2.418 -13.267   7.813
  175    HA   LYS  23           HA       LYS  23  -5.183 -14.227   8.339
  176   1HB   LYS  23          HB2       LYS  23  -4.477 -11.611   7.131
  177   2HB   LYS  23          HB1       LYS  23  -5.926 -12.039   8.022
  178   1HG   LYS  23          HG2       LYS  23  -3.792 -12.542   9.824
  179   2HG   LYS  23          HG1       LYS  23  -3.375 -11.020   9.054
  180   1HD   LYS  23          HD2       LYS  23  -5.470 -10.016   9.765
  181   2HD   LYS  23          HD1       LYS  23  -6.068 -11.580  10.328
  182   1HE   LYS  23          HE2       LYS  23  -4.154 -11.648  11.954
  183   2HE   LYS  23          HE1       LYS  23  -3.764  -9.996  11.477
  184   1HZ   LYS  23          HZ1       LYS  23  -5.334 -10.462  13.486
  185   2HZ   LYS  23          HZ2       LYS  23  -6.514 -10.627  12.275
  186   3HZ   LYS  23          HZ3       LYS  23  -5.650  -9.172  12.431
  187    H    THR  24           HN       THR  24  -6.702 -14.446   6.588
  188    HA   THR  24           HA       THR  24  -5.524 -15.315   4.045
  189    HB   THR  24           HB       THR  24  -7.584 -16.272   3.601
  190    HG1  THR  24           HG1      THR  24  -8.655 -14.048   4.981
  191   1HG2  THR  24          HG21      THR  24  -6.812 -16.955   5.905
  192   2HG2  THR  24          HG22      THR  24  -8.544 -17.132   5.624
  193   3HG2  THR  24          HG23      THR  24  -7.938 -15.767   6.559
  194    H    GLU  25           HN       GLU  25  -6.409 -14.547   1.968
  195    HA   GLU  25           HA       GLU  25  -6.034 -11.741   1.594
  196   1HB   GLU  25          HB2       GLU  25  -5.993 -13.636  -0.175
  197   2HB   GLU  25          HB1       GLU  25  -7.745 -13.460  -0.224
  198   1HG   GLU  25          HG2       GLU  25  -7.277 -10.937  -0.596
  199   2HG   GLU  25          HG1       GLU  25  -5.633 -11.447  -0.981
  200    H    LYS  26           HN       LYS  26  -9.008 -13.677   1.907
  201    HA   LYS  26           HA       LYS  26 -10.907 -11.620   1.574
  202   1HB   LYS  26          HB2       LYS  26 -10.868 -14.277   2.921
  203   2HB   LYS  26          HB1       LYS  26 -12.169 -13.190   3.400
  204   1HG   LYS  26          HG2       LYS  26 -12.774 -12.905   0.996
  205   2HG   LYS  26          HG1       LYS  26 -11.532 -14.083   0.570
  206   1HD   LYS  26          HD2       LYS  26 -12.659 -15.779   1.957
  207   2HD   LYS  26          HD1       LYS  26 -13.901 -14.603   2.386
  208   1HE   LYS  26          HE2       LYS  26 -14.540 -16.162   0.497
  209   2HE   LYS  26          HE1       LYS  26 -14.651 -14.446   0.103
  210   1HZ   LYS  26          HZ1       LYS  26 -12.521 -14.557  -0.973
  211   2HZ   LYS  26          HZ2       LYS  26 -13.532 -15.754  -1.628
  212   3HZ   LYS  26          HZ3       LYS  26 -12.320 -16.177  -0.517
  213    H    GLU  27           HN       GLU  27  -8.960 -12.381   4.410
  214    HA   GLU  27           HA       GLU  27 -10.493 -10.619   6.150
  215   1HB   GLU  27          HB2       GLU  27  -7.778 -11.918   6.426
  216   2HB   GLU  27          HB1       GLU  27  -8.474 -10.866   7.655
  217   1HG   GLU  27          HG2       GLU  27 -10.388 -12.339   7.896
  218   2HG   GLU  27          HG1       GLU  27  -9.800 -13.360   6.587
  219    H    ILE  28           HN       ILE  28  -7.543 -10.247   4.184
  220    HA   ILE  28           HA       ILE  28  -6.808  -7.698   5.274
  221    HB   ILE  28           HB       ILE  28  -6.280  -8.636   2.442
  222   1HG1  ILE  28          HG12      ILE  28  -5.491  -9.820   5.030
  223   2HG1  ILE  28          HG11      ILE  28  -5.539 -10.557   3.459
  224   1HG2  ILE  28          HG21      ILE  28  -5.551  -6.346   3.070
  225   2HG2  ILE  28          HG22      ILE  28  -4.195  -7.399   2.688
  226   3HG2  ILE  28          HG23      ILE  28  -4.577  -7.028   4.370
  227   1HD1  ILE  28          HD11      ILE  28  -3.264 -10.551   4.292
  228   2HD1  ILE  28          HD12      ILE  28  -3.327  -8.809   4.561
  229   3HD1  ILE  28          HD13      ILE  28  -3.369  -9.447   2.916
  230    H    LEU  29           HN       LEU  29  -8.917  -8.641   2.572
  231    HA   LEU  29           HA       LEU  29  -9.455  -5.909   1.786
  232   1HB   LEU  29          HB2       LEU  29 -11.126  -8.390   1.287
  233   2HB   LEU  29          HB1       LEU  29 -11.149  -6.891   0.355
  234    HG   LEU  29           HG       LEU  29  -8.724  -8.706   0.652
  235   1HD1  LEU  29          HD11      LEU  29  -9.224  -9.084  -1.846
  236   2HD1  LEU  29          HD12      LEU  29 -10.821  -8.412  -1.518
  237   3HD1  LEU  29          HD13      LEU  29 -10.300  -9.884  -0.702
  238   1HD2  LEU  29          HD21      LEU  29  -7.902  -6.538   0.196
  239   2HD2  LEU  29          HD22      LEU  29  -9.280  -6.119  -0.821
  240   3HD2  LEU  29          HD23      LEU  29  -8.053  -7.238  -1.413
  241    H    ASP  30           HN       ASP  30 -10.833  -8.151   4.091
  242    HA   ASP  30           HA       ASP  30 -13.283  -6.679   4.589
  243   1HB   ASP  30          HB2       ASP  30 -12.865  -9.074   5.284
  244   2HB   ASP  30          HB1       ASP  30 -11.776  -8.461   6.528
  245    H    ALA  31           HN       ALA  31 -10.072  -6.679   6.139
  246    HA   ALA  31           HA       ALA  31 -10.744  -4.725   8.130
  247   1HB   ALA  31          HB1       ALA  31  -7.997  -5.267   6.984
  248   2HB   ALA  31          HB2       ALA  31  -8.780  -6.313   8.166
  249   3HB   ALA  31          HB3       ALA  31  -8.387  -4.650   8.591
  250    H    PHE  32           HN       PHE  32  -9.861  -4.391   4.746
  251    HA   PHE  32           HA       PHE  32  -8.856  -1.733   4.671
  252   1HB   PHE  32          HB2       PHE  32 -10.552  -3.378   2.810
  253   2HB   PHE  32          HB1       PHE  32 -10.146  -1.721   2.414
  254    HD1  PHE  32           HD1      PHE  32  -7.559  -3.453   4.381
  255    HD2  PHE  32           HD2      PHE  32  -9.054  -2.785   0.390
  256    HE1  PHE  32           HE1      PHE  32  -5.384  -4.100   3.454
  257    HE2  PHE  32           HE2      PHE  32  -6.855  -3.468  -0.525
  258    HZ   PHE  32           HZ       PHE  32  -5.024  -4.125   1.009
  259    H    ASP  33           HN       ASP  33 -11.931  -2.877   5.684
  260    HA   ASP  33           HA       ASP  33 -13.401  -0.448   5.013
  261   1HB   ASP  33          HB2       ASP  33 -14.098  -2.730   6.883
  262   2HB   ASP  33          HB1       ASP  33 -15.211  -1.470   6.346
  263    H    LYS  34           HN       LYS  34 -11.352  -1.429   7.643
  264    HA   LYS  34           HA       LYS  34 -12.122   1.072   9.101
  265   1HB   LYS  34          HB2       LYS  34 -11.574  -0.194  11.232
  266   2HB   LYS  34          HB1       LYS  34 -13.066  -0.682  10.428
  267   1HG   LYS  34          HG2       LYS  34 -11.998  -2.619   9.467
  268   2HG   LYS  34          HG1       LYS  34 -10.412  -2.081  10.018
  269   1HD   LYS  34          HD2       LYS  34 -11.192  -3.784  11.552
  270   2HD   LYS  34          HD1       LYS  34 -11.250  -2.231  12.382
  271   1HE   LYS  34          HE2       LYS  34 -13.599  -2.091  12.214
  272   2HE   LYS  34          HE1       LYS  34 -13.672  -3.299  10.931
  273   1HZ   LYS  34          HZ1       LYS  34 -13.775  -4.926  12.413
  274   2HZ   LYS  34          HZ2       LYS  34 -14.004  -3.744  13.612
  275   3HZ   LYS  34          HZ3       LYS  34 -12.444  -4.333  13.281
  276    H    MET  35           HN       MET  35  -9.787  -0.137   7.272
  277    HA   MET  35           HA       MET  35  -7.500   0.227   9.067
  278   1HB   MET  35          HB2       MET  35  -7.848  -1.100   6.680
  279   2HB   MET  35          HB1       MET  35  -6.991   0.323   6.130
  280   1HG   MET  35          HG2       MET  35  -5.162  -0.948   6.660
  281   2HG   MET  35          HG1       MET  35  -5.456  -0.338   8.278
  282   1HE   MET  35          HE1       MET  35  -5.808  -4.520   6.620
  283   2HE   MET  35          HE2       MET  35  -4.356  -3.526   6.734
  284   3HE   MET  35          HE3       MET  35  -5.701  -3.001   5.724
  285    H    CYS  36           HN       CYS  36  -9.093   2.172   6.457
  286    HA   CYS  36           HA       CYS  36  -7.134   4.262   6.671
  287   1HB   CYS  36          HB2       CYS  36  -9.075   3.919   4.877
  288   2HB   CYS  36          HB1       CYS  36  -9.995   4.927   5.987
  289    H    SER  37           HN       SER  37  -9.217   3.017   8.875
  290    HA   SER  37           HA       SER  37 -10.022   5.536  10.172
  291   1HB   SER  37          HB2       SER  37 -11.304   3.315  10.257
  292   2HB   SER  37          HB1       SER  37 -10.095   2.788  11.423
  293    HG   SER  37           HG       SER  37 -11.067   5.285  11.938
  294    H    LYS  38           HN       LYS  38  -7.030   4.488   9.857
  295    HA   LYS  38           HA       LYS  38  -6.289   5.040  12.724
  296   1HB   LYS  38          HB2       LYS  38  -5.126   3.117  10.715
  297   2HB   LYS  38          HB1       LYS  38  -4.112   3.770  12.003
  298   1HG   LYS  38          HG2       LYS  38  -5.447   2.810  13.705
  299   2HG   LYS  38          HG1       LYS  38  -6.807   2.548  12.614
  300   1HD   LYS  38          HD2       LYS  38  -5.569   0.445  13.152
  301   2HD   LYS  38          HD1       LYS  38  -5.582   0.813  11.429
  302   1HE   LYS  38          HE2       LYS  38  -3.327   0.109  12.377
  303   2HE   LYS  38          HE1       LYS  38  -3.335   1.635  11.495
  304   1HZ   LYS  38          HZ1       LYS  38  -3.807   1.631  14.397
  305   2HZ   LYS  38          HZ2       LYS  38  -3.159   2.856  13.414
  306   3HZ   LYS  38          HZ3       LYS  38  -2.220   1.497  13.812
  307    H    LEU  39           HN       LEU  39  -6.325   6.383   9.697
  308    HA   LEU  39           HA       LEU  39  -3.762   7.878  10.101
  309   1HB   LEU  39          HB2       LEU  39  -5.594   7.753   7.684
  310   2HB   LEU  39          HB1       LEU  39  -4.046   8.583   7.743
  311    HG   LEU  39           HG       LEU  39  -4.410   5.604   8.173
  312   1HD1  LEU  39          HD11      LEU  39  -4.898   6.532   5.836
  313   2HD1  LEU  39          HD12      LEU  39  -3.651   5.291   5.937
  314   3HD1  LEU  39          HD13      LEU  39  -3.197   6.984   5.780
  315   1HD2  LEU  39          HD21      LEU  39  -2.400   6.219   9.265
  316   2HD2  LEU  39          HD22      LEU  39  -2.020   7.449   8.059
  317   3HD2  LEU  39          HD23      LEU  39  -1.857   5.746   7.658
  318    HA   PRO  40           HA       PRO  40  -6.046  11.373  11.610
  319   1HB   PRO  40          HB2       PRO  40  -4.567  13.211   9.829
  320   2HB   PRO  40          HB1       PRO  40  -4.562  13.133  11.598
  321   1HG   PRO  40          HG2       PRO  40  -2.503  12.200   9.843
  322   2HG   PRO  40          HG1       PRO  40  -2.587  11.970  11.596
  323   1HD   PRO  40          HD2       PRO  40  -2.908   9.968   9.563
  324   2HD   PRO  40          HD1       PRO  40  -3.056   9.748  11.312
  325    H    LYS  41           HN       LYS  41  -7.725  12.951  10.755
  326    HA   LYS  41           HA       LYS  41  -9.126  11.840   8.497
  327   1HB   LYS  41          HB2       LYS  41 -10.074  13.255  10.439
  328   2HB   LYS  41          HB1       LYS  41  -9.509  14.648   9.518
  329   1HG   LYS  41          HG2       LYS  41 -10.868  13.991   7.602
  330   2HG   LYS  41          HG1       LYS  41 -11.365  12.511   8.424
  331   1HD   LYS  41          HD2       LYS  41 -12.390  13.920  10.224
  332   2HD   LYS  41          HD1       LYS  41 -12.001  15.352   9.270
  333   1HE   LYS  41          HE2       LYS  41 -13.902  13.110   8.573
  334   2HE   LYS  41          HE1       LYS  41 -14.251  14.834   8.703
  335   1HZ   LYS  41          HZ1       LYS  41 -12.565  13.518   6.644
  336   2HZ   LYS  41          HZ2       LYS  41 -12.753  15.199   6.804
  337   3HZ   LYS  41          HZ3       LYS  41 -14.087  14.226   6.404
  338    H    SER  42           HN       SER  42  -6.507  14.054   8.588
  339    HA   SER  42           HA       SER  42  -7.254  15.471   6.193
  340   1HB   SER  42          HB2       SER  42  -5.696  16.573   7.642
  341   2HB   SER  42          HB1       SER  42  -4.616  15.182   7.644
  342    HG   SER  42           HG       SER  42  -4.766  15.676   5.182
  343    H    LEU  43           HN       LEU  43  -6.036  12.340   6.530
  344    HA   LEU  43           HA       LEU  43  -5.239  12.342   3.622
  345   1HB   LEU  43          HB2       LEU  43  -4.479  10.211   5.622
  346   2HB   LEU  43          HB1       LEU  43  -3.793  10.500   4.027
  347    HG   LEU  43           HG       LEU  43  -3.515  12.257   6.458
  348   1HD1  LEU  43          HD11      LEU  43  -1.049  11.718   6.019
  349   2HD1  LEU  43          HD12      LEU  43  -1.646  10.426   4.976
  350   3HD1  LEU  43          HD13      LEU  43  -2.045  10.431   6.694
  351   1HD2  LEU  43          HD21      LEU  43  -3.596  13.726   4.558
  352   2HD2  LEU  43          HD22      LEU  43  -2.616  12.626   3.595
  353   3HD2  LEU  43          HD23      LEU  43  -1.890  13.510   4.936
  354    H    SER  44           HN       SER  44  -7.733  11.553   5.679
  355    HA   SER  44           HA       SER  44  -8.635   9.012   5.297
  356   1HB   SER  44          HB2       SER  44 -10.189  11.582   4.920
  357   2HB   SER  44          HB1       SER  44 -10.965  10.001   4.927
  358    HG   SER  44           HG       SER  44  -9.447   9.931   6.992
  359    H    GLU  45           HN       GLU  45  -9.672  11.455   2.998
  360    HA   GLU  45           HA       GLU  45 -10.743   9.899   1.067
  361   1HB   GLU  45          HB2       GLU  45  -9.283  12.515   0.723
  362   2HB   GLU  45          HB1       GLU  45 -10.485  11.851  -0.387
  363   1HG   GLU  45          HG2       GLU  45 -12.166  11.862   1.439
  364   2HG   GLU  45          HG1       GLU  45 -10.968  12.575   2.520
  365    H    GLU  46           HN       GLU  46  -7.457  11.219   0.780
  366    HA   GLU  46           HA       GLU  46  -6.889  10.121  -1.752
  367   1HB   GLU  46          HB2       GLU  46  -4.723  10.224   0.318
  368   2HB   GLU  46          HB1       GLU  46  -4.698  10.776  -1.354
  369   1HG   GLU  46          HG2       GLU  46  -5.979  12.142   1.023
  370   2HG   GLU  46          HG1       GLU  46  -4.687  12.749  -0.004
  371    H    CYS  47           HN       CYS  47  -7.159   8.556   1.337
  372    HA   CYS  47           HA       CYS  47  -5.659   6.189   0.474
  373   1HB   CYS  47          HB2       CYS  47  -5.948   5.442   2.654
  374   2HB   CYS  47          HB1       CYS  47  -6.254   7.156   2.935
  375    H    GLN  48           HN       GLN  48  -9.059   7.131   0.865
  376    HA   GLN  48           HA       GLN  48 -10.272   4.687   0.179
  377   1HB   GLN  48          HB2       GLN  48 -11.102   7.529  -0.482
  378   2HB   GLN  48          HB1       GLN  48 -12.130   6.128  -0.789
  379   1HG   GLN  48          HG2       GLN  48 -12.101   5.545   1.582
  380   2HG   GLN  48          HG1       GLN  48 -10.998   6.879   1.918
  381   1HE2  GLN  48          HE21      GLN  48 -13.157   7.215   3.393
  382   2HE2  GLN  48          HE22      GLN  48 -14.285   8.287   2.716
  383    H    GLU  49           HN       GLU  49  -9.064   7.257  -1.982
  384    HA   GLU  49           HA       GLU  49  -9.849   5.916  -4.385
  385   1HB   GLU  49          HB2       GLU  49  -9.360   8.329  -4.304
  386   2HB   GLU  49          HB1       GLU  49  -7.671   7.983  -3.948
  387   1HG   GLU  49          HG2       GLU  49  -8.985   6.827  -6.409
  388   2HG   GLU  49          HG1       GLU  49  -8.348   8.470  -6.422
  389    H    VAL  50           HN       VAL  50  -6.806   5.922  -2.519
  390    HA   VAL  50           HA       VAL  50  -5.367   4.332  -4.429
  391    HB   VAL  50           HB       VAL  50  -4.864   4.540  -1.454
  392   1HG1  VAL  50          HG11      VAL  50  -3.121   3.653  -3.759
  393   2HG1  VAL  50          HG12      VAL  50  -3.720   2.644  -2.441
  394   3HG1  VAL  50          HG13      VAL  50  -2.549   3.918  -2.114
  395   1HG2  VAL  50          HG21      VAL  50  -3.271   6.053  -3.505
  396   2HG2  VAL  50          HG22      VAL  50  -3.634   6.484  -1.834
  397   3HG2  VAL  50          HG23      VAL  50  -4.859   6.683  -3.083
  398    H    VAL  51           HN       VAL  51  -6.898   3.499  -1.286
  399    HA   VAL  51           HA       VAL  51  -6.444   0.736  -1.559
  400    HB   VAL  51           HB       VAL  51  -8.698   2.123  -0.053
  401   1HG1  VAL  51          HG11      VAL  51  -7.432  -0.603   0.218
  402   2HG1  VAL  51          HG12      VAL  51  -9.124  -0.231  -0.117
  403   3HG1  VAL  51          HG13      VAL  51  -8.439   0.122   1.469
  404   1HG2  VAL  51          HG21      VAL  51  -7.199   2.259   1.833
  405   2HG2  VAL  51          HG22      VAL  51  -6.355   2.948   0.447
  406   3HG2  VAL  51          HG23      VAL  51  -5.972   1.315   0.987
  407    H    ASP  52           HN       ASP  52  -9.410   2.534  -2.303
  408    HA   ASP  52           HA       ASP  52 -10.883   0.325  -3.279
  409   1HB   ASP  52          HB2       ASP  52 -11.128   3.228  -4.097
  410   2HB   ASP  52          HB1       ASP  52 -12.365   1.982  -4.276
  411    H    THR  53           HN       THR  53  -8.818   2.623  -5.062
  412    HA   THR  53           HA       THR  53  -9.401   1.275  -7.618
  413    HB   THR  53           HB       THR  53  -7.375   3.446  -7.077
  414    HG1  THR  53           HG1      THR  53 -10.163   3.523  -7.462
  415   1HG2  THR  53          HG21      THR  53  -7.666   3.929  -9.438
  416   2HG2  THR  53          HG22      THR  53  -8.947   2.723  -9.562
  417   3HG2  THR  53          HG23      THR  53  -7.286   2.217  -9.256
  418    H    TYR  54           HN       TYR  54  -6.626   1.561  -5.391
  419    HA   TYR  54           HA       TYR  54  -5.218  -0.461  -7.105
  420   1HB   TYR  54          HB2       TYR  54  -4.157   1.569  -5.153
  421   2HB   TYR  54          HB1       TYR  54  -3.167   0.340  -5.934
  422    HD1  TYR  54           HD1      TYR  54  -5.142   3.388  -6.436
  423    HD2  TYR  54           HD2      TYR  54  -2.696   0.438  -8.343
  424    HE1  TYR  54           HE1      TYR  54  -4.964   4.849  -8.411
  425    HE2  TYR  54           HE2      TYR  54  -2.509   1.893 -10.344
  426    HH   TYR  54           HH       TYR  54  -3.539   3.711 -11.396
  427    H    GLY  55           HN       GLY  55  -7.237  -1.133  -5.057
  428   1HA   GLY  55          HA2       GLY  55  -5.760  -2.181  -2.777
  429   2HA   GLY  55          HA1       GLY  55  -7.473  -2.421  -3.095
  430    H    SER  56           HN       SER  56  -7.629  -3.814  -5.414
  431    HA   SER  56           HA       SER  56  -6.711  -6.383  -4.601
  432   1HB   SER  56          HB2       SER  56  -7.401  -5.790  -7.471
  433   2HB   SER  56          HB1       SER  56  -7.732  -7.240  -6.523
  434    HG   SER  56           HG       SER  56  -9.026  -4.747  -6.530
  435    H    SER  57           HN       SER  57  -5.369  -3.901  -6.629
  436    HA   SER  57           HA       SER  57  -3.459  -5.673  -7.872
  437   1HB   SER  57          HB2       SER  57  -2.430  -3.591  -8.791
  438   2HB   SER  57          HB1       SER  57  -4.171  -3.639  -9.057
  439    HG   SER  57           HG       SER  57  -2.738  -1.816  -7.759
  440    H    ILE  58           HN       ILE  58  -3.154  -3.257  -5.261
  441    HA   ILE  58           HA       ILE  58  -0.356  -3.642  -4.777
  442    HB   ILE  58           HB       ILE  58  -2.668  -2.881  -2.966
  443   1HG1  ILE  58          HG12      ILE  58  -0.279  -1.315  -3.999
  444   2HG1  ILE  58          HG11      ILE  58  -1.887  -1.253  -4.709
  445   1HG2  ILE  58          HG21      ILE  58   0.259  -3.299  -2.315
  446   2HG2  ILE  58          HG22      ILE  58  -1.147  -3.917  -1.454
  447   3HG2  ILE  58          HG23      ILE  58  -0.741  -2.207  -1.358
  448   1HD1  ILE  58          HD11      ILE  58  -0.890  -0.093  -2.144
  449   2HD1  ILE  58          HD12      ILE  58  -2.558  -0.675  -2.162
  450   3HD1  ILE  58          HD13      ILE  58  -2.049   0.577  -3.294
  451    H    LEU  59           HN       LEU  59  -3.172  -5.042  -3.236
  452    HA   LEU  59           HA       LEU  59  -1.855  -6.984  -1.651
  453   1HB   LEU  59          HB2       LEU  59  -4.162  -6.355  -1.245
  454   2HB   LEU  59          HB1       LEU  59  -4.644  -6.913  -2.843
  455    HG   LEU  59           HG       LEU  59  -4.150  -9.217  -2.249
  456   1HD1  LEU  59          HD11      LEU  59  -3.567  -9.617   0.265
  457   2HD1  LEU  59          HD12      LEU  59  -3.028  -7.938   0.249
  458   3HD1  LEU  59          HD13      LEU  59  -2.271  -9.118  -0.816
  459   1HD2  LEU  59          HD21      LEU  59  -5.685  -9.313  -0.068
  460   2HD2  LEU  59          HD22      LEU  59  -6.355  -8.829  -1.621
  461   3HD2  LEU  59          HD23      LEU  59  -5.925  -7.606  -0.428
  462    H    SER  60           HN       SER  60  -2.651  -7.002  -5.104
  463    HA   SER  60           HA       SER  60  -2.380  -9.875  -5.212
  464   1HB   SER  60          HB2       SER  60  -3.771  -8.891  -6.891
  465   2HB   SER  60          HB1       SER  60  -2.512  -7.754  -7.365
  466    HG   SER  60           HG       SER  60  -2.073 -10.532  -7.518
  467    H    ILE  61           HN       ILE  61  -0.340  -7.074  -5.810
  468    HA   ILE  61           HA       ILE  61   1.890  -8.404  -7.047
  469    HB   ILE  61           HB       ILE  61   1.989  -5.911  -5.333
  470   1HG1  ILE  61          HG12      ILE  61   0.378  -6.310  -7.689
  471   2HG1  ILE  61          HG11      ILE  61   0.673  -4.809  -6.822
  472   1HG2  ILE  61          HG21      ILE  61   3.872  -5.320  -6.815
  473   2HG2  ILE  61          HG22      ILE  61   3.668  -6.846  -7.678
  474   3HG2  ILE  61          HG23      ILE  61   4.152  -6.847  -5.982
  475   1HD1  ILE  61          HD11      ILE  61   1.244  -4.631  -9.215
  476   2HD1  ILE  61          HD12      ILE  61   2.447  -5.902  -9.020
  477   3HD1  ILE  61          HD13      ILE  61   2.643  -4.362  -8.177
  478    H    LEU  62           HN       LEU  62   1.341  -7.336  -3.686
  479    HA   LEU  62           HA       LEU  62   3.788  -8.172  -2.639
  480   1HB   LEU  62          HB2       LEU  62   1.253  -7.309  -1.614
  481   2HB   LEU  62          HB1       LEU  62   1.739  -8.706  -0.661
  482    HG   LEU  62           HG       LEU  62   3.565  -6.343  -1.220
  483   1HD1  LEU  62          HD11      LEU  62   2.950  -5.360   0.804
  484   2HD1  LEU  62          HD12      LEU  62   2.252  -6.846   1.432
  485   3HD1  LEU  62          HD13      LEU  62   1.396  -5.924   0.201
  486   1HD2  LEU  62          HD21      LEU  62   4.930  -8.172  -0.631
  487   2HD2  LEU  62          HD22      LEU  62   3.735  -8.837   0.479
  488   3HD2  LEU  62          HD23      LEU  62   4.647  -7.403   0.924
  489    H    LEU  63           HN       LEU  63   1.027 -10.112  -3.536
  490    HA   LEU  63           HA       LEU  63   2.008 -12.516  -2.176
  491   1HB   LEU  63          HB2       LEU  63  -0.089 -12.205  -4.346
  492   2HB   LEU  63          HB1       LEU  63   0.203 -13.664  -3.398
  493    HG   LEU  63           HG       LEU  63  -0.629 -10.977  -2.268
  494   1HD1  LEU  63          HD11      LEU  63  -2.158 -13.550  -2.732
  495   2HD1  LEU  63          HD12      LEU  63  -2.463 -11.985  -3.485
  496   3HD1  LEU  63          HD13      LEU  63  -2.760 -12.207  -1.761
  497   1HD2  LEU  63          HD21      LEU  63   0.133 -13.615  -1.032
  498   2HD2  LEU  63          HD22      LEU  63  -1.095 -12.624  -0.242
  499   3HD2  LEU  63          HD23      LEU  63   0.522 -11.977  -0.503
  500    H    GLU  64           HN       GLU  64   2.800 -10.921  -5.097
  501    HA   GLU  64           HA       GLU  64   3.776 -13.401  -6.357
  502   1HB   GLU  64          HB2       GLU  64   3.802 -10.484  -7.158
  503   2HB   GLU  64          HB1       GLU  64   4.753 -11.681  -8.038
  504   1HG   GLU  64          HG2       GLU  64   2.654 -13.013  -8.364
  505   2HG   GLU  64          HG1       GLU  64   1.755 -11.678  -7.643
  506    H    GLU  65           HN       GLU  65   4.743 -12.609  -3.770
  507    HA   GLU  65           HA       GLU  65   6.805 -12.473  -2.583
  508   1HB   GLU  65          HB2       GLU  65   7.594 -13.795  -5.172
  509   2HB   GLU  65          HB1       GLU  65   8.645 -13.681  -3.761
  510   1HG   GLU  65          HG2       GLU  65   7.021 -14.897  -2.404
  511   2HG   GLU  65          HG1       GLU  65   5.886 -14.939  -3.754
  512    H    VAL  66           HN       VAL  66   6.135 -10.098  -4.344
  513    HA   VAL  66           HA       VAL  66   8.811  -9.217  -5.299
  514    HB   VAL  66           HB       VAL  66   5.981  -8.248  -5.583
  515   1HG1  VAL  66          HG11      VAL  66   8.435  -6.489  -5.723
  516   2HG1  VAL  66          HG12      VAL  66   6.927  -6.190  -4.859
  517   3HG1  VAL  66          HG13      VAL  66   6.964  -6.109  -6.619
  518   1HG2  VAL  66          HG21      VAL  66   7.328  -9.690  -7.249
  519   2HG2  VAL  66          HG22      VAL  66   8.231  -8.218  -7.602
  520   3HG2  VAL  66          HG23      VAL  66   6.494  -8.277  -7.901
  521    H    SER  67           HN       SER  67   9.968  -7.539  -4.263
  522    HA   SER  67           HA       SER  67   9.874  -7.322  -1.489
  523   1HB   SER  67          HB2       SER  67  10.757  -4.938  -3.088
  524   2HB   SER  67          HB1       SER  67  11.521  -5.676  -1.687
  525    HG   SER  67           HG       SER  67  11.746  -7.563  -3.211
  526    HA   PRO  68           HA       PRO  68   6.339  -4.810  -0.655
  527   1HB   PRO  68          HB2       PRO  68   7.331  -3.331   1.566
  528   2HB   PRO  68          HB1       PRO  68   6.518  -4.895   1.627
  529   1HG   PRO  68          HG2       PRO  68   9.380  -4.295   1.982
  530   2HG   PRO  68          HG1       PRO  68   8.484  -5.756   2.428
  531   1HD   PRO  68          HD2       PRO  68  10.266  -5.496   0.234
  532   2HD   PRO  68          HD1       PRO  68   9.138  -6.836   0.527
  533    H    GLU  69           HN       GLU  69   9.431  -2.944  -0.595
  534    HA   GLU  69           HA       GLU  69   8.002  -0.445  -1.106
  535   1HB   GLU  69          HB2       GLU  69  10.599   0.206  -1.643
  536   2HB   GLU  69          HB1       GLU  69   9.932   0.142  -0.016
  537   1HG   GLU  69          HG2       GLU  69  10.744  -2.126   0.292
  538   2HG   GLU  69          HG1       GLU  69  11.295  -2.196  -1.382
  539    H    LEU  70           HN       LEU  70   9.114  -2.982  -3.115
  540    HA   LEU  70           HA       LEU  70   9.568  -1.307  -5.449
  541   1HB   LEU  70          HB2       LEU  70   9.141  -4.284  -5.084
  542   2HB   LEU  70          HB1       LEU  70   9.259  -3.577  -6.683
  543    HG   LEU  70           HG       LEU  70  11.340  -3.219  -4.547
  544   1HD1  LEU  70          HD11      LEU  70  12.620  -4.966  -5.506
  545   2HD1  LEU  70          HD12      LEU  70  11.614  -5.012  -6.953
  546   3HD1  LEU  70          HD13      LEU  70  10.985  -5.622  -5.424
  547   1HD2  LEU  70          HD21      LEU  70  11.094  -2.327  -7.388
  548   2HD2  LEU  70          HD22      LEU  70  12.694  -2.765  -6.805
  549   3HD2  LEU  70          HD23      LEU  70  11.789  -1.485  -6.008
  550    H    VAL  71           HN       VAL  71   6.887  -2.382  -3.705
  551    HA   VAL  71           HA       VAL  71   4.960  -2.537  -5.805
  552    HB   VAL  71           HB       VAL  71   4.787  -2.095  -2.820
  553   1HG1  VAL  71          HG11      VAL  71   2.535  -1.705  -4.783
  554   2HG1  VAL  71          HG12      VAL  71   2.942  -0.730  -3.369
  555   3HG1  VAL  71          HG13      VAL  71   2.209  -2.315  -3.160
  556   1HG2  VAL  71          HG21      VAL  71   3.808  -4.242  -4.719
  557   2HG2  VAL  71          HG22      VAL  71   3.446  -4.221  -2.992
  558   3HG2  VAL  71          HG23      VAL  71   5.115  -4.371  -3.540
  559    H    CYS  72           HN       CYS  72   5.579   0.264  -3.593
  560    HA   CYS  72           HA       CYS  72   3.737   1.839  -5.055
  561   1HB   CYS  72          HB2       CYS  72   6.106   2.879  -3.456
  562   2HB   CYS  72          HB1       CYS  72   4.630   3.756  -3.827
  563    H    SER  73           HN       SER  73   7.116   1.104  -5.616
  564    HA   SER  73           HA       SER  73   7.505   3.256  -7.578
  565   1HB   SER  73          HB2       SER  73   9.330   1.971  -6.255
  566   2HB   SER  73          HB1       SER  73   9.146   0.730  -7.490
  567    HG   SER  73           HG       SER  73   9.889   3.448  -7.806
  568    H    MET  74           HN       MET  74   6.602  -0.190  -7.876
  569    HA   MET  74           HA       MET  74   6.709  -0.191 -10.807
  570   1HB   MET  74          HB2       MET  74   5.840  -2.064  -8.669
  571   2HB   MET  74          HB1       MET  74   5.001  -2.245 -10.207
  572   1HG   MET  74          HG2       MET  74   7.384  -2.262 -11.256
  573   2HG   MET  74          HG1       MET  74   7.937  -2.574  -9.617
  574   1HE   MET  74          HE1       MET  74   4.855  -4.171  -8.930
  575   2HE   MET  74          HE2       MET  74   6.414  -4.234  -8.112
  576   3HE   MET  74          HE3       MET  74   5.695  -5.715  -8.731
  577    H    LEU  75           HN       LEU  75   4.020   0.301  -8.497
  578    HA   LEU  75           HA       LEU  75   2.057   0.450 -10.620
  579   1HB   LEU  75          HB2       LEU  75   1.858   1.628  -7.841
  580   2HB   LEU  75          HB1       LEU  75   0.521   1.245  -8.923
  581    HG   LEU  75           HG       LEU  75   2.419  -0.707  -7.600
  582   1HD1  LEU  75          HD11      LEU  75  -0.529  -0.137  -7.355
  583   2HD1  LEU  75          HD12      LEU  75   0.698  -0.084  -6.090
  584   3HD1  LEU  75          HD13      LEU  75   0.197  -1.632  -6.768
  585   1HD2  LEU  75          HD21      LEU  75   0.457  -1.071  -9.859
  586   2HD2  LEU  75          HD22      LEU  75   0.803  -2.402  -8.758
  587   3HD2  LEU  75          HD23      LEU  75   2.102  -1.695  -9.714
  588    H    HIS  76           HN       HIS  76   4.539   2.300 -10.581
  589    HA   HIS  76           HA       HIS  76   5.039   4.518 -11.137
  590   1HB   HIS  76          HB2       HIS  76   2.322   4.298 -12.479
  591   2HB   HIS  76          HB1       HIS  76   3.563   5.494 -12.859
  592    HD1  HIS  76           HD1      HIS  76   2.742   3.669 -15.120
  593    HD2  HIS  76           HD2      HIS  76   5.783   2.671 -12.449
  594    HE1  HIS  76           HE1      HIS  76   4.195   1.959 -16.295
  595    H    LEU  77           HN       LEU  77   3.348   4.024  -8.605
  596    HA   LEU  77           HA       LEU  77   1.754   6.504  -8.494
  597   1HB   LEU  77          HB2       LEU  77   2.287   4.269  -6.541
  598   2HB   LEU  77          HB1       LEU  77   1.496   5.743  -6.030
  599    HG   LEU  77           HG       LEU  77   0.516   3.735  -8.069
  600   1HD1  LEU  77          HD11      LEU  77   0.213   3.360  -5.573
  601   2HD1  LEU  77          HD12      LEU  77  -1.278   3.391  -6.512
  602   3HD1  LEU  77          HD13      LEU  77  -0.804   4.795  -5.567
  603   1HD2  LEU  77          HD21      LEU  77  -1.586   5.374  -7.949
  604   2HD2  LEU  77          HD22      LEU  77  -0.286   5.689  -9.090
  605   3HD2  LEU  77          HD23      LEU  77  -0.354   6.576  -7.567
  606    H    CYS  78           HN       CYS  78   5.006   5.683  -8.022
  607    HA   CYS  78           HA       CYS  78   5.399   8.263  -6.540
  608   1HB   CYS  78          HB2       CYS  78   6.001   5.782  -5.474
  609   2HB   CYS  78          HB1       CYS  78   7.540   6.225  -6.190
  610    H    SER  79           HN       SER  79   7.378   9.398  -7.134
  611    HA   SER  79           HA       SER  79   7.922   9.312  -9.942
  612   1HB   SER  79          HB2       SER  79   9.524  11.029  -9.535
  613   2HB   SER  79          HB1       SER  79   8.264  11.280  -8.329
  614    HG   SER  79           HG       SER  79   9.963  11.218  -7.051
  615    H    GLY  80           HN       GLY  80  10.026   8.329  -7.188
  616   1HA   GLY  80          HA2       GLY  80  10.936   5.911  -7.811
  617   2HA   GLY  80          HA1       GLY  80  11.732   6.823  -9.096
  618    H    LEU  81           HN       LEU  81  12.342   5.552  -6.148
  619    HA   LEU  81           HA       LEU  81  13.481   7.502  -4.533
  620   1HB   LEU  81          HB2       LEU  81  14.333   4.678  -5.150
  621   2HB   LEU  81          HB1       LEU  81  15.272   5.663  -4.033
  622    HG   LEU  81           HG       LEU  81  13.552   4.229  -2.906
  623   1HD1  LEU  81          HD11      LEU  81  13.091   5.801  -1.283
  624   2HD1  LEU  81          HD12      LEU  81  12.633   7.047  -2.441
  625   3HD1  LEU  81          HD13      LEU  81  14.336   6.678  -2.166
  626   1HD2  LEU  81          HD21      LEU  81  11.534   6.093  -4.184
  627   2HD2  LEU  81          HD22      LEU  81  11.208   4.680  -3.181
  628   3HD2  LEU  81          HD23      LEU  81  11.881   4.474  -4.797
  629    H    VAL  82           HN       VAL  82  14.494   6.694  -7.769
  630    HA   VAL  82           HA       VAL  82  17.209   7.671  -7.344
  631    HB   VAL  82           HB       VAL  82  17.368   7.465  -9.829
  632   1HG1  VAL  82          HG11      VAL  82  17.120   5.032  -9.886
  633   2HG1  VAL  82          HG12      VAL  82  16.074   5.083  -8.468
  634   3HG1  VAL  82          HG13      VAL  82  17.776   5.524  -8.324
  635   1HG2  VAL  82          HG21      VAL  82  15.426   6.486 -11.026
  636   2HG2  VAL  82          HG22      VAL  82  15.048   8.080 -10.373
  637   3HG2  VAL  82          HG23      VAL  82  14.461   6.630  -9.558
  638    HA   PRO  83           HA       PRO  83  16.215  11.985  -7.849
  639   1HB   PRO  83          HB2       PRO  83  18.541  12.687  -9.388
  640   2HB   PRO  83          HB1       PRO  83  18.320  12.871  -7.643
  641   1HG   PRO  83          HG2       PRO  83  19.936  10.885  -9.074
  642   2HG   PRO  83          HG1       PRO  83  19.904  11.240  -7.340
  643   1HD   PRO  83          HD2       PRO  83  18.810   8.933  -8.601
  644   2HD   PRO  83          HD1       PRO  83  18.557   9.439  -6.918
  645    H    ARG  84           HN       ARG  84  16.497   9.753 -10.339
  646    HA   ARG  84           HA       ARG  84  15.953  11.609 -12.556
  647   1HB   ARG  84          HB2       ARG  84  17.271   9.457 -12.797
  648   2HB   ARG  84          HB1       ARG  84  15.755   8.586 -12.560
  649   1HG   ARG  84          HG2       ARG  84  14.785   9.879 -14.479
  650   2HG   ARG  84          HG1       ARG  84  16.379  10.561 -14.772
  651   1HD   ARG  84          HD2       ARG  84  15.549   7.664 -14.941
  652   2HD   ARG  84          HD1       ARG  84  16.158   8.672 -16.247
  653    HE   ARG  84           HE       ARG  84  17.722   7.106 -14.414
  654   1HH1  ARG  84          HH21      ARG  84  17.675  10.226 -15.896
  655   2HH1  ARG  84          HH22      ARG  84  19.348  10.535 -15.577
  656   1HH2  ARG  84          HH11      ARG  84  19.893   7.495 -14.014
  657   2HH2  ARG  84          HH12      ARG  84  20.602   8.992 -14.521
  Start of MODEL   13
    1   1H    SER   1          HT1       SER   1   6.165  17.070  -1.997
    2   2H    SER   1          HT2       SER   1   6.923  15.709  -1.320
    3   3H    SER   1          HT3       SER   1   7.301  17.264  -0.752
    4    HA   SER   1           HA       SER   1   5.817  16.026   0.759
    5   1HB   SER   1          HB2       SER   1   4.232  17.882   1.050
    6   2HB   SER   1          HB1       SER   1   5.841  18.504   0.693
    7    HG   SER   1           HG       SER   1   3.547  18.813  -0.674
    8    H    ASP   2           HN       ASP   2   5.488  14.712  -1.851
    9    HA   ASP   2           HA       ASP   2   2.728  14.752  -2.656
   10   1HB   ASP   2          HB2       ASP   2   4.347  13.921  -4.205
   11   2HB   ASP   2          HB1       ASP   2   4.954  12.747  -3.042
   12    H    VAL   3           HN       VAL   3   1.165  14.263  -1.244
   13    HA   VAL   3           HA       VAL   3   1.451  12.551   1.045
   14    HB   VAL   3           HB       VAL   3  -0.716  13.138   1.558
   15   1HG1  VAL   3          HG11      VAL   3  -0.183  15.245  -0.538
   16   2HG1  VAL   3          HG12      VAL   3   0.752  15.143   0.955
   17   3HG1  VAL   3          HG13      VAL   3  -0.987  15.430   1.021
   18   1HG2  VAL   3          HG21      VAL   3  -1.288  13.128  -1.422
   19   2HG2  VAL   3          HG22      VAL   3  -2.425  13.771  -0.236
   20   3HG2  VAL   3          HG23      VAL   3  -1.967  12.069  -0.185
   21    H    TYR   4           HN       TYR   4   0.878  11.758  -2.328
   22    HA   TYR   4           HA       TYR   4  -0.750   9.469  -1.686
   23   1HB   TYR   4          HB2       TYR   4   0.519  10.569  -4.173
   24   2HB   TYR   4          HB1       TYR   4   0.090   8.868  -4.203
   25    HD1  TYR   4           HD1      TYR   4  -2.326   8.263  -3.390
   26    HD2  TYR   4           HD2      TYR   4  -1.120  12.173  -4.689
   27    HE1  TYR   4           HE1      TYR   4  -4.681   8.815  -3.889
   28    HE2  TYR   4           HE2      TYR   4  -3.485  12.739  -5.168
   29    HH   TYR   4           HH       TYR   4  -5.869  10.533  -5.508
   30    H    CYS   5           HN       CYS   5   2.674   9.777  -2.602
   31    HA   CYS   5           HA       CYS   5   3.354   7.003  -2.450
   32   1HB   CYS   5          HB2       CYS   5   4.942   9.520  -1.833
   33   2HB   CYS   5          HB1       CYS   5   5.647   7.911  -1.669
   34    H    GLU   6           HN       GLU   6   3.174   9.475   0.143
   35    HA   GLU   6           HA       GLU   6   4.122   7.869   2.251
   36   1HB   GLU   6          HB2       GLU   6   3.533  10.326   2.366
   37   2HB   GLU   6          HB1       GLU   6   1.842   9.847   2.491
   38   1HG   GLU   6          HG2       GLU   6   2.652  10.156   4.736
   39   2HG   GLU   6          HG1       GLU   6   2.496   8.418   4.479
   40    H    VAL   7           HN       VAL   7   0.802   8.044   0.924
   41    HA   VAL   7           HA       VAL   7  -0.225   6.163   2.898
   42    HB   VAL   7           HB       VAL   7  -1.351   6.959   0.189
   43   1HG1  VAL   7          HG11      VAL   7  -2.405   4.930   0.766
   44   2HG1  VAL   7          HG12      VAL   7  -3.511   6.166   1.360
   45   3HG1  VAL   7          HG13      VAL   7  -2.440   5.332   2.482
   46   1HG2  VAL   7          HG21      VAL   7  -2.949   8.257   1.810
   47   2HG2  VAL   7          HG22      VAL   7  -1.367   8.941   1.452
   48   3HG2  VAL   7          HG23      VAL   7  -1.634   8.087   2.972
   49    H    CYS   8           HN       CYS   8   0.956   5.676  -0.476
   50    HA   CYS   8           HA       CYS   8   0.195   2.950  -0.633
   51   1HB   CYS   8          HB2       CYS   8   1.606   2.845  -2.493
   52   2HB   CYS   8          HB1       CYS   8   1.195   4.551  -2.418
   53    H    GLU   9           HN       GLU   9   3.269   4.384   0.536
   54    HA   GLU   9           HA       GLU   9   4.399   1.869   1.252
   55   1HB   GLU   9          HB2       GLU   9   4.881   4.647   2.376
   56   2HB   GLU   9          HB1       GLU   9   5.856   3.241   2.796
   57   1HG   GLU   9          HG2       GLU   9   5.458   4.259  -0.028
   58   2HG   GLU   9          HG1       GLU   9   6.862   4.623   0.971
   59    H    PHE  10           HN       PHE  10   2.062   3.998   2.912
   60    HA   PHE  10           HA       PHE  10   2.401   2.725   5.466
   61   1HB   PHE  10          HB2       PHE  10   1.362   4.946   5.277
   62   2HB   PHE  10          HB1       PHE  10   0.015   4.243   4.377
   63    HD1  PHE  10           HD1      PHE  10  -1.566   2.706   5.464
   64    HD2  PHE  10           HD2      PHE  10   1.598   4.596   7.660
   65    HE1  PHE  10           HE1      PHE  10  -2.654   2.043   7.597
   66    HE2  PHE  10           HE2      PHE  10   0.518   3.939   9.793
   67    HZ   PHE  10           HZ       PHE  10  -1.605   2.661   9.760
   68    H    LEU  11           HN       LEU  11  -0.038   2.253   2.856
   69    HA   LEU  11           HA       LEU  11  -1.457   0.122   4.174
   70   1HB   LEU  11          HB2       LEU  11  -1.040   0.458   1.189
   71   2HB   LEU  11          HB1       LEU  11  -2.281  -0.523   1.973
   72    HG   LEU  11           HG       LEU  11  -2.057   2.451   2.507
   73   1HD1  LEU  11          HD11      LEU  11  -3.940   2.635   0.780
   74   2HD1  LEU  11          HD12      LEU  11  -3.455   1.032   0.230
   75   3HD1  LEU  11          HD13      LEU  11  -2.319   2.377   0.132
   76   1HD2  LEU  11          HD21      LEU  11  -4.269   0.383   2.732
   77   2HD2  LEU  11          HD22      LEU  11  -4.532   2.114   2.925
   78   3HD2  LEU  11          HD23      LEU  11  -3.484   1.254   4.050
   79    H    VAL  12           HN       VAL  12   1.393   0.063   1.968
   80    HA   VAL  12           HA       VAL  12   1.585  -2.755   1.810
   81    HB   VAL  12           HB       VAL  12   3.530  -0.458   1.555
   82   1HG1  VAL  12          HG11      VAL  12   5.203  -2.180   0.720
   83   2HG1  VAL  12          HG12      VAL  12   4.208  -3.406   1.510
   84   3HG1  VAL  12          HG13      VAL  12   4.977  -2.139   2.465
   85   1HG2  VAL  12          HG21      VAL  12   2.675  -2.614  -0.400
   86   2HG2  VAL  12          HG22      VAL  12   3.553  -1.128  -0.771
   87   3HG2  VAL  12          HG23      VAL  12   1.871  -1.050  -0.245
   88    H    LYS  13           HN       LYS  13   3.147  -0.501   4.156
   89    HA   LYS  13           HA       LYS  13   4.518  -2.508   5.640
   90   1HB   LYS  13          HB2       LYS  13   5.102  -0.233   6.030
   91   2HB   LYS  13          HB1       LYS  13   3.440   0.211   6.412
   92   1HG   LYS  13          HG2       LYS  13   3.536  -0.692   8.554
   93   2HG   LYS  13          HG1       LYS  13   4.746  -1.896   8.111
   94   1HD   LYS  13          HD2       LYS  13   5.598  -0.044   9.612
   95   2HD   LYS  13          HD1       LYS  13   6.504  -0.256   8.117
   96   1HE   LYS  13          HE2       LYS  13   4.223   1.679   8.051
   97   2HE   LYS  13          HE1       LYS  13   5.671   2.165   8.929
   98   1HZ   LYS  13          HZ1       LYS  13   6.256   2.828   6.864
   99   2HZ   LYS  13          HZ2       LYS  13   5.306   1.660   6.078
  100   3HZ   LYS  13          HZ3       LYS  13   6.801   1.226   6.758
  101    H    GLU  14           HN       GLU  14   1.257  -1.184   6.031
  102    HA   GLU  14           HA       GLU  14   0.647  -2.745   8.384
  103   1HB   GLU  14          HB2       GLU  14  -0.531  -0.618   7.104
  104   2HB   GLU  14          HB1       GLU  14  -1.628  -1.920   6.659
  105   1HG   GLU  14          HG2       GLU  14  -0.773  -1.239   9.492
  106   2HG   GLU  14          HG1       GLU  14  -2.323  -0.815   8.770
  107    H    VAL  15           HN       VAL  15   0.148  -3.281   4.905
  108    HA   VAL  15           HA       VAL  15  -1.444  -5.643   5.296
  109    HB   VAL  15           HB       VAL  15   0.119  -4.539   2.954
  110   1HG1  VAL  15          HG11      VAL  15  -1.264  -7.229   3.150
  111   2HG1  VAL  15          HG12      VAL  15   0.409  -6.918   2.679
  112   3HG1  VAL  15          HG13      VAL  15  -0.916  -6.435   1.614
  113   1HG2  VAL  15          HG21      VAL  15  -2.110  -4.341   1.977
  114   2HG2  VAL  15          HG22      VAL  15  -2.101  -3.587   3.572
  115   3HG2  VAL  15          HG23      VAL  15  -2.818  -5.185   3.356
  116    H    THR  16           HN       THR  16   2.113  -5.232   4.846
  117    HA   THR  16           HA       THR  16   2.531  -8.040   4.709
  118    HB   THR  16           HB       THR  16   4.783  -7.729   4.869
  119    HG1  THR  16           HG1      THR  16   5.349  -6.894   6.703
  120   1HG2  THR  16          HG21      THR  16   5.190  -6.107   3.324
  121   2HG2  THR  16          HG22      THR  16   4.506  -4.848   4.344
  122   3HG2  THR  16          HG23      THR  16   3.446  -5.852   3.356
  123    H    LYS  17           HN       LYS  17   2.335  -5.896   7.546
  124    HA   LYS  17           HA       LYS  17   3.187  -7.900   9.394
  125   1HB   LYS  17          HB2       LYS  17   3.042  -5.730  10.326
  126   2HB   LYS  17          HB1       LYS  17   1.416  -5.468   9.695
  127   1HG   LYS  17          HG2       LYS  17   0.417  -6.832  11.328
  128   2HG   LYS  17          HG1       LYS  17   1.907  -7.710  11.652
  129   1HD   LYS  17          HD2       LYS  17   2.854  -5.644  12.678
  130   2HD   LYS  17          HD1       LYS  17   1.294  -4.850  12.439
  131   1HE   LYS  17          HE2       LYS  17   0.182  -6.385  13.901
  132   2HE   LYS  17          HE1       LYS  17   1.576  -7.466  13.944
  133   1HZ   LYS  17          HZ1       LYS  17   1.011  -5.348  15.654
  134   2HZ   LYS  17          HZ2       LYS  17   2.362  -4.877  14.737
  135   3HZ   LYS  17          HZ3       LYS  17   2.400  -6.320  15.633
  136    H    LEU  18           HN       LEU  18   0.189  -7.155   7.778
  137    HA   LEU  18           HA       LEU  18  -1.491  -9.012   9.255
  138   1HB   LEU  18          HB2       LEU  18  -1.780  -7.645   6.563
  139   2HB   LEU  18          HB1       LEU  18  -3.007  -8.670   7.233
  140    HG   LEU  18           HG       LEU  18  -2.611  -5.853   7.680
  141   1HD1  LEU  18          HD11      LEU  18  -4.763  -7.145   7.460
  142   2HD1  LEU  18          HD12      LEU  18  -4.735  -5.952   8.761
  143   3HD1  LEU  18          HD13      LEU  18  -4.542  -7.659   9.132
  144   1HD2  LEU  18          HD21      LEU  18  -2.559  -7.353  10.319
  145   2HD2  LEU  18          HD22      LEU  18  -2.565  -5.615  10.066
  146   3HD2  LEU  18          HD23      LEU  18  -1.152  -6.549   9.629
  147    H    ILE  19           HN       ILE  19   0.474  -9.150   6.345
  148    HA   ILE  19           HA       ILE  19  -0.343 -11.834   5.605
  149    HB   ILE  19           HB       ILE  19   2.126 -10.194   4.881
  150   1HG1  ILE  19          HG12      ILE  19  -0.380 -10.864   3.289
  151   2HG1  ILE  19          HG11      ILE  19  -0.084  -9.326   4.074
  152   1HG2  ILE  19          HG21      ILE  19   2.410 -11.851   3.042
  153   2HG2  ILE  19          HG22      ILE  19   1.132 -12.830   3.764
  154   3HG2  ILE  19          HG23      ILE  19   2.640 -12.561   4.637
  155   1HD1  ILE  19          HD11      ILE  19   0.551  -9.070   1.765
  156   2HD1  ILE  19          HD12      ILE  19   1.504 -10.551   1.808
  157   3HD1  ILE  19          HD13      ILE  19   2.037  -9.132   2.708
  158    H    ASP  20           HN       ASP  20   2.076 -10.338   7.636
  159    HA   ASP  20           HA       ASP  20   3.569 -12.780   8.148
  160   1HB   ASP  20          HB2       ASP  20   4.499 -10.439   8.332
  161   2HB   ASP  20          HB1       ASP  20   3.526 -10.239   9.790
  162    H    ASN  21           HN       ASN  21   0.703 -11.286   9.535
  163    HA   ASN  21           HA       ASN  21   0.966 -12.975  11.944
  164   1HB   ASN  21          HB2       ASN  21   0.004 -10.588  12.028
  165   2HB   ASN  21          HB1       ASN  21  -1.433 -11.247  11.244
  166   1HD2  ASN  21          HD21      ASN  21   0.627 -12.776  13.761
  167   2HD2  ASN  21          HD22      ASN  21  -0.619 -12.933  14.902
  168    H    ASN  22           HN       ASN  22   0.139 -13.625   8.906
  169    HA   ASN  22           HA       ASN  22  -0.716 -15.630   8.052
  170   1HB   ASN  22          HB2       ASN  22  -1.906 -16.387  10.706
  171   2HB   ASN  22          HB1       ASN  22  -1.252 -17.413   9.437
  172   1HD2  ASN  22          HD21      ASN  22  -0.509 -16.378  12.476
  173   2HD2  ASN  22          HD22      ASN  22   1.186 -16.401  12.388
  174    H    LYS  23           HN       LYS  23  -2.380 -13.252   7.853
  175    HA   LYS  23           HA       LYS  23  -5.125 -14.248   8.430
  176   1HB   LYS  23          HB2       LYS  23  -4.498 -11.640   7.167
  177   2HB   LYS  23          HB1       LYS  23  -5.904 -12.078   8.122
  178   1HG   LYS  23          HG2       LYS  23  -3.703 -12.507   9.854
  179   2HG   LYS  23          HG1       LYS  23  -3.324 -11.003   9.029
  180   1HD   LYS  23          HD2       LYS  23  -5.459 -10.036   9.758
  181   2HD   LYS  23          HD1       LYS  23  -5.926 -11.579  10.481
  182   1HE   LYS  23          HE2       LYS  23  -5.057 -10.066  12.201
  183   2HE   LYS  23          HE1       LYS  23  -3.980 -11.447  11.997
  184   1HZ   LYS  23          HZ1       LYS  23  -2.624 -10.070  10.499
  185   2HZ   LYS  23          HZ2       LYS  23  -2.695  -9.440  12.075
  186   3HZ   LYS  23          HZ3       LYS  23  -3.621  -8.740  10.834
  187    H    THR  24           HN       THR  24  -6.662 -14.514   6.699
  188    HA   THR  24           HA       THR  24  -5.497 -15.411   4.166
  189    HB   THR  24           HB       THR  24  -7.546 -16.407   3.766
  190    HG1  THR  24           HG1      THR  24  -8.542 -14.046   4.901
  191   1HG2  THR  24          HG21      THR  24  -6.765 -16.991   6.103
  192   2HG2  THR  24          HG22      THR  24  -8.489 -17.221   5.810
  193   3HG2  THR  24          HG23      THR  24  -7.929 -15.809   6.702
  194    H    GLU  25           HN       GLU  25  -6.330 -14.658   2.078
  195    HA   GLU  25           HA       GLU  25  -5.999 -11.864   1.681
  196   1HB   GLU  25          HB2       GLU  25  -5.755 -13.298  -0.220
  197   2HB   GLU  25          HB1       GLU  25  -7.345 -14.014   0.015
  198   1HG   GLU  25          HG2       GLU  25  -7.327 -11.061  -0.396
  199   2HG   GLU  25          HG1       GLU  25  -6.836 -12.014  -1.790
  200    H    LYS  26           HN       LYS  26  -8.968 -13.796   2.013
  201    HA   LYS  26           HA       LYS  26 -10.887 -11.762   1.668
  202   1HB   LYS  26          HB2       LYS  26 -11.498 -14.124   1.851
  203   2HB   LYS  26          HB1       LYS  26 -10.978 -14.139   3.537
  204   1HG   LYS  26          HG2       LYS  26 -12.723 -12.656   4.197
  205   2HG   LYS  26          HG1       LYS  26 -13.089 -12.226   2.527
  206   1HD   LYS  26          HD2       LYS  26 -14.785 -13.779   3.313
  207   2HD   LYS  26          HD1       LYS  26 -13.781 -14.598   2.118
  208   1HE   LYS  26          HE2       LYS  26 -13.128 -14.788   5.058
  209   2HE   LYS  26          HE1       LYS  26 -14.326 -15.855   4.326
  210   1HZ   LYS  26          HZ1       LYS  26 -11.854 -15.607   2.848
  211   2HZ   LYS  26          HZ2       LYS  26 -12.767 -16.991   3.222
  212   3HZ   LYS  26          HZ3       LYS  26 -11.694 -16.342   4.368
  213    H    GLU  27           HN       GLU  27  -8.912 -12.454   4.509
  214    HA   GLU  27           HA       GLU  27 -10.466 -10.686   6.229
  215   1HB   GLU  27          HB2       GLU  27  -7.743 -11.969   6.510
  216   2HB   GLU  27          HB1       GLU  27  -8.410 -10.878   7.720
  217   1HG   GLU  27          HG2       GLU  27 -10.331 -12.329   8.036
  218   2HG   GLU  27          HG1       GLU  27  -9.767 -13.396   6.752
  219    H    ILE  28           HN       ILE  28  -7.541 -10.311   4.233
  220    HA   ILE  28           HA       ILE  28  -6.821  -7.740   5.284
  221    HB   ILE  28           HB       ILE  28  -6.283  -8.704   2.463
  222   1HG1  ILE  28          HG12      ILE  28  -5.470  -9.839   5.082
  223   2HG1  ILE  28          HG11      ILE  28  -5.639 -10.636   3.548
  224   1HG2  ILE  28          HG21      ILE  28  -5.539  -6.417   3.151
  225   2HG2  ILE  28          HG22      ILE  28  -4.209  -7.478   2.707
  226   3HG2  ILE  28          HG23      ILE  28  -4.548  -7.154   4.408
  227   1HD1  ILE  28          HD11      ILE  28  -3.465  -9.593   2.840
  228   2HD1  ILE  28          HD12      ILE  28  -3.321 -10.704   4.209
  229   3HD1  ILE  28          HD13      ILE  28  -3.298  -8.962   4.481
  230    H    LEU  29           HN       LEU  29  -8.890  -8.732   2.562
  231    HA   LEU  29           HA       LEU  29  -9.453  -6.030   1.726
  232   1HB   LEU  29          HB2       LEU  29 -11.130  -8.520   1.310
  233   2HB   LEU  29          HB1       LEU  29 -11.147  -7.051   0.330
  234    HG   LEU  29           HG       LEU  29  -8.752  -8.896   0.681
  235   1HD1  LEU  29          HD11      LEU  29  -9.235  -9.257  -1.833
  236   2HD1  LEU  29          HD12      LEU  29 -10.824  -8.564  -1.510
  237   3HD1  LEU  29          HD13      LEU  29 -10.325 -10.045  -0.694
  238   1HD2  LEU  29          HD21      LEU  29  -8.035  -7.441  -1.394
  239   2HD2  LEU  29          HD22      LEU  29  -7.851  -6.767   0.222
  240   3HD2  LEU  29          HD23      LEU  29  -9.219  -6.287  -0.781
  241    H    ASP  30           HN       ASP  30 -10.862  -8.233   4.065
  242    HA   ASP  30           HA       ASP  30 -13.289  -6.721   4.547
  243   1HB   ASP  30          HB2       ASP  30 -12.907  -9.109   5.277
  244   2HB   ASP  30          HB1       ASP  30 -11.802  -8.496   6.507
  245    H    ALA  31           HN       ALA  31 -10.076  -6.715   6.090
  246    HA   ALA  31           HA       ALA  31 -10.745  -4.735   8.057
  247   1HB   ALA  31          HB1       ALA  31  -8.771  -6.338   8.074
  248   2HB   ALA  31          HB2       ALA  31  -8.408  -4.678   8.543
  249   3HB   ALA  31          HB3       ALA  31  -7.990  -5.252   6.927
  250    H    PHE  32           HN       PHE  32  -9.851  -4.441   4.664
  251    HA   PHE  32           HA       PHE  32  -8.831  -1.799   4.562
  252   1HB   PHE  32          HB2       PHE  32 -10.551  -3.449   2.728
  253   2HB   PHE  32          HB1       PHE  32 -10.192  -1.784   2.320
  254    HD1  PHE  32           HD1      PHE  32  -9.121  -2.753   0.271
  255    HD2  PHE  32           HD2      PHE  32  -7.546  -3.533   4.208
  256    HE1  PHE  32           HE1      PHE  32  -6.943  -3.402  -0.711
  257    HE2  PHE  32           HE2      PHE  32  -5.384  -4.146   3.214
  258    HZ   PHE  32           HZ       PHE  32  -5.077  -4.101   0.760
  259    H    ASP  33           HN       ASP  33 -11.845  -2.860   5.731
  260    HA   ASP  33           HA       ASP  33 -13.325  -0.425   5.027
  261   1HB   ASP  33          HB2       ASP  33 -14.023  -2.688   6.920
  262   2HB   ASP  33          HB1       ASP  33 -15.128  -1.426   6.374
  263    H    LYS  34           HN       LYS  34 -11.296  -1.479   7.665
  264    HA   LYS  34           HA       LYS  34 -11.996   1.043   9.130
  265   1HB   LYS  34          HB2       LYS  34 -11.419  -0.267  11.243
  266   2HB   LYS  34          HB1       LYS  34 -12.951  -0.675  10.473
  267   1HG   LYS  34          HG2       LYS  34 -11.988  -2.638   9.444
  268   2HG   LYS  34          HG1       LYS  34 -10.372  -2.184   9.982
  269   1HD   LYS  34          HD2       LYS  34 -11.189  -3.876  11.498
  270   2HD   LYS  34          HD1       LYS  34 -11.193  -2.337  12.357
  271   1HE   LYS  34          HE2       LYS  34 -13.541  -2.122  12.206
  272   2HE   LYS  34          HE1       LYS  34 -13.658  -3.312  10.909
  273   1HZ   LYS  34          HZ1       LYS  34 -13.881  -4.914  12.396
  274   2HZ   LYS  34          HZ2       LYS  34 -13.900  -3.750  13.634
  275   3HZ   LYS  34          HZ3       LYS  34 -12.436  -4.475  13.168
  276    H    MET  35           HN       MET  35  -9.707  -0.216   7.275
  277    HA   MET  35           HA       MET  35  -7.379   0.128   9.023
  278   1HB   MET  35          HB2       MET  35  -7.861  -1.104   6.547
  279   2HB   MET  35          HB1       MET  35  -6.819   0.235   6.124
  280   1HG   MET  35          HG2       MET  35  -5.148  -1.213   6.656
  281   2HG   MET  35          HG1       MET  35  -5.507  -0.793   8.317
  282   1HE   MET  35          HE1       MET  35  -4.400  -3.722   6.630
  283   2HE   MET  35          HE2       MET  35  -5.624  -3.180   5.484
  284   3HE   MET  35          HE3       MET  35  -5.799  -4.747   6.265
  285    H    CYS  36           HN       CYS  36  -8.999   2.053   6.427
  286    HA   CYS  36           HA       CYS  36  -7.045   4.150   6.607
  287   1HB   CYS  36          HB2       CYS  36  -9.843   3.951   5.514
  288   2HB   CYS  36          HB1       CYS  36  -9.141   5.554   5.729
  289    H    SER  37           HN       SER  37  -8.971   2.923   8.902
  290    HA   SER  37           HA       SER  37  -9.977   5.377  10.128
  291   1HB   SER  37          HB2       SER  37 -10.894   3.021  10.467
  292   2HB   SER  37          HB1       SER  37  -9.517   2.741  11.529
  293    HG   SER  37           HG       SER  37 -11.686   4.513  11.810
  294    H    LYS  38           HN       LYS  38  -6.826   3.812  10.202
  295    HA   LYS  38           HA       LYS  38  -6.168   5.160  12.773
  296   1HB   LYS  38          HB2       LYS  38  -3.818   4.058  12.168
  297   2HB   LYS  38          HB1       LYS  38  -5.132   3.107  12.850
  298   1HG   LYS  38          HG2       LYS  38  -5.805   2.384  10.601
  299   2HG   LYS  38          HG1       LYS  38  -4.517   3.360   9.893
  300   1HD   LYS  38          HD2       LYS  38  -3.478   1.270  10.004
  301   2HD   LYS  38          HD1       LYS  38  -2.965   1.971  11.534
  302   1HE   LYS  38          HE2       LYS  38  -4.782   0.809  12.703
  303   2HE   LYS  38          HE1       LYS  38  -5.367   0.152  11.176
  304   1HZ   LYS  38          HZ1       LYS  38  -2.574  -0.296  11.967
  305   2HZ   LYS  38          HZ2       LYS  38  -3.582  -1.247  10.984
  306   3HZ   LYS  38          HZ3       LYS  38  -3.795  -1.241  12.669
  307    H    LEU  39           HN       LEU  39  -6.414   6.402   9.807
  308    HA   LEU  39           HA       LEU  39  -3.881   8.000   9.973
  309   1HB   LEU  39          HB2       LEU  39  -5.835   7.770   7.676
  310   2HB   LEU  39          HB1       LEU  39  -4.275   8.590   7.644
  311    HG   LEU  39           HG       LEU  39  -4.727   5.618   8.072
  312   1HD1  LEU  39          HD11      LEU  39  -3.239   6.971   5.820
  313   2HD1  LEU  39          HD12      LEU  39  -4.971   6.669   5.733
  314   3HD1  LEU  39          HD13      LEU  39  -3.848   5.320   5.892
  315   1HD2  LEU  39          HD21      LEU  39  -2.124   5.677   7.750
  316   2HD2  LEU  39          HD22      LEU  39  -2.785   6.078   9.330
  317   3HD2  LEU  39          HD23      LEU  39  -2.266   7.362   8.241
  318    HA   PRO  40           HA       PRO  40  -6.214  11.388  11.667
  319   1HB   PRO  40          HB2       PRO  40  -4.862  13.257   9.794
  320   2HB   PRO  40          HB1       PRO  40  -4.801  13.219  11.562
  321   1HG   PRO  40          HG2       PRO  40  -2.762  12.329   9.780
  322   2HG   PRO  40          HG1       PRO  40  -2.808  12.080  11.531
  323   1HD   PRO  40          HD2       PRO  40  -3.123  10.096   9.471
  324   2HD   PRO  40          HD1       PRO  40  -3.204   9.850  11.224
  325    H    LYS  41           HN       LYS  41  -7.978  12.885  10.939
  326    HA   LYS  41           HA       LYS  41  -9.488  11.744   8.771
  327   1HB   LYS  41          HB2       LYS  41 -10.330  13.105  10.843
  328   2HB   LYS  41          HB1       LYS  41 -10.025  14.514   9.825
  329   1HG   LYS  41          HG2       LYS  41 -11.406  13.312   8.020
  330   2HG   LYS  41          HG1       LYS  41 -11.919  12.213   9.298
  331   1HD   LYS  41          HD2       LYS  41 -12.223  15.230   9.419
  332   2HD   LYS  41          HD1       LYS  41 -13.507  14.123   8.937
  333   1HE   LYS  41          HE2       LYS  41 -13.920  14.467  11.230
  334   2HE   LYS  41          HE1       LYS  41 -13.045  12.938  11.206
  335   1HZ   LYS  41          HZ1       LYS  41 -11.297  15.199  11.304
  336   2HZ   LYS  41          HZ2       LYS  41 -11.353  13.830  12.310
  337   3HZ   LYS  41          HZ3       LYS  41 -12.360  15.163  12.626
  338    H    SER  42           HN       SER  42  -7.105  14.237   8.761
  339    HA   SER  42           HA       SER  42  -8.103  15.514   6.377
  340   1HB   SER  42          HB2       SER  42  -6.739  16.818   7.860
  341   2HB   SER  42          HB1       SER  42  -5.430  15.641   7.782
  342    HG   SER  42           HG       SER  42  -5.362  16.122   5.488
  343    H    LEU  43           HN       LEU  43  -6.620  12.621   6.762
  344    HA   LEU  43           HA       LEU  43  -5.400  12.612   4.048
  345   1HB   LEU  43          HB2       LEU  43  -4.487  11.821   6.651
  346   2HB   LEU  43          HB1       LEU  43  -4.716  10.331   5.752
  347    HG   LEU  43           HG       LEU  43  -3.267  11.105   4.031
  348   1HD1  LEU  43          HD11      LEU  43  -3.564  13.731   5.370
  349   2HD1  LEU  43          HD12      LEU  43  -3.254  13.372   3.674
  350   3HD1  LEU  43          HD13      LEU  43  -1.926  13.370   4.825
  351   1HD2  LEU  43          HD21      LEU  43  -1.134  11.449   5.451
  352   2HD2  LEU  43          HD22      LEU  43  -2.065   9.976   5.704
  353   3HD2  LEU  43          HD23      LEU  43  -2.217  11.317   6.834
  354    H    SER  44           HN       SER  44  -8.017  11.711   5.853
  355    HA   SER  44           HA       SER  44  -8.786   9.139   5.418
  356   1HB   SER  44          HB2       SER  44 -10.317  10.688   6.434
  357   2HB   SER  44          HB1       SER  44 -10.438  11.630   4.952
  358    HG   SER  44           HG       SER  44 -11.806   9.436   5.706
  359    H    GLU  45           HN       GLU  45  -9.642  11.652   3.082
  360    HA   GLU  45           HA       GLU  45 -10.709  10.138   1.099
  361   1HB   GLU  45          HB2       GLU  45  -9.210  12.742   0.866
  362   2HB   GLU  45          HB1       GLU  45 -10.360  12.114  -0.317
  363   1HG   GLU  45          HG2       GLU  45 -11.052  12.619   2.593
  364   2HG   GLU  45          HG1       GLU  45 -11.369  13.766   1.293
  365    H    GLU  46           HN       GLU  46  -7.391  11.435   0.825
  366    HA   GLU  46           HA       GLU  46  -6.857  10.309  -1.713
  367   1HB   GLU  46          HB2       GLU  46  -4.789  10.530   0.475
  368   2HB   GLU  46          HB1       GLU  46  -4.565  10.715  -1.261
  369   1HG   GLU  46          HG2       GLU  46  -4.598  12.953  -0.629
  370   2HG   GLU  46          HG1       GLU  46  -6.310  12.706  -0.955
  371    H    CYS  47           HN       CYS  47  -7.123   8.794   1.382
  372    HA   CYS  47           HA       CYS  47  -5.661   6.401   0.549
  373   1HB   CYS  47          HB2       CYS  47  -5.916   5.726   2.748
  374   2HB   CYS  47          HB1       CYS  47  -6.309   7.427   2.997
  375    H    GLN  48           HN       GLN  48  -9.065   7.338   0.926
  376    HA   GLN  48           HA       GLN  48 -10.236   4.867   0.255
  377   1HB   GLN  48          HB2       GLN  48 -11.113   7.695  -0.406
  378   2HB   GLN  48          HB1       GLN  48 -12.112   6.281  -0.738
  379   1HG   GLN  48          HG2       GLN  48 -12.130   5.681   1.617
  380   2HG   GLN  48          HG1       GLN  48 -11.012   6.992   1.992
  381   1HE2  GLN  48          HE21      GLN  48 -13.504   7.549  -0.418
  382   2HE2  GLN  48          HE22      GLN  48 -14.474   8.559   0.542
  383    H    GLU  49           HN       GLU  49  -8.959   7.401  -1.903
  384    HA   GLU  49           HA       GLU  49  -9.769   6.092  -4.311
  385   1HB   GLU  49          HB2       GLU  49  -7.626   8.151  -3.750
  386   2HB   GLU  49          HB1       GLU  49  -8.058   7.612  -5.373
  387   1HG   GLU  49          HG2       GLU  49 -10.072   8.724  -3.405
  388   2HG   GLU  49          HG1       GLU  49  -9.240   9.719  -4.600
  389    H    VAL  50           HN       VAL  50  -6.712   5.983  -2.448
  390    HA   VAL  50           HA       VAL  50  -5.352   4.356  -4.390
  391    HB   VAL  50           HB       VAL  50  -4.775   4.476  -1.423
  392   1HG1  VAL  50          HG11      VAL  50  -3.086   3.706  -3.809
  393   2HG1  VAL  50          HG12      VAL  50  -3.681   2.621  -2.550
  394   3HG1  VAL  50          HG13      VAL  50  -2.491   3.859  -2.157
  395   1HG2  VAL  50          HG21      VAL  50  -3.475   6.395  -1.771
  396   2HG2  VAL  50          HG22      VAL  50  -4.805   6.700  -2.883
  397   3HG2  VAL  50          HG23      VAL  50  -3.281   6.076  -3.495
  398    H    VAL  51           HN       VAL  51  -6.920   3.551  -1.261
  399    HA   VAL  51           HA       VAL  51  -6.501   0.780  -1.528
  400    HB   VAL  51           HB       VAL  51  -8.760   2.173  -0.041
  401   1HG1  VAL  51          HG11      VAL  51  -8.503   0.186   1.494
  402   2HG1  VAL  51          HG12      VAL  51  -7.467  -0.539   0.266
  403   3HG1  VAL  51          HG13      VAL  51  -9.158  -0.190  -0.098
  404   1HG2  VAL  51          HG21      VAL  51  -6.018   1.416   0.998
  405   2HG2  VAL  51          HG22      VAL  51  -7.272   2.308   1.863
  406   3HG2  VAL  51          HG23      VAL  51  -6.457   3.044   0.482
  407    H    ASP  52           HN       ASP  52  -9.445   2.599  -2.308
  408    HA   ASP  52           HA       ASP  52 -10.921   0.389  -3.265
  409   1HB   ASP  52          HB2       ASP  52 -12.520   1.944  -3.936
  410   2HB   ASP  52          HB1       ASP  52 -11.630   2.844  -2.712
  411    H    THR  53           HN       THR  53  -8.860   2.640  -5.082
  412    HA   THR  53           HA       THR  53  -9.416   1.247  -7.615
  413    HB   THR  53           HB       THR  53  -7.469   3.481  -7.013
  414    HG1  THR  53           HG1      THR  53  -9.632   4.038  -6.586
  415   1HG2  THR  53          HG21      THR  53  -8.620   2.382  -9.591
  416   2HG2  THR  53          HG22      THR  53  -6.932   2.326  -9.084
  417   3HG2  THR  53          HG23      THR  53  -7.684   3.873  -9.473
  418    H    TYR  54           HN       TYR  54  -6.655   1.550  -5.377
  419    HA   TYR  54           HA       TYR  54  -5.235  -0.487  -7.065
  420   1HB   TYR  54          HB2       TYR  54  -4.182   1.546  -5.109
  421   2HB   TYR  54          HB1       TYR  54  -3.191   0.322  -5.897
  422    HD1  TYR  54           HD1      TYR  54  -5.228   3.343  -6.403
  423    HD2  TYR  54           HD2      TYR  54  -2.662   0.470  -8.274
  424    HE1  TYR  54           HE1      TYR  54  -5.045   4.819  -8.372
  425    HE2  TYR  54           HE2      TYR  54  -2.474   1.940 -10.265
  426    HH   TYR  54           HH       TYR  54  -4.532   4.510 -10.851
  427    H    GLY  55           HN       GLY  55  -7.276  -1.128  -5.028
  428   1HA   GLY  55          HA2       GLY  55  -5.822  -2.181  -2.735
  429   2HA   GLY  55          HA1       GLY  55  -7.536  -2.400  -3.062
  430    H    SER  56           HN       SER  56  -7.628  -3.772  -5.434
  431    HA   SER  56           HA       SER  56  -6.781  -6.370  -4.578
  432   1HB   SER  56          HB2       SER  56  -7.476  -5.785  -7.446
  433   2HB   SER  56          HB1       SER  56  -7.817  -7.227  -6.489
  434    HG   SER  56           HG       SER  56  -9.562  -5.556  -6.906
  435    H    SER  57           HN       SER  57  -5.387  -3.948  -6.650
  436    HA   SER  57           HA       SER  57  -3.536  -5.790  -7.888
  437   1HB   SER  57          HB2       SER  57  -2.519  -3.817  -8.925
  438   2HB   SER  57          HB1       SER  57  -4.272  -3.674  -9.004
  439    HG   SER  57           HG       SER  57  -3.826  -1.801  -8.109
  440    H    ILE  58           HN       ILE  58  -3.128  -3.339  -5.313
  441    HA   ILE  58           HA       ILE  58  -0.345  -3.767  -4.843
  442    HB   ILE  58           HB       ILE  58  -2.624  -3.091  -2.961
  443   1HG1  ILE  58          HG12      ILE  58  -0.357  -1.379  -4.031
  444   2HG1  ILE  58          HG11      ILE  58  -1.960  -1.435  -4.759
  445   1HG2  ILE  58          HG21      ILE  58  -0.650  -2.326  -1.456
  446   2HG2  ILE  58          HG22      ILE  58   0.347  -3.372  -2.466
  447   3HG2  ILE  58          HG23      ILE  58  -0.983  -4.055  -1.535
  448   1HD1  ILE  58          HD11      ILE  58  -2.051   0.436  -3.296
  449   2HD1  ILE  58          HD12      ILE  58  -1.173  -0.425  -2.029
  450   3HD1  ILE  58          HD13      ILE  58  -2.844  -0.853  -2.393
  451    H    LEU  59           HN       LEU  59  -3.170  -5.197  -3.357
  452    HA   LEU  59           HA       LEU  59  -1.845  -7.134  -1.771
  453   1HB   LEU  59          HB2       LEU  59  -4.156  -6.523  -1.362
  454   2HB   LEU  59          HB1       LEU  59  -4.634  -7.081  -2.962
  455    HG   LEU  59           HG       LEU  59  -4.117  -9.381  -2.378
  456   1HD1  LEU  59          HD11      LEU  59  -3.524  -9.777   0.144
  457   2HD1  LEU  59          HD12      LEU  59  -2.988  -8.098   0.116
  458   3HD1  LEU  59          HD13      LEU  59  -2.234  -9.282  -0.947
  459   1HD2  LEU  59          HD21      LEU  59  -5.637  -9.520  -0.208
  460   2HD2  LEU  59          HD22      LEU  59  -6.323  -8.996  -1.742
  461   3HD2  LEU  59          HD23      LEU  59  -5.886  -7.804  -0.519
  462    H    SER  60           HN       SER  60  -2.620  -7.129  -5.221
  463    HA   SER  60           HA       SER  60  -2.367  -9.994  -5.351
  464   1HB   SER  60          HB2       SER  60  -3.742  -9.007  -7.029
  465   2HB   SER  60          HB1       SER  60  -2.492  -7.847  -7.474
  466    HG   SER  60           HG       SER  60  -1.533  -9.328  -8.654
  467    H    ILE  61           HN       ILE  61  -0.316  -7.199  -5.958
  468    HA   ILE  61           HA       ILE  61   1.920  -8.560  -7.159
  469    HB   ILE  61           HB       ILE  61   2.032  -6.024  -5.513
  470   1HG1  ILE  61          HG12      ILE  61   0.469  -6.519  -7.929
  471   2HG1  ILE  61          HG11      ILE  61   0.595  -5.045  -6.979
  472   1HG2  ILE  61          HG21      ILE  61   3.658  -6.962  -7.893
  473   2HG2  ILE  61          HG22      ILE  61   4.170  -7.047  -6.209
  474   3HG2  ILE  61          HG23      ILE  61   3.915  -5.481  -6.969
  475   1HD1  ILE  61          HD11      ILE  61   2.639  -4.415  -8.209
  476   2HD1  ILE  61          HD12      ILE  61   1.262  -4.624  -9.288
  477   3HD1  ILE  61          HD13      ILE  61   2.495  -5.876  -9.190
  478    H    LEU  62           HN       LEU  62   1.290  -7.469  -3.821
  479    HA   LEU  62           HA       LEU  62   3.719  -8.250  -2.698
  480   1HB   LEU  62          HB2       LEU  62   1.043  -7.553  -1.773
  481   2HB   LEU  62          HB1       LEU  62   1.720  -8.802  -0.735
  482    HG   LEU  62           HG       LEU  62   3.340  -6.358  -1.486
  483   1HD1  LEU  62          HD11      LEU  62   1.147  -6.598   0.542
  484   2HD1  LEU  62          HD12      LEU  62   1.543  -5.253  -0.517
  485   3HD1  LEU  62          HD13      LEU  62   2.541  -5.582   0.895
  486   1HD2  LEU  62          HD21      LEU  62   4.573  -8.195  -0.486
  487   2HD2  LEU  62          HD22      LEU  62   3.380  -8.357   0.801
  488   3HD2  LEU  62          HD23      LEU  62   4.400  -6.932   0.727
  489    H    LEU  63           HN       LEU  63   0.905 -10.219  -3.487
  490    HA   LEU  63           HA       LEU  63   1.923 -12.610  -2.167
  491   1HB   LEU  63          HB2       LEU  63  -0.182 -12.300  -4.330
  492   2HB   LEU  63          HB1       LEU  63   0.119 -13.766  -3.396
  493    HG   LEU  63           HG       LEU  63  -0.692 -11.092  -2.221
  494   1HD1  LEU  63          HD11      LEU  63  -2.875 -12.097  -1.860
  495   2HD1  LEU  63          HD12      LEU  63  -2.313 -13.636  -2.511
  496   3HD1  LEU  63          HD13      LEU  63  -2.468 -12.236  -3.571
  497   1HD2  LEU  63          HD21      LEU  63   0.437 -12.138  -0.476
  498   2HD2  LEU  63          HD22      LEU  63   0.047 -13.761  -1.049
  499   3HD2  LEU  63          HD23      LEU  63  -1.182 -12.791  -0.237
  500    H    GLU  64           HN       GLU  64   2.753 -11.033  -5.079
  501    HA   GLU  64           HA       GLU  64   3.710 -13.529  -6.323
  502   1HB   GLU  64          HB2       GLU  64   3.761 -10.618  -7.145
  503   2HB   GLU  64          HB1       GLU  64   4.700 -11.832  -8.016
  504   1HG   GLU  64          HG2       GLU  64   2.588 -13.145  -8.332
  505   2HG   GLU  64          HG1       GLU  64   1.702 -11.800  -7.615
  506    H    GLU  65           HN       GLU  65   4.677 -12.720  -3.735
  507    HA   GLU  65           HA       GLU  65   6.739 -12.593  -2.544
  508   1HB   GLU  65          HB2       GLU  65   7.589 -13.897  -5.126
  509   2HB   GLU  65          HB1       GLU  65   8.543 -13.863  -3.643
  510   1HG   GLU  65          HG2       GLU  65   5.725 -14.960  -3.760
  511   2HG   GLU  65          HG1       GLU  65   7.158 -15.966  -3.984
  512    H    VAL  66           HN       VAL  66   6.081 -10.234  -4.317
  513    HA   VAL  66           HA       VAL  66   8.757  -9.358  -5.283
  514    HB   VAL  66           HB       VAL  66   5.924  -8.434  -5.594
  515   1HG1  VAL  66          HG11      VAL  66   6.869  -6.281  -6.637
  516   2HG1  VAL  66          HG12      VAL  66   8.337  -6.621  -5.720
  517   3HG1  VAL  66          HG13      VAL  66   6.813  -6.349  -4.876
  518   1HG2  VAL  66          HG21      VAL  66   6.463  -8.458  -7.908
  519   2HG2  VAL  66          HG22      VAL  66   7.309  -9.855  -7.239
  520   3HG2  VAL  66          HG23      VAL  66   8.194  -8.373  -7.587
  521    H    SER  67           HN       SER  67   9.892  -7.631  -4.275
  522    HA   SER  67           HA       SER  67   9.747  -7.366  -1.492
  523   1HB   SER  67          HB2       SER  67  10.719  -5.035  -3.123
  524   2HB   SER  67          HB1       SER  67  11.432  -5.758  -1.687
  525    HG   SER  67           HG       SER  67  12.592  -6.310  -3.566
  526    HA   PRO  68           HA       PRO  68   6.238  -4.757  -0.837
  527   1HB   PRO  68          HB2       PRO  68   7.209  -3.242   1.375
  528   2HB   PRO  68          HB1       PRO  68   6.348  -4.775   1.459
  529   1HG   PRO  68          HG2       PRO  68   9.217  -4.254   1.877
  530   2HG   PRO  68          HG1       PRO  68   8.264  -5.672   2.342
  531   1HD   PRO  68          HD2       PRO  68  10.113  -5.544   0.196
  532   2HD   PRO  68          HD1       PRO  68   8.926  -6.832   0.490
  533    H    GLU  69           HN       GLU  69   9.383  -3.042  -0.712
  534    HA   GLU  69           HA       GLU  69   8.208  -0.448  -1.244
  535   1HB   GLU  69          HB2       GLU  69  10.273  -0.462  -0.084
  536   2HB   GLU  69          HB1       GLU  69  11.023  -1.536  -1.261
  537   1HG   GLU  69          HG2       GLU  69  11.719   0.904  -1.416
  538   2HG   GLU  69          HG1       GLU  69  11.118   0.199  -2.914
  539    H    LEU  70           HN       LEU  70   9.157  -3.080  -3.272
  540    HA   LEU  70           HA       LEU  70   9.585  -1.441  -5.625
  541   1HB   LEU  70          HB2       LEU  70   9.049  -4.405  -5.268
  542   2HB   LEU  70          HB1       LEU  70   9.232  -3.691  -6.855
  543    HG   LEU  70           HG       LEU  70  11.284  -3.392  -4.688
  544   1HD1  LEU  70          HD11      LEU  70  12.521  -5.219  -5.617
  545   2HD1  LEU  70          HD12      LEU  70  11.437  -5.325  -7.003
  546   3HD1  LEU  70          HD13      LEU  70  10.873  -5.808  -5.405
  547   1HD2  LEU  70          HD21      LEU  70  12.733  -3.065  -6.861
  548   2HD2  LEU  70          HD22      LEU  70  11.766  -1.729  -6.255
  549   3HD2  LEU  70          HD23      LEU  70  11.182  -2.696  -7.604
  550    H    VAL  71           HN       VAL  71   6.875  -2.410  -3.858
  551    HA   VAL  71           HA       VAL  71   4.951  -2.500  -5.969
  552    HB   VAL  71           HB       VAL  71   4.744  -2.001  -2.990
  553   1HG1  VAL  71          HG11      VAL  71   2.520  -1.666  -5.007
  554   2HG1  VAL  71          HG12      VAL  71   2.943  -0.607  -3.663
  555   3HG1  VAL  71          HG13      VAL  71   2.179  -2.158  -3.347
  556   1HG2  VAL  71          HG21      VAL  71   3.740  -4.165  -4.854
  557   2HG2  VAL  71          HG22      VAL  71   3.387  -4.106  -3.128
  558   3HG2  VAL  71          HG23      VAL  71   5.049  -4.297  -3.680
  559    H    CYS  72           HN       CYS  72   5.698   0.302  -3.792
  560    HA   CYS  72           HA       CYS  72   3.932   1.933  -5.275
  561   1HB   CYS  72          HB2       CYS  72   5.290   2.290  -2.942
  562   2HB   CYS  72          HB1       CYS  72   6.255   3.322  -3.988
  563    H    SER  73           HN       SER  73   7.264   1.044  -5.828
  564    HA   SER  73           HA       SER  73   7.741   3.151  -7.817
  565   1HB   SER  73          HB2       SER  73   9.510   1.804  -6.460
  566   2HB   SER  73          HB1       SER  73   9.292   0.570  -7.699
  567    HG   SER  73           HG       SER  73  10.396   1.768  -9.021
  568    H    MET  74           HN       MET  74   6.724  -0.274  -8.060
  569    HA   MET  74           HA       MET  74   6.803  -0.281 -10.985
  570   1HB   MET  74          HB2       MET  74   5.917  -2.143  -8.845
  571   2HB   MET  74          HB1       MET  74   5.055  -2.299 -10.373
  572   1HG   MET  74          HG2       MET  74   7.426  -2.366 -11.450
  573   2HG   MET  74          HG1       MET  74   7.988  -2.704  -9.819
  574   1HE   MET  74          HE1       MET  74   4.859  -4.221  -9.121
  575   2HE   MET  74          HE2       MET  74   6.417  -4.334  -8.309
  576   3HE   MET  74          HE3       MET  74   5.653  -5.788  -8.937
  577    H    LEU  75           HN       LEU  75   4.164   0.283  -8.623
  578    HA   LEU  75           HA       LEU  75   2.175   0.489 -10.727
  579   1HB   LEU  75          HB2       LEU  75   2.043   1.598  -7.915
  580   2HB   LEU  75          HB1       LEU  75   0.681   1.301  -8.992
  581    HG   LEU  75           HG       LEU  75   2.511  -0.762  -7.741
  582   1HD1  LEU  75          HD11      LEU  75   0.822  -0.133  -6.202
  583   2HD1  LEU  75          HD12      LEU  75   0.250  -1.629  -6.934
  584   3HD1  LEU  75          HD13      LEU  75  -0.411  -0.084  -7.461
  585   1HD2  LEU  75          HD21      LEU  75   2.153  -1.676  -9.882
  586   2HD2  LEU  75          HD22      LEU  75   0.530  -0.992 -10.001
  587   3HD2  LEU  75          HD23      LEU  75   0.833  -2.365  -8.940
  588    H    HIS  76           HN       HIS  76   4.723   2.298 -10.589
  589    HA   HIS  76           HA       HIS  76   5.263   4.518 -11.119
  590   1HB   HIS  76          HB2       HIS  76   2.570   4.270 -12.498
  591   2HB   HIS  76          HB1       HIS  76   3.734   5.561 -12.795
  592    HD1  HIS  76           HD1      HIS  76   6.108   4.788 -13.775
  593    HD2  HIS  76           HD2      HIS  76   3.112   1.890 -13.854
  594    HE1  HIS  76           HE1      HIS  76   6.901   2.981 -15.362
  595    H    LEU  77           HN       LEU  77   3.593   4.036  -8.586
  596    HA   LEU  77           HA       LEU  77   1.993   6.511  -8.461
  597   1HB   LEU  77          HB2       LEU  77   2.562   4.302  -6.475
  598   2HB   LEU  77          HB1       LEU  77   1.739   5.772  -5.997
  599    HG   LEU  77           HG       LEU  77   0.800   3.701  -7.986
  600   1HD1  LEU  77          HD11      LEU  77  -1.075   3.486  -6.432
  601   2HD1  LEU  77          HD12      LEU  77  -0.438   4.806  -5.456
  602   3HD1  LEU  77          HD13      LEU  77   0.442   3.287  -5.557
  603   1HD2  LEU  77          HD21      LEU  77  -0.127   6.538  -7.559
  604   2HD2  LEU  77          HD22      LEU  77  -1.326   5.303  -7.939
  605   3HD2  LEU  77          HD23      LEU  77  -0.015   5.625  -9.065
  606    H    CYS  78           HN       CYS  78   5.257   5.686  -7.980
  607    HA   CYS  78           HA       CYS  78   5.624   8.259  -6.492
  608   1HB   CYS  78          HB2       CYS  78   7.044   5.616  -6.076
  609   2HB   CYS  78          HB1       CYS  78   7.721   7.143  -5.511
  610    H    SER  79           HN       SER  79   7.574   9.252  -6.785
  611    HA   SER  79           HA       SER  79   9.402  10.022  -7.814
  612   1HB   SER  79          HB2       SER  79   9.143   8.005 -10.067
  613   2HB   SER  79          HB1       SER  79  10.603   8.819  -9.514
  614    HG   SER  79           HG       SER  79  10.773   7.437  -7.912
  615    H    GLY  80           HN       GLY  80   7.045  11.269  -8.125
  616   1HA   GLY  80          HA2       GLY  80   6.151  11.569 -10.830
  617   2HA   GLY  80          HA1       GLY  80   5.789  12.671  -9.505
  618    H    LEU  81           HN       LEU  81   8.805  11.760 -11.279
  619    HA   LEU  81           HA       LEU  81   9.703  14.547 -11.148
  620   1HB   LEU  81          HB2       LEU  81  10.791  12.010 -12.379
  621   2HB   LEU  81          HB1       LEU  81  11.500  13.571 -12.784
  622    HG   LEU  81           HG       LEU  81  12.651  12.385 -10.887
  623   1HD1  LEU  81          HD11      LEU  81  12.341  15.023 -11.190
  624   2HD1  LEU  81          HD12      LEU  81  13.130  14.349  -9.769
  625   3HD1  LEU  81          HD13      LEU  81  11.447  14.856  -9.678
  626   1HD2  LEU  81          HD21      LEU  81  10.482  11.434  -9.982
  627   2HD2  LEU  81          HD22      LEU  81  10.136  13.036  -9.328
  628   3HD2  LEU  81          HD23      LEU  81  11.547  12.139  -8.766
  629    H    VAL  82           HN       VAL  82   7.271  13.250 -12.639
  630    HA   VAL  82           HA       VAL  82   7.770  14.159 -15.403
  631    HB   VAL  82           HB       VAL  82   5.403  13.395 -15.763
  632   1HG1  VAL  82          HG11      VAL  82   7.380  11.851 -15.928
  633   2HG1  VAL  82          HG12      VAL  82   5.882  11.034 -15.482
  634   3HG1  VAL  82          HG13      VAL  82   7.094  11.385 -14.251
  635   1HG2  VAL  82          HG21      VAL  82   4.567  13.928 -13.494
  636   2HG2  VAL  82          HG22      VAL  82   5.594  12.662 -12.824
  637   3HG2  VAL  82          HG23      VAL  82   4.268  12.240 -13.904
  638    HA   PRO  83           HA       PRO  83   6.298  18.305 -14.780
  639   1HB   PRO  83          HB2       PRO  83   4.550  18.303 -17.118
  640   2HB   PRO  83          HB1       PRO  83   6.110  19.113 -16.915
  641   1HG   PRO  83          HG2       PRO  83   5.547  16.722 -18.454
  642   2HG   PRO  83          HG1       PRO  83   7.098  17.555 -18.273
  643   1HD   PRO  83          HD2       PRO  83   6.372  15.019 -17.151
  644   2HD   PRO  83          HD1       PRO  83   7.860  15.937 -16.845
  645    H    ARG  84           HN       ARG  84   4.593  19.108 -13.568
  646    HA   ARG  84           HA       ARG  84   2.453  17.323 -12.805
  647   1HB   ARG  84          HB2       ARG  84   1.584  19.347 -11.580
  648   2HB   ARG  84          HB1       ARG  84   3.261  18.950 -11.202
  649   1HG   ARG  84          HG2       ARG  84   4.057  20.653 -12.758
  650   2HG   ARG  84          HG1       ARG  84   2.403  21.008 -13.256
  651   1HD   ARG  84          HD2       ARG  84   3.556  21.393 -10.477
  652   2HD   ARG  84          HD1       ARG  84   3.141  22.671 -11.620
  653    HE   ARG  84           HE       ARG  84   0.775  21.261 -11.322
  654   1HH1  ARG  84          HH21      ARG  84   3.083  22.744  -9.234
  655   2HH1  ARG  84          HH22      ARG  84   1.922  23.143  -8.013
  656   1HH2  ARG  84          HH11      ARG  84  -0.756  21.774  -9.739
  657   2HH2  ARG  84          HH12      ARG  84  -0.253  22.593  -8.299
  Start of MODEL   14
    1   1H    SER   1          HT1       SER   1   6.327  18.218  -0.869
    2   2H    SER   1          HT2       SER   1   5.237  17.693  -2.061
    3   3H    SER   1          HT3       SER   1   6.334  16.597  -1.367
    4    HA   SER   1           HA       SER   1   5.242  16.674   0.725
    5   1HB   SER   1          HB2       SER   1   4.689  19.039   0.781
    6   2HB   SER   1          HB1       SER   1   3.593  18.857  -0.586
    7    HG   SER   1           HG       SER   1   2.700  18.830   1.662
    8    H    ASP   2           HN       ASP   2   5.148  15.207  -1.742
    9    HA   ASP   2           HA       ASP   2   2.520  14.690  -2.690
   10   1HB   ASP   2          HB2       ASP   2   4.490  13.963  -3.917
   11   2HB   ASP   2          HB1       ASP   2   4.960  12.902  -2.595
   12    H    VAL   3           HN       VAL   3   0.945  14.216  -1.267
   13    HA   VAL   3           HA       VAL   3   1.304  12.575   1.092
   14    HB   VAL   3           HB       VAL   3  -0.893  13.094   1.593
   15   1HG1  VAL   3          HG11      VAL   3   0.556  15.127   1.139
   16   2HG1  VAL   3          HG12      VAL   3  -1.184  15.409   1.083
   17   3HG1  VAL   3          HG13      VAL   3  -0.265  15.264  -0.415
   18   1HG2  VAL   3          HG21      VAL   3  -2.102  12.085  -0.203
   19   2HG2  VAL   3          HG22      VAL   3  -1.384  13.168  -1.398
   20   3HG2  VAL   3          HG23      VAL   3  -2.554  13.791  -0.231
   21    H    TYR   4           HN       TYR   4   0.790  11.750  -2.272
   22    HA   TYR   4           HA       TYR   4  -0.831   9.448  -1.638
   23   1HB   TYR   4          HB2       TYR   4   0.451  10.544  -4.127
   24   2HB   TYR   4          HB1       TYR   4  -0.029   8.858  -4.153
   25    HD1  TYR   4           HD1      TYR   4  -1.148  12.257  -4.458
   26    HD2  TYR   4           HD2      TYR   4  -2.450   8.274  -3.520
   27    HE1  TYR   4           HE1      TYR   4  -3.492  12.903  -4.948
   28    HE2  TYR   4           HE2      TYR   4  -4.786   8.910  -4.025
   29    HH   TYR   4           HH       TYR   4  -5.658  12.266  -4.728
   30    H    CYS   5           HN       CYS   5   2.579   9.765  -2.605
   31    HA   CYS   5           HA       CYS   5   3.290   7.004  -2.464
   32   1HB   CYS   5          HB2       CYS   5   4.665   9.216  -3.100
   33   2HB   CYS   5          HB1       CYS   5   5.211   9.093  -1.435
   34    H    GLU   6           HN       GLU   6   3.167   9.482   0.141
   35    HA   GLU   6           HA       GLU   6   4.190   7.849   2.213
   36   1HB   GLU   6          HB2       GLU   6   1.966   9.868   2.570
   37   2HB   GLU   6          HB1       GLU   6   3.176   9.377   3.756
   38   1HG   GLU   6          HG2       GLU   6   4.952  10.306   2.306
   39   2HG   GLU   6          HG1       GLU   6   3.723  10.829   1.156
   40    H    VAL   7           HN       VAL   7   0.857   8.141   1.002
   41    HA   VAL   7           HA       VAL   7  -0.207   6.311   2.997
   42    HB   VAL   7           HB       VAL   7  -1.276   7.343   0.346
   43   1HG1  VAL   7          HG11      VAL   7  -2.477   5.420   2.337
   44   2HG1  VAL   7          HG12      VAL   7  -2.410   5.291   0.579
   45   3HG1  VAL   7          HG13      VAL   7  -3.505   6.445   1.336
   46   1HG2  VAL   7          HG21      VAL   7  -1.638   8.115   3.243
   47   2HG2  VAL   7          HG22      VAL   7  -2.939   8.422   2.096
   48   3HG2  VAL   7          HG23      VAL   7  -1.357   9.146   1.842
   49    H    CYS   8           HN       CYS   8   0.990   5.801  -0.347
   50    HA   CYS   8           HA       CYS   8   0.122   3.107  -0.608
   51   1HB   CYS   8          HB2       CYS   8   1.535   3.035  -2.460
   52   2HB   CYS   8          HB1       CYS   8   1.286   4.767  -2.294
   53    H    GLU   9           HN       GLU   9   3.192   4.417   0.674
   54    HA   GLU   9           HA       GLU   9   4.243   1.853   1.355
   55   1HB   GLU   9          HB2       GLU   9   4.840   4.591   2.519
   56   2HB   GLU   9          HB1       GLU   9   5.802   3.143   2.818
   57   1HG   GLU   9          HG2       GLU   9   6.024   2.950   0.271
   58   2HG   GLU   9          HG1       GLU   9   5.390   4.594   0.199
   59    H    PHE  10           HN       PHE  10   1.996   4.056   3.034
   60    HA   PHE  10           HA       PHE  10   2.323   2.782   5.578
   61   1HB   PHE  10          HB2       PHE  10   1.253   4.983   5.427
   62   2HB   PHE  10          HB1       PHE  10  -0.065   4.291   4.474
   63    HD1  PHE  10           HD1      PHE  10   1.477   4.484   7.809
   64    HD2  PHE  10           HD2      PHE  10  -1.709   2.811   5.475
   65    HE1  PHE  10           HE1      PHE  10   0.352   3.742   9.893
   66    HE2  PHE  10           HE2      PHE  10  -2.848   2.069   7.558
   67    HZ   PHE  10           HZ       PHE  10  -1.814   2.539   9.764
   68    H    LEU  11           HN       LEU  11  -0.071   2.280   2.947
   69    HA   LEU  11           HA       LEU  11  -1.472   0.134   4.255
   70   1HB   LEU  11          HB2       LEU  11  -1.075   0.596   1.283
   71   2HB   LEU  11          HB1       LEU  11  -2.244  -0.518   2.001
   72    HG   LEU  11           HG       LEU  11  -2.219   2.423   2.729
   73   1HD1  LEU  11          HD11      LEU  11  -2.478   2.478   0.351
   74   2HD1  LEU  11          HD12      LEU  11  -4.106   2.609   1.017
   75   3HD1  LEU  11          HD13      LEU  11  -3.541   1.071   0.366
   76   1HD2  LEU  11          HD21      LEU  11  -3.576   1.095   4.201
   77   2HD2  LEU  11          HD22      LEU  11  -4.262   0.182   2.857
   78   3HD2  LEU  11          HD23      LEU  11  -4.689   1.876   3.080
   79    H    VAL  12           HN       VAL  12   1.355   0.096   2.012
   80    HA   VAL  12           HA       VAL  12   1.575  -2.717   1.864
   81    HB   VAL  12           HB       VAL  12   3.518  -0.413   1.620
   82   1HG1  VAL  12          HG11      VAL  12   4.951  -2.135   2.488
   83   2HG1  VAL  12          HG12      VAL  12   5.174  -2.116   0.743
   84   3HG1  VAL  12          HG13      VAL  12   4.173  -3.365   1.490
   85   1HG2  VAL  12          HG21      VAL  12   3.505  -1.030  -0.717
   86   2HG2  VAL  12          HG22      VAL  12   1.829  -0.972  -0.171
   87   3HG2  VAL  12          HG23      VAL  12   2.639  -2.528  -0.368
   88    H    LYS  13           HN       LYS  13   3.137  -0.446   4.197
   89    HA   LYS  13           HA       LYS  13   4.522  -2.434   5.690
   90   1HB   LYS  13          HB2       LYS  13   5.086  -0.153   6.096
   91   2HB   LYS  13          HB1       LYS  13   3.416   0.278   6.455
   92   1HG   LYS  13          HG2       LYS  13   3.504  -0.572   8.611
   93   2HG   LYS  13          HG1       LYS  13   4.659  -1.834   8.184
   94   1HD   LYS  13          HD2       LYS  13   5.724  -0.162   9.630
   95   2HD   LYS  13          HD1       LYS  13   6.451  -0.129   8.024
   96   1HE   LYS  13          HE2       LYS  13   5.139   1.814   7.407
   97   2HE   LYS  13          HE1       LYS  13   4.232   1.729   8.918
   98   1HZ   LYS  13          HZ1       LYS  13   6.323   3.289   8.626
   99   2HZ   LYS  13          HZ2       LYS  13   7.141   1.880   9.104
  100   3HZ   LYS  13          HZ3       LYS  13   5.951   2.558  10.110
  101    H    GLU  14           HN       GLU  14   1.243  -1.155   6.055
  102    HA   GLU  14           HA       GLU  14   0.654  -2.719   8.415
  103   1HB   GLU  14          HB2       GLU  14  -0.560  -0.602   7.145
  104   2HB   GLU  14          HB1       GLU  14  -1.641  -1.915   6.693
  105   1HG   GLU  14          HG2       GLU  14  -0.789  -1.264   9.536
  106   2HG   GLU  14          HG1       GLU  14  -2.333  -0.819   8.815
  107    H    VAL  15           HN       VAL  15   0.178  -3.260   4.930
  108    HA   VAL  15           HA       VAL  15  -1.406  -5.627   5.317
  109    HB   VAL  15           HB       VAL  15   0.144  -4.509   2.978
  110   1HG1  VAL  15          HG11      VAL  15   0.472  -6.890   2.706
  111   2HG1  VAL  15          HG12      VAL  15  -0.846  -6.418   1.628
  112   3HG1  VAL  15          HG13      VAL  15  -1.204  -7.220   3.157
  113   1HG2  VAL  15          HG21      VAL  15  -2.081  -3.581   3.566
  114   2HG2  VAL  15          HG22      VAL  15  -2.783  -5.192   3.410
  115   3HG2  VAL  15          HG23      VAL  15  -2.105  -4.384   1.995
  116    H    THR  16           HN       THR  16   2.149  -5.202   4.886
  117    HA   THR  16           HA       THR  16   2.575  -8.011   4.752
  118    HB   THR  16           HB       THR  16   4.823  -7.688   4.906
  119    HG1  THR  16           HG1      THR  16   5.692  -6.572   6.464
  120   1HG2  THR  16          HG21      THR  16   4.505  -4.800   4.400
  121   2HG2  THR  16          HG22      THR  16   3.485  -5.827   3.393
  122   3HG2  THR  16          HG23      THR  16   5.231  -6.040   3.383
  123    H    LYS  17           HN       LYS  17   2.368  -5.857   7.583
  124    HA   LYS  17           HA       LYS  17   3.203  -7.850   9.453
  125   1HB   LYS  17          HB2       LYS  17   3.011  -5.650  10.343
  126   2HB   LYS  17          HB1       LYS  17   1.363  -5.462   9.738
  127   1HG   LYS  17          HG2       LYS  17   0.452  -6.860  11.391
  128   2HG   LYS  17          HG1       LYS  17   1.982  -7.677  11.689
  129   1HD   LYS  17          HD2       LYS  17   2.863  -5.578  12.701
  130   2HD   LYS  17          HD1       LYS  17   1.269  -4.845  12.490
  131   1HE   LYS  17          HE2       LYS  17   0.242  -6.416  13.972
  132   2HE   LYS  17          HE1       LYS  17   1.668  -7.454  13.980
  133   1HZ   LYS  17          HZ1       LYS  17   1.086  -5.449  15.764
  134   2HZ   LYS  17          HZ2       LYS  17   2.304  -4.794  14.778
  135   3HZ   LYS  17          HZ3       LYS  17   2.567  -6.258  15.601
  136    H    LEU  18           HN       LEU  18   0.223  -7.118   7.801
  137    HA   LEU  18           HA       LEU  18  -1.460  -8.975   9.267
  138   1HB   LEU  18          HB2       LEU  18  -1.727  -7.585   6.590
  139   2HB   LEU  18          HB1       LEU  18  -2.959  -8.620   7.224
  140    HG   LEU  18           HG       LEU  18  -2.527  -5.809   7.753
  141   1HD1  LEU  18          HD11      LEU  18  -4.719  -5.945   8.792
  142   2HD1  LEU  18          HD12      LEU  18  -4.590  -7.691   8.906
  143   3HD1  LEU  18          HD13      LEU  18  -4.696  -6.922   7.323
  144   1HD2  LEU  18          HD21      LEU  18  -2.622  -5.661  10.146
  145   2HD2  LEU  18          HD22      LEU  18  -1.209  -6.625   9.764
  146   3HD2  LEU  18          HD23      LEU  18  -2.685  -7.407  10.329
  147    H    ILE  19           HN       ILE  19   0.494  -9.114   6.344
  148    HA   ILE  19           HA       ILE  19  -0.321 -11.801   5.616
  149    HB   ILE  19           HB       ILE  19   2.137 -10.154   4.878
  150   1HG1  ILE  19          HG12      ILE  19  -0.365 -10.841   3.290
  151   2HG1  ILE  19          HG11      ILE  19  -0.097  -9.308   4.095
  152   1HG2  ILE  19          HG21      ILE  19   2.668 -12.510   4.626
  153   2HG2  ILE  19          HG22      ILE  19   2.402 -11.813   3.033
  154   3HG2  ILE  19          HG23      ILE  19   1.147 -12.800   3.782
  155   1HD1  ILE  19          HD11      ILE  19   1.547 -10.479   1.840
  156   2HD1  ILE  19          HD12      ILE  19   2.002  -9.034   2.738
  157   3HD1  ILE  19          HD13      ILE  19   0.529  -9.042   1.775
  158    H    ASP  20           HN       ASP  20   2.118 -10.302   7.625
  159    HA   ASP  20           HA       ASP  20   3.613 -12.745   8.134
  160   1HB   ASP  20          HB2       ASP  20   4.545 -10.406   8.317
  161   2HB   ASP  20          HB1       ASP  20   3.568 -10.201   9.772
  162    H    ASN  21           HN       ASN  21   0.725 -11.290   9.504
  163    HA   ASN  21           HA       ASN  21   1.011 -12.968  11.920
  164   1HB   ASN  21          HB2       ASN  21   0.069 -10.674  12.200
  165   2HB   ASN  21          HB1       ASN  21  -1.269 -11.104  11.133
  166   1HD2  ASN  21          HD21      ASN  21  -0.113 -11.273  14.400
  167   2HD2  ASN  21          HD22      ASN  21  -1.386 -12.205  15.026
  168    H    ASN  22           HN       ASN  22   0.139 -13.596   8.859
  169    HA   ASN  22           HA       ASN  22  -0.685 -15.625   8.025
  170   1HB   ASN  22          HB2       ASN  22  -0.194 -16.373  10.508
  171   2HB   ASN  22          HB1       ASN  22  -1.951 -16.394  10.639
  172   1HD2  ASN  22          HD21      ASN  22  -2.979 -17.526   8.500
  173   2HD2  ASN  22          HD22      ASN  22  -2.253 -19.005   8.091
  174    H    LYS  23           HN       LYS  23  -2.307 -13.258   7.768
  175    HA   LYS  23           HA       LYS  23  -5.079 -14.201   8.313
  176   1HB   LYS  23          HB2       LYS  23  -4.328 -11.615   7.054
  177   2HB   LYS  23          HB1       LYS  23  -5.803 -12.010   7.919
  178   1HG   LYS  23          HG2       LYS  23  -3.653 -12.472   9.763
  179   2HG   LYS  23          HG1       LYS  23  -3.309 -10.932   8.993
  180   1HD   LYS  23          HD2       LYS  23  -5.427 -10.012   9.704
  181   2HD   LYS  23          HD1       LYS  23  -6.004 -11.602  10.211
  182   1HE   LYS  23          HE2       LYS  23  -4.161 -11.677  11.902
  183   2HE   LYS  23          HE1       LYS  23  -3.742 -10.024  11.459
  184   1HZ   LYS  23          HZ1       LYS  23  -6.538 -10.404  12.012
  185   2HZ   LYS  23          HZ2       LYS  23  -5.471  -9.207  12.575
  186   3HZ   LYS  23          HZ3       LYS  23  -5.540 -10.718  13.348
  187    H    THR  24           HN       THR  24  -6.590 -14.474   6.570
  188    HA   THR  24           HA       THR  24  -5.423 -15.378   4.032
  189    HB   THR  24           HB       THR  24  -7.513 -16.277   3.562
  190    HG1  THR  24           HG1      THR  24  -8.918 -14.712   3.446
  191   1HG2  THR  24          HG21      THR  24  -8.485 -17.149   5.594
  192   2HG2  THR  24          HG22      THR  24  -7.755 -15.860   6.546
  193   3HG2  THR  24          HG23      THR  24  -6.735 -17.087   5.797
  194    H    GLU  25           HN       GLU  25  -6.600 -14.655   1.968
  195    HA   GLU  25           HA       GLU  25  -6.096 -11.838   1.558
  196   1HB   GLU  25          HB2       GLU  25  -6.080 -13.763  -0.187
  197   2HB   GLU  25          HB1       GLU  25  -7.831 -13.562  -0.233
  198   1HG   GLU  25          HG2       GLU  25  -7.343 -11.058  -0.644
  199   2HG   GLU  25          HG1       GLU  25  -5.694 -11.574  -1.002
  200    H    LYS  26           HN       LYS  26  -9.070 -13.768   1.877
  201    HA   LYS  26           HA       LYS  26 -10.969 -11.722   1.520
  202   1HB   LYS  26          HB2       LYS  26 -11.396 -14.218   1.763
  203   2HB   LYS  26          HB1       LYS  26 -11.258 -13.978   3.499
  204   1HG   LYS  26          HG2       LYS  26 -13.557 -13.719   3.233
  205   2HG   LYS  26          HG1       LYS  26 -13.035 -12.046   3.062
  206   1HD   LYS  26          HD2       LYS  26 -12.992 -12.349   0.583
  207   2HD   LYS  26          HD1       LYS  26 -13.601 -13.989   0.800
  208   1HE   LYS  26          HE2       LYS  26 -14.997 -11.415   1.578
  209   2HE   LYS  26          HE1       LYS  26 -15.483 -12.545   0.313
  210   1HZ   LYS  26          HZ1       LYS  26 -15.504 -12.965   3.242
  211   2HZ   LYS  26          HZ2       LYS  26 -15.616 -14.255   2.142
  212   3HZ   LYS  26          HZ3       LYS  26 -16.809 -13.046   2.163
  213    H    GLU  27           HN       GLU  27  -9.048 -12.448   4.373
  214    HA   GLU  27           HA       GLU  27 -10.595 -10.663   6.094
  215   1HB   GLU  27          HB2       GLU  27  -7.945 -12.069   6.380
  216   2HB   GLU  27          HB1       GLU  27  -8.511 -10.909   7.578
  217   1HG   GLU  27          HG2       GLU  27 -10.174 -13.265   6.679
  218   2HG   GLU  27          HG1       GLU  27  -9.098 -13.329   8.071
  219    H    ILE  28           HN       ILE  28  -7.618 -10.332   4.146
  220    HA   ILE  28           HA       ILE  28  -6.866  -7.781   5.221
  221    HB   ILE  28           HB       ILE  28  -6.375  -8.712   2.382
  222   1HG1  ILE  28          HG12      ILE  28  -5.592  -9.993   4.896
  223   2HG1  ILE  28          HG11      ILE  28  -5.440 -10.588   3.272
  224   1HG2  ILE  28          HG21      ILE  28  -4.680  -7.056   4.267
  225   2HG2  ILE  28          HG22      ILE  28  -5.686  -6.421   2.968
  226   3HG2  ILE  28          HG23      ILE  28  -4.307  -7.444   2.587
  227   1HD1  ILE  28          HD11      ILE  28  -3.337  -9.332   2.997
  228   2HD1  ILE  28          HD12      ILE  28  -3.262 -10.469   4.348
  229   3HD1  ILE  28          HD13      ILE  28  -3.487  -8.748   4.657
  230    H    LEU  29           HN       LEU  29  -8.980  -8.729   2.523
  231    HA   LEU  29           HA       LEU  29  -9.516  -6.000   1.729
  232   1HB   LEU  29          HB2       LEU  29 -11.179  -8.483   1.229
  233   2HB   LEU  29          HB1       LEU  29 -11.220  -6.980   0.306
  234    HG   LEU  29           HG       LEU  29  -8.788  -8.782   0.581
  235   1HD1  LEU  29          HD11      LEU  29 -10.487  -9.885  -0.762
  236   2HD1  LEU  29          HD12      LEU  29  -9.250  -9.254  -1.849
  237   3HD1  LEU  29          HD13      LEU  29 -10.788  -8.407  -1.675
  238   1HD2  LEU  29          HD21      LEU  29  -8.132  -7.280  -1.475
  239   2HD2  LEU  29          HD22      LEU  29  -7.949  -6.621   0.146
  240   3HD2  LEU  29          HD23      LEU  29  -9.342  -6.168  -0.837
  241    H    ASP  30           HN       ASP  30 -10.888  -8.225   4.047
  242    HA   ASP  30           HA       ASP  30 -13.340  -6.744   4.540
  243   1HB   ASP  30          HB2       ASP  30 -11.777  -8.646   6.323
  244   2HB   ASP  30          HB1       ASP  30 -13.395  -8.040   6.677
  245    H    ALA  31           HN       ALA  31 -10.129  -6.766   6.083
  246    HA   ALA  31           HA       ALA  31 -10.778  -4.772   8.054
  247   1HB   ALA  31          HB1       ALA  31  -8.468  -4.789   8.582
  248   2HB   ALA  31          HB2       ALA  31  -8.018  -5.311   6.957
  249   3HB   ALA  31          HB3       ALA  31  -8.829  -6.430   8.050
  250    H    PHE  32           HN       PHE  32  -9.826  -4.520   4.670
  251    HA   PHE  32           HA       PHE  32  -8.735  -1.927   4.563
  252   1HB   PHE  32          HB2       PHE  32 -10.473  -3.550   2.737
  253   2HB   PHE  32          HB1       PHE  32 -10.143  -1.883   2.320
  254    HD1  PHE  32           HD1      PHE  32  -7.432  -3.602   4.164
  255    HD2  PHE  32           HD2      PHE  32  -9.093  -2.832   0.259
  256    HE1  PHE  32           HE1      PHE  32  -5.282  -4.181   3.125
  257    HE2  PHE  32           HE2      PHE  32  -6.925  -3.444  -0.766
  258    HZ   PHE  32           HZ       PHE  32  -5.023  -4.122   0.667
  259    H    ASP  33           HN       ASP  33 -11.823  -2.874   5.668
  260    HA   ASP  33           HA       ASP  33 -13.121  -0.316   5.031
  261   1HB   ASP  33          HB2       ASP  33 -14.570  -2.209   5.032
  262   2HB   ASP  33          HB1       ASP  33 -13.968  -2.768   6.587
  263    H    LYS  34           HN       LYS  34 -11.347  -1.736   7.720
  264    HA   LYS  34           HA       LYS  34 -11.955   0.700   9.371
  265   1HB   LYS  34          HB2       LYS  34 -10.895  -1.975  10.322
  266   2HB   LYS  34          HB1       LYS  34 -11.414  -0.620  11.324
  267   1HG   LYS  34          HG2       LYS  34 -13.702  -0.878  10.116
  268   2HG   LYS  34          HG1       LYS  34 -13.097  -2.467   9.639
  269   1HD   LYS  34          HD2       LYS  34 -13.282  -1.460  12.493
  270   2HD   LYS  34          HD1       LYS  34 -14.410  -2.586  11.738
  271   1HE   LYS  34          HE2       LYS  34 -12.382  -4.064  11.241
  272   2HE   LYS  34          HE1       LYS  34 -11.479  -3.021  12.339
  273   1HZ   LYS  34          HZ1       LYS  34 -12.422  -4.991  13.438
  274   2HZ   LYS  34          HZ2       LYS  34 -13.984  -4.448  13.049
  275   3HZ   LYS  34          HZ3       LYS  34 -13.002  -3.540  14.097
  276    H    MET  35           HN       MET  35  -9.674  -0.330   7.286
  277    HA   MET  35           HA       MET  35  -7.303   0.159   8.955
  278   1HB   MET  35          HB2       MET  35  -7.783  -1.164   6.528
  279   2HB   MET  35          HB1       MET  35  -6.799   0.207   6.057
  280   1HG   MET  35          HG2       MET  35  -5.266  -0.484   8.008
  281   2HG   MET  35          HG1       MET  35  -6.149  -2.008   7.990
  282   1HE   MET  35          HE1       MET  35  -4.633  -4.023   5.368
  283   2HE   MET  35          HE2       MET  35  -6.118  -3.730   6.273
  284   3HE   MET  35          HE3       MET  35  -4.576  -3.807   7.122
  285    H    CYS  36           HN       CYS  36  -9.054   1.941   6.328
  286    HA   CYS  36           HA       CYS  36  -7.203   4.141   6.471
  287   1HB   CYS  36          HB2       CYS  36  -9.971   3.767   5.344
  288   2HB   CYS  36          HB1       CYS  36  -9.378   5.414   5.558
  289    H    SER  37           HN       SER  37  -9.169   2.846   8.729
  290    HA   SER  37           HA       SER  37 -10.032   5.400   9.971
  291   1HB   SER  37          HB2       SER  37 -11.394   3.267  10.084
  292   2HB   SER  37          HB1       SER  37 -10.156   2.614  11.152
  293    HG   SER  37           HG       SER  37 -11.982   4.705  11.559
  294    H    LYS  38           HN       LYS  38  -7.069   4.290   9.653
  295    HA   LYS  38           HA       LYS  38  -6.285   4.819  12.510
  296   1HB   LYS  38          HB2       LYS  38  -5.252   2.845  10.490
  297   2HB   LYS  38          HB1       LYS  38  -4.135   3.492  11.692
  298   1HG   LYS  38          HG2       LYS  38  -5.362   2.594  13.496
  299   2HG   LYS  38          HG1       LYS  38  -6.815   2.378  12.522
  300   1HD   LYS  38          HD2       LYS  38  -5.554   0.241  13.027
  301   2HD   LYS  38          HD1       LYS  38  -5.828   0.546  11.313
  302   1HE   LYS  38          HE2       LYS  38  -3.585   1.184  10.944
  303   2HE   LYS  38          HE1       LYS  38  -3.286   1.458  12.661
  304   1HZ   LYS  38          HZ1       LYS  38  -4.135  -1.207  12.194
  305   2HZ   LYS  38          HZ2       LYS  38  -2.706  -0.648  12.923
  306   3HZ   LYS  38          HZ3       LYS  38  -2.783  -0.844  11.237
  307    H    LEU  39           HN       LEU  39  -6.565   6.572   9.930
  308    HA   LEU  39           HA       LEU  39  -3.855   7.852  10.164
  309   1HB   LEU  39          HB2       LEU  39  -5.674   7.777   7.736
  310   2HB   LEU  39          HB1       LEU  39  -4.115   8.584   7.810
  311    HG   LEU  39           HG       LEU  39  -4.518   5.608   8.215
  312   1HD1  LEU  39          HD11      LEU  39  -3.306   6.994   5.824
  313   2HD1  LEU  39          HD12      LEU  39  -5.008   6.546   5.887
  314   3HD1  LEU  39          HD13      LEU  39  -3.765   5.301   5.974
  315   1HD2  LEU  39          HD21      LEU  39  -2.493   6.208   9.302
  316   2HD2  LEU  39          HD22      LEU  39  -2.101   7.417   8.079
  317   3HD2  LEU  39          HD23      LEU  39  -1.972   5.706   7.697
  318    HA   PRO  40           HA       PRO  40  -6.053  11.407  11.674
  319   1HB   PRO  40          HB2       PRO  40  -4.509  13.198   9.898
  320   2HB   PRO  40          HB1       PRO  40  -4.523  13.129  11.667
  321   1HG   PRO  40          HG2       PRO  40  -2.472  12.138   9.943
  322   2HG   PRO  40          HG1       PRO  40  -2.590  11.899  11.693
  323   1HD   PRO  40          HD2       PRO  40  -2.945   9.925   9.635
  324   2HD   PRO  40          HD1       PRO  40  -3.106   9.692  11.381
  325    H    LYS  41           HN       LYS  41  -7.665  13.051  10.806
  326    HA   LYS  41           HA       LYS  41  -9.101  11.978   8.555
  327   1HB   LYS  41          HB2       LYS  41 -10.020  13.405  10.487
  328   2HB   LYS  41          HB1       LYS  41  -9.392  14.791   9.595
  329   1HG   LYS  41          HG2       LYS  41 -10.760  14.241   7.664
  330   2HG   LYS  41          HG1       LYS  41 -11.298  12.743   8.421
  331   1HD   LYS  41          HD2       LYS  41 -12.351  14.065  10.241
  332   2HD   LYS  41          HD1       LYS  41 -11.862  15.549   9.421
  333   1HE   LYS  41          HE2       LYS  41 -13.720  13.419   8.324
  334   2HE   LYS  41          HE1       LYS  41 -14.177  15.042   8.840
  335   1HZ   LYS  41          HZ1       LYS  41 -12.375  15.734   7.118
  336   2HZ   LYS  41          HZ2       LYS  41 -13.941  15.330   6.597
  337   3HZ   LYS  41          HZ3       LYS  41 -12.679  14.201   6.458
  338    H    SER  42           HN       SER  42  -6.433  14.145   8.647
  339    HA   SER  42           HA       SER  42  -7.151  15.559   6.237
  340   1HB   SER  42          HB2       SER  42  -4.432  15.254   7.542
  341   2HB   SER  42          HB1       SER  42  -4.834  16.420   6.284
  342    HG   SER  42           HG       SER  42  -6.663  16.798   8.027
  343    H    LEU  43           HN       LEU  43  -6.004  12.424   6.587
  344    HA   LEU  43           HA       LEU  43  -5.135  12.407   3.699
  345   1HB   LEU  43          HB2       LEU  43  -4.474  10.275   5.738
  346   2HB   LEU  43          HB1       LEU  43  -3.765  10.503   4.142
  347    HG   LEU  43           HG       LEU  43  -3.432  12.289   6.546
  348   1HD1  LEU  43          HD11      LEU  43  -2.014  10.423   6.795
  349   2HD1  LEU  43          HD12      LEU  43  -0.984  11.672   6.100
  350   3HD1  LEU  43          HD13      LEU  43  -1.623  10.388   5.076
  351   1HD2  LEU  43          HD21      LEU  43  -3.471  13.746   4.640
  352   2HD2  LEU  43          HD22      LEU  43  -2.546  12.601   3.672
  353   3HD2  LEU  43          HD23      LEU  43  -1.769  13.468   4.994
  354    H    SER  44           HN       SER  44  -7.684  11.707   5.698
  355    HA   SER  44           HA       SER  44  -8.642   9.190   5.308
  356   1HB   SER  44          HB2       SER  44 -10.071  10.809   6.355
  357   2HB   SER  44          HB1       SER  44 -10.134  11.793   4.897
  358    HG   SER  44           HG       SER  44 -10.922   9.144   4.647
  359    H    GLU  45           HN       GLU  45  -9.641  11.634   2.993
  360    HA   GLU  45           HA       GLU  45 -10.724  10.072   1.075
  361   1HB   GLU  45          HB2       GLU  45  -9.251  12.676   0.704
  362   2HB   GLU  45          HB1       GLU  45 -10.453  12.008  -0.401
  363   1HG   GLU  45          HG2       GLU  45 -11.000  12.632   2.516
  364   2HG   GLU  45          HG1       GLU  45 -11.399  13.711   1.181
  365    H    GLU  46           HN       GLU  46  -7.418  11.353   0.754
  366    HA   GLU  46           HA       GLU  46  -6.892  10.215  -1.775
  367   1HB   GLU  46          HB2       GLU  46  -4.803  10.417   0.386
  368   2HB   GLU  46          HB1       GLU  46  -4.624  10.677  -1.342
  369   1HG   GLU  46          HG2       GLU  46  -4.697  12.894  -0.678
  370   2HG   GLU  46          HG1       GLU  46  -6.426  12.621  -0.864
  371    H    CYS  47           HN       CYS  47  -7.138   8.705   1.333
  372    HA   CYS  47           HA       CYS  47  -5.671   6.311   0.504
  373   1HB   CYS  47          HB2       CYS  47  -5.958   5.597   2.695
  374   2HB   CYS  47          HB1       CYS  47  -6.257   7.316   2.948
  375    H    GLN  48           HN       GLN  48  -9.079   7.238   0.893
  376    HA   GLN  48           HA       GLN  48 -10.243   4.758   0.229
  377   1HB   GLN  48          HB2       GLN  48 -11.091   7.622  -0.055
  378   2HB   GLN  48          HB1       GLN  48 -12.024   6.426  -0.951
  379   1HG   GLN  48          HG2       GLN  48 -12.922   6.909   1.351
  380   2HG   GLN  48          HG1       GLN  48 -12.539   5.210   1.075
  381   1HE2  GLN  48          HE21      GLN  48 -11.258   4.260   2.663
  382   2HE2  GLN  48          HE22      GLN  48 -10.252   5.107   3.738
  383    H    GLU  49           HN       GLU  49  -8.980   7.295  -1.939
  384    HA   GLU  49           HA       GLU  49  -9.789   5.974  -4.349
  385   1HB   GLU  49          HB2       GLU  49  -7.677   8.062  -3.775
  386   2HB   GLU  49          HB1       GLU  49  -8.054   7.497  -5.403
  387   1HG   GLU  49          HG2       GLU  49 -10.150   8.589  -3.512
  388   2HG   GLU  49          HG1       GLU  49  -9.291   9.594  -4.680
  389    H    VAL  50           HN       VAL  50  -6.737   5.906  -2.481
  390    HA   VAL  50           HA       VAL  50  -5.346   4.280  -4.395
  391    HB   VAL  50           HB       VAL  50  -4.817   4.443  -1.420
  392   1HG1  VAL  50          HG11      VAL  50  -3.095   3.602  -3.760
  393   2HG1  VAL  50          HG12      VAL  50  -3.705   2.558  -2.475
  394   3HG1  VAL  50          HG13      VAL  50  -2.517   3.807  -2.107
  395   1HG2  VAL  50          HG21      VAL  50  -4.814   6.631  -2.940
  396   2HG2  VAL  50          HG22      VAL  50  -3.275   5.989  -3.494
  397   3HG2  VAL  50          HG23      VAL  50  -3.515   6.352  -1.785
  398    H    VAL  51           HN       VAL  51  -6.934   3.480  -1.276
  399    HA   VAL  51           HA       VAL  51  -6.526   0.702  -1.547
  400    HB   VAL  51           HB       VAL  51  -8.780   2.112  -0.067
  401   1HG1  VAL  51          HG11      VAL  51  -7.499  -0.603   0.288
  402   2HG1  VAL  51          HG12      VAL  51  -9.168  -0.270  -0.180
  403   3HG1  VAL  51          HG13      VAL  51  -8.611   0.127   1.445
  404   1HG2  VAL  51          HG21      VAL  51  -6.060   1.311   0.988
  405   2HG2  VAL  51          HG22      VAL  51  -7.305   2.226   1.842
  406   3HG2  VAL  51          HG23      VAL  51  -6.463   2.948   0.469
  407    H    ASP  52           HN       ASP  52  -9.432   2.574  -2.326
  408    HA   ASP  52           HA       ASP  52 -10.951   0.397  -3.307
  409   1HB   ASP  52          HB2       ASP  52 -11.855   2.623  -2.700
  410   2HB   ASP  52          HB1       ASP  52 -11.136   3.292  -4.163
  411    H    THR  53           HN       THR  53  -8.821   2.649  -5.082
  412    HA   THR  53           HA       THR  53  -9.416   1.301  -7.633
  413    HB   THR  53           HB       THR  53  -7.384   3.461  -7.053
  414    HG1  THR  53           HG1      THR  53  -9.806   4.065  -8.226
  415   1HG2  THR  53          HG21      THR  53  -7.136   2.251  -9.204
  416   2HG2  THR  53          HG22      THR  53  -7.621   3.929  -9.446
  417   3HG2  THR  53          HG23      THR  53  -8.812   2.637  -9.595
  418    H    TYR  54           HN       TYR  54  -6.642   1.552  -5.398
  419    HA   TYR  54           HA       TYR  54  -5.261  -0.505  -7.094
  420   1HB   TYR  54          HB2       TYR  54  -4.172   1.507  -5.137
  421   2HB   TYR  54          HB1       TYR  54  -3.201   0.268  -5.928
  422    HD1  TYR  54           HD1      TYR  54  -2.706   0.391  -8.324
  423    HD2  TYR  54           HD2      TYR  54  -5.154   3.339  -6.414
  424    HE1  TYR  54           HE1      TYR  54  -2.496   1.860 -10.314
  425    HE2  TYR  54           HE2      TYR  54  -4.951   4.813  -8.379
  426    HH   TYR  54           HH       TYR  54  -4.465   4.595 -10.791
  427    H    GLY  55           HN       GLY  55  -7.299  -1.147  -5.060
  428   1HA   GLY  55          HA2       GLY  55  -5.849  -2.195  -2.761
  429   2HA   GLY  55          HA1       GLY  55  -7.560  -2.425  -3.094
  430    H    SER  56           HN       SER  56  -7.663  -3.808  -5.441
  431    HA   SER  56           HA       SER  56  -6.791  -6.390  -4.590
  432   1HB   SER  56          HB2       SER  56  -7.468  -5.815  -7.465
  433   2HB   SER  56          HB1       SER  56  -7.814  -7.254  -6.504
  434    HG   SER  56           HG       SER  56  -9.080  -5.578  -5.187
  435    H    SER  57           HN       SER  57  -5.395  -3.947  -6.635
  436    HA   SER  57           HA       SER  57  -3.523  -5.773  -7.863
  437   1HB   SER  57          HB2       SER  57  -2.460  -3.741  -8.820
  438   2HB   SER  57          HB1       SER  57  -4.206  -3.717  -9.044
  439    HG   SER  57           HG       SER  57  -2.622  -2.004  -7.692
  440    H    ILE  58           HN       ILE  58  -3.146  -3.333  -5.274
  441    HA   ILE  58           HA       ILE  58  -0.361  -3.768  -4.791
  442    HB   ILE  58           HB       ILE  58  -2.642  -3.054  -2.921
  443   1HG1  ILE  58          HG12      ILE  58  -0.359  -1.378  -4.016
  444   2HG1  ILE  58          HG11      ILE  58  -1.972  -1.410  -4.716
  445   1HG2  ILE  58          HG21      ILE  58  -1.014  -4.028  -1.486
  446   2HG2  ILE  58          HG22      ILE  58  -0.665  -2.303  -1.411
  447   3HG2  ILE  58          HG23      ILE  58   0.326  -3.359  -2.413
  448   1HD1  ILE  58          HD11      ILE  58  -2.789  -0.811  -2.311
  449   2HD1  ILE  58          HD12      ILE  58  -2.043   0.463  -3.271
  450   3HD1  ILE  58          HD13      ILE  58  -1.106  -0.366  -2.024
  451    H    LEU  59           HN       LEU  59  -3.197  -5.146  -3.273
  452    HA   LEU  59           HA       LEU  59  -1.904  -7.095  -1.680
  453   1HB   LEU  59          HB2       LEU  59  -4.210  -6.447  -1.284
  454   2HB   LEU  59          HB1       LEU  59  -4.689  -7.011  -2.882
  455    HG   LEU  59           HG       LEU  59  -4.211  -9.314  -2.278
  456   1HD1  LEU  59          HD11      LEU  59  -3.077  -8.030   0.214
  457   2HD1  LEU  59          HD12      LEU  59  -2.334  -9.231  -0.839
  458   3HD1  LEU  59          HD13      LEU  59  -3.635  -9.703   0.247
  459   1HD2  LEU  59          HD21      LEU  59  -6.419  -8.862  -1.661
  460   2HD2  LEU  59          HD22      LEU  59  -5.954  -7.697  -0.421
  461   3HD2  LEU  59          HD23      LEU  59  -5.757  -9.421  -0.129
  462    H    SER  60           HN       SER  60  -2.666  -7.100  -5.135
  463    HA   SER  60           HA       SER  60  -2.417  -9.971  -5.242
  464   1HB   SER  60          HB2       SER  60  -3.798  -8.991  -6.924
  465   2HB   SER  60          HB1       SER  60  -2.542  -7.849  -7.391
  466    HG   SER  60           HG       SER  60  -1.537 -10.285  -7.612
  467    H    ILE  61           HN       ILE  61  -0.385  -7.172  -5.874
  468    HA   ILE  61           HA       ILE  61   1.858  -8.495  -7.095
  469    HB   ILE  61           HB       ILE  61   1.935  -5.982  -5.407
  470   1HG1  ILE  61          HG12      ILE  61   0.337  -6.426  -7.777
  471   2HG1  ILE  61          HG11      ILE  61   0.575  -4.926  -6.889
  472   1HG2  ILE  61          HG21      ILE  61   3.806  -5.385  -6.889
  473   2HG2  ILE  61          HG22      ILE  61   3.607  -6.907  -7.759
  474   3HG2  ILE  61          HG23      ILE  61   4.098  -6.914  -6.068
  475   1HD1  ILE  61          HD11      ILE  61   2.381  -5.936  -9.102
  476   2HD1  ILE  61          HD12      ILE  61   2.572  -4.422  -8.214
  477   3HD1  ILE  61          HD13      ILE  61   1.171  -4.664  -9.257
  478    H    LEU  62           HN       LEU  62   1.277  -7.405  -3.753
  479    HA   LEU  62           HA       LEU  62   3.723  -8.208  -2.662
  480   1HB   LEU  62          HB2       LEU  62   1.110  -7.392  -1.703
  481   2HB   LEU  62          HB1       LEU  62   1.708  -8.687  -0.672
  482    HG   LEU  62           HG       LEU  62   3.494  -6.353  -1.398
  483   1HD1  LEU  62          HD11      LEU  62   1.753  -5.126  -0.463
  484   2HD1  LEU  62          HD12      LEU  62   2.710  -5.511   0.962
  485   3HD1  LEU  62          HD13      LEU  62   1.257  -6.436   0.601
  486   1HD2  LEU  62          HD21      LEU  62   3.415  -7.942   1.167
  487   2HD2  LEU  62          HD22      LEU  62   4.768  -7.082   0.447
  488   3HD2  LEU  62          HD23      LEU  62   4.221  -8.595  -0.258
  489    H    LEU  63           HN       LEU  63   0.933 -10.167  -3.483
  490    HA   LEU  63           HA       LEU  63   1.929 -12.531  -2.063
  491   1HB   LEU  63          HB2       LEU  63  -0.238 -12.255  -4.165
  492   2HB   LEU  63          HB1       LEU  63   0.073 -13.697  -3.196
  493    HG   LEU  63           HG       LEU  63  -0.680 -10.976  -2.095
  494   1HD1  LEU  63          HD11      LEU  63  -2.272 -13.541  -2.377
  495   2HD1  LEU  63          HD12      LEU  63  -2.551 -12.039  -3.258
  496   3HD1  LEU  63          HD13      LEU  63  -2.821 -12.102  -1.517
  497   1HD2  LEU  63          HD21      LEU  63  -1.094 -12.579  -0.019
  498   2HD2  LEU  63          HD22      LEU  63   0.518 -11.950  -0.351
  499   3HD2  LEU  63          HD23      LEU  63   0.098 -13.595  -0.834
  500    H    GLU  64           HN       GLU  64   2.798 -11.084  -5.008
  501    HA   GLU  64           HA       GLU  64   3.575 -13.661  -6.214
  502   1HB   GLU  64          HB2       GLU  64   3.854 -10.771  -7.072
  503   2HB   GLU  64          HB1       GLU  64   4.682 -12.071  -7.931
  504   1HG   GLU  64          HG2       GLU  64   1.702 -12.076  -7.399
  505   2HG   GLU  64          HG1       GLU  64   2.416 -11.441  -8.880
  506    H    GLU  65           HN       GLU  65   4.657 -12.022  -3.695
  507    HA   GLU  65           HA       GLU  65   6.711 -12.337  -2.474
  508   1HB   GLU  65          HB2       GLU  65   6.744 -14.406  -4.173
  509   2HB   GLU  65          HB1       GLU  65   8.110 -13.513  -4.837
  510   1HG   GLU  65          HG2       GLU  65   9.030 -13.368  -2.487
  511   2HG   GLU  65          HG1       GLU  65   7.750 -14.473  -1.991
  512    H    VAL  66           HN       VAL  66   6.087  -9.997  -4.284
  513    HA   VAL  66           HA       VAL  66   8.776  -9.163  -5.253
  514    HB   VAL  66           HB       VAL  66   5.958  -8.178  -5.548
  515   1HG1  VAL  66          HG11      VAL  66   6.923  -6.109  -4.892
  516   2HG1  VAL  66          HG12      VAL  66   6.962  -6.081  -6.655
  517   3HG1  VAL  66          HG13      VAL  66   8.427  -6.453  -5.745
  518   1HG2  VAL  66          HG21      VAL  66   8.190  -8.228  -7.584
  519   2HG2  VAL  66          HG22      VAL  66   6.451  -8.274  -7.868
  520   3HG2  VAL  66          HG23      VAL  66   7.271  -9.678  -7.187
  521    H    SER  67           HN       SER  67   9.943  -7.462  -4.232
  522    HA   SER  67           HA       SER  67   9.802  -7.185  -1.459
  523   1HB   SER  67          HB2       SER  67  10.748  -4.848  -3.099
  524   2HB   SER  67          HB1       SER  67  11.463  -5.548  -1.652
  525    HG   SER  67           HG       SER  67  11.458  -7.467  -3.399
  526    HA   PRO  68           HA       PRO  68   6.268  -4.616  -0.798
  527   1HB   PRO  68          HB2       PRO  68   7.208  -3.117   1.435
  528   2HB   PRO  68          HB1       PRO  68   6.366  -4.664   1.499
  529   1HG   PRO  68          HG2       PRO  68   9.230  -4.109   1.929
  530   2HG   PRO  68          HG1       PRO  68   8.293  -5.539   2.388
  531   1HD   PRO  68          HD2       PRO  68  10.144  -5.386   0.246
  532   2HD   PRO  68          HD1       PRO  68   8.961  -6.682   0.526
  533    H    GLU  69           HN       GLU  69   9.402  -2.893  -0.664
  534    HA   GLU  69           HA       GLU  69   8.211  -0.301  -1.176
  535   1HB   GLU  69          HB2       GLU  69  10.271  -0.297  -0.020
  536   2HB   GLU  69          HB1       GLU  69  11.029  -1.375  -1.189
  537   1HG   GLU  69          HG2       GLU  69  11.210   0.324  -2.820
  538   2HG   GLU  69          HG1       GLU  69  10.031   1.354  -2.008
  539    H    LEU  70           HN       LEU  70   9.150  -2.930  -3.199
  540    HA   LEU  70           HA       LEU  70   9.548  -1.296  -5.573
  541   1HB   LEU  70          HB2       LEU  70   9.094  -4.265  -5.174
  542   2HB   LEU  70          HB1       LEU  70   9.220  -3.568  -6.775
  543    HG   LEU  70           HG       LEU  70  11.311  -3.198  -4.656
  544   1HD1  LEU  70          HD11      LEU  70  11.481  -5.119  -6.976
  545   2HD1  LEU  70          HD12      LEU  70  10.947  -5.623  -5.375
  546   3HD1  LEU  70          HD13      LEU  70  12.575  -4.991  -5.601
  547   1HD2  LEU  70          HD21      LEU  70  11.739  -1.525  -6.214
  548   2HD2  LEU  70          HD22      LEU  70  11.109  -2.474  -7.555
  549   3HD2  LEU  70          HD23      LEU  70  12.691  -2.842  -6.885
  550    H    VAL  71           HN       VAL  71   6.860  -2.348  -3.782
  551    HA   VAL  71           HA       VAL  71   4.932  -2.478  -5.888
  552    HB   VAL  71           HB       VAL  71   4.750  -2.021  -2.905
  553   1HG1  VAL  71          HG11      VAL  71   2.166  -2.127  -3.244
  554   2HG1  VAL  71          HG12      VAL  71   2.513  -1.548  -4.873
  555   3HG1  VAL  71          HG13      VAL  71   2.965  -0.574  -3.474
  556   1HG2  VAL  71          HG21      VAL  71   3.336  -4.088  -3.073
  557   2HG2  VAL  71          HG22      VAL  71   4.989  -4.305  -3.648
  558   3HG2  VAL  71          HG23      VAL  71   3.671  -4.116  -4.805
  559    H    CYS  72           HN       CYS  72   5.638   0.313  -3.698
  560    HA   CYS  72           HA       CYS  72   3.848   1.944  -5.125
  561   1HB   CYS  72          HB2       CYS  72   6.289   2.779  -3.509
  562   2HB   CYS  72          HB1       CYS  72   5.002   3.857  -4.013
  563    H    SER  73           HN       SER  73   7.174   1.076  -5.744
  564    HA   SER  73           HA       SER  73   7.626   3.189  -7.731
  565   1HB   SER  73          HB2       SER  73   9.190   0.619  -7.596
  566   2HB   SER  73          HB1       SER  73   9.746   2.215  -8.089
  567    HG   SER  73           HG       SER  73   9.610   2.885  -5.965
  568    H    MET  74           HN       MET  74   6.626  -0.238  -7.970
  569    HA   MET  74           HA       MET  74   6.704  -0.258 -10.894
  570   1HB   MET  74          HB2       MET  74   5.861  -2.117  -8.741
  571   2HB   MET  74          HB1       MET  74   4.969  -2.288 -10.250
  572   1HG   MET  74          HG2       MET  74   7.321  -2.341 -11.375
  573   2HG   MET  74          HG1       MET  74   7.913  -2.675  -9.753
  574   1HE   MET  74          HE1       MET  74   5.629  -5.765  -8.815
  575   2HE   MET  74          HE2       MET  74   4.825  -4.208  -8.976
  576   3HE   MET  74          HE3       MET  74   6.410  -4.299  -8.214
  577    H    LEU  75           HN       LEU  75   4.058   0.296  -8.540
  578    HA   LEU  75           HA       LEU  75   2.065   0.463 -10.642
  579   1HB   LEU  75          HB2       LEU  75   1.913   1.609  -7.846
  580   2HB   LEU  75          HB1       LEU  75   0.559   1.261  -8.917
  581    HG   LEU  75           HG       LEU  75   2.437  -0.736  -7.630
  582   1HD1  LEU  75          HD11      LEU  75   0.198  -1.642  -6.809
  583   2HD1  LEU  75          HD12      LEU  75  -0.501  -0.124  -7.363
  584   3HD1  LEU  75          HD13      LEU  75   0.733  -0.120  -6.103
  585   1HD2  LEU  75          HD21      LEU  75   0.457  -1.051  -9.882
  586   2HD2  LEU  75          HD22      LEU  75   0.805  -2.401  -8.802
  587   3HD2  LEU  75          HD23      LEU  75   2.099  -1.689  -9.761
  588    H    HIS  76           HN       HIS  76   4.584   2.316 -10.536
  589    HA   HIS  76           HA       HIS  76   5.086   4.539 -11.078
  590   1HB   HIS  76          HB2       HIS  76   2.371   4.492 -12.427
  591   2HB   HIS  76          HB1       HIS  76   3.773   5.464 -12.873
  592    HD1  HIS  76           HD1      HIS  76   6.028   3.752 -13.281
  593    HD2  HIS  76           HD2      HIS  76   2.205   2.281 -14.053
  594    HE1  HIS  76           HE1      HIS  76   6.324   1.761 -14.819
  595    H    LEU  77           HN       LEU  77   3.333   4.017  -8.577
  596    HA   LEU  77           HA       LEU  77   1.737   6.490  -8.452
  597   1HB   LEU  77          HB2       LEU  77   2.343   4.284  -6.474
  598   2HB   LEU  77          HB1       LEU  77   1.509   5.741  -5.982
  599    HG   LEU  77           HG       LEU  77   0.581   3.651  -7.945
  600   1HD1  LEU  77          HD11      LEU  77  -0.658   4.771  -5.425
  601   2HD1  LEU  77          HD12      LEU  77   0.256   3.273  -5.502
  602   3HD1  LEU  77          HD13      LEU  77  -1.270   3.421  -6.371
  603   1HD2  LEU  77          HD21      LEU  77  -0.382   6.479  -7.545
  604   2HD2  LEU  77          HD22      LEU  77  -1.562   5.222  -7.911
  605   3HD2  LEU  77          HD23      LEU  77  -0.257   5.555  -9.042
  606    H    CYS  78           HN       CYS  78   4.987   5.660  -7.976
  607    HA   CYS  78           HA       CYS  78   5.405   8.222  -6.469
  608   1HB   CYS  78          HB2       CYS  78   6.692   5.521  -6.021
  609   2HB   CYS  78          HB1       CYS  78   7.310   7.019  -5.317
  610    H    SER  79           HN       SER  79   7.314   9.209  -6.809
  611    HA   SER  79           HA       SER  79   9.304   9.760  -7.722
  612   1HB   SER  79          HB2       SER  79  10.462   8.451  -9.337
  613   2HB   SER  79          HB1       SER  79   9.476   7.260  -8.496
  614    HG   SER  79           HG       SER  79   7.869   7.748 -10.202
  615    H    GLY  80           HN       GLY  80   6.650  10.821  -8.261
  616   1HA   GLY  80          HA2       GLY  80   7.029  12.920  -9.936
  617   2HA   GLY  80          HA1       GLY  80   6.694  11.640 -11.102
  618    H    LEU  81           HN       LEU  81   5.243  14.056  -9.357
  619    HA   LEU  81           HA       LEU  81   2.628  13.651 -10.162
  620   1HB   LEU  81          HB2       LEU  81   3.327  11.815  -7.961
  621   2HB   LEU  81          HB1       LEU  81   1.999  12.867  -7.506
  622    HG   LEU  81           HG       LEU  81   1.966  11.416 -10.159
  623   1HD1  LEU  81          HD11      LEU  81   0.584   9.674  -9.007
  624   2HD1  LEU  81          HD12      LEU  81   1.033  10.397  -7.461
  625   3HD1  LEU  81          HD13      LEU  81   2.270   9.673  -8.488
  626   1HD2  LEU  81          HD21      LEU  81  -0.483  11.680  -9.835
  627   2HD2  LEU  81          HD22      LEU  81   0.348  13.236  -9.820
  628   3HD2  LEU  81          HD23      LEU  81  -0.178  12.502  -8.306
  629    H    VAL  82           HN       VAL  82   4.967  15.290  -8.809
  630    HA   VAL  82           HA       VAL  82   3.162  17.187  -7.311
  631    HB   VAL  82           HB       VAL  82   5.495  17.939  -6.343
  632   1HG1  VAL  82          HG11      VAL  82   3.879  17.060  -4.851
  633   2HG1  VAL  82          HG12      VAL  82   5.295  16.033  -4.620
  634   3HG1  VAL  82          HG13      VAL  82   3.939  15.463  -5.596
  635   1HG2  VAL  82          HG21      VAL  82   6.666  16.350  -7.988
  636   2HG2  VAL  82          HG22      VAL  82   6.089  15.036  -6.964
  637   3HG2  VAL  82          HG23      VAL  82   7.184  16.252  -6.305
  638    HA   PRO  83           HA       PRO  83   4.640  19.336 -11.123
  639   1HB   PRO  83          HB2       PRO  83   2.382  21.130 -10.972
  640   2HB   PRO  83          HB1       PRO  83   2.642  19.822 -12.134
  641   1HG   PRO  83          HG2       PRO  83   0.727  19.883  -9.977
  642   2HG   PRO  83          HG1       PRO  83   1.027  18.560 -11.115
  643   1HD   PRO  83          HD2       PRO  83   1.797  18.737  -8.304
  644   2HD   PRO  83          HD1       PRO  83   1.953  17.350  -9.402
  645    H    ARG  84           HN       ARG  84   4.559  19.977  -7.932
  646    HA   ARG  84           HA       ARG  84   6.138  22.411  -8.211
  647   1HB   ARG  84          HB2       ARG  84   3.763  23.249  -8.292
  648   2HB   ARG  84          HB1       ARG  84   3.531  22.586  -6.674
  649   1HG   ARG  84          HG2       ARG  84   5.362  24.000  -5.823
  650   2HG   ARG  84          HG1       ARG  84   5.608  24.659  -7.441
  651   1HD   ARG  84          HD2       ARG  84   3.374  25.619  -7.446
  652   2HD   ARG  84          HD1       ARG  84   3.004  24.853  -5.900
  653    HE   ARG  84           HE       ARG  84   5.248  26.384  -5.358
  654   1HH1  ARG  84          HH21      ARG  84   2.148  26.901  -6.775
  655   2HH1  ARG  84          HH22      ARG  84   2.033  28.546  -6.248
  656   1HH2  ARG  84          HH11      ARG  84   5.116  28.531  -4.660
  657   2HH2  ARG  84          HH12      ARG  84   3.714  29.470  -5.050
  Start of MODEL   15
    1   1H    SER   1          HT1       SER   1   6.825  17.493  -1.495
    2   2H    SER   1          HT2       SER   1   6.146  16.200  -2.364
    3   3H    SER   1          HT3       SER   1   7.291  15.900  -1.145
    4    HA   SER   1           HA       SER   1   5.764  15.893   0.448
    5   1HB   SER   1          HB2       SER   1   5.770  18.381   0.328
    6   2HB   SER   1          HB1       SER   1   4.525  18.305  -0.915
    7    HG   SER   1           HG       SER   1   4.353  17.951   1.807
    8    H    ASP   2           HN       ASP   2   5.463  14.522  -2.125
    9    HA   ASP   2           HA       ASP   2   2.700  14.545  -2.948
   10   1HB   ASP   2          HB2       ASP   2   4.366  13.721  -4.473
   11   2HB   ASP   2          HB1       ASP   2   4.918  12.522  -3.308
   12    H    VAL   3           HN       VAL   3   1.223  14.154  -1.390
   13    HA   VAL   3           HA       VAL   3   1.497  12.430   0.855
   14    HB   VAL   3           HB       VAL   3  -0.730  12.909   1.310
   15   1HG1  VAL   3          HG11      VAL   3   0.748  14.952   0.875
   16   2HG1  VAL   3          HG12      VAL   3  -0.996  15.225   0.871
   17   3HG1  VAL   3          HG13      VAL   3  -0.116  15.118  -0.654
   18   1HG2  VAL   3          HG21      VAL   3  -1.142  13.003  -1.691
   19   2HG2  VAL   3          HG22      VAL   3  -2.342  13.628  -0.560
   20   3HG2  VAL   3          HG23      VAL   3  -1.900  11.919  -0.522
   21    H    TYR   4           HN       TYR   4   1.013  11.555  -2.498
   22    HA   TYR   4           HA       TYR   4  -0.583   9.247  -1.828
   23   1HB   TYR   4          HB2       TYR   4   0.809  10.191  -4.338
   24   2HB   TYR   4          HB1       TYR   4   0.291   8.510  -4.277
   25    HD1  TYR   4           HD1      TYR   4  -2.183   8.157  -3.373
   26    HD2  TYR   4           HD2      TYR   4  -0.715  11.773  -5.156
   27    HE1  TYR   4           HE1      TYR   4  -4.493   8.787  -3.984
   28    HE2  TYR   4           HE2      TYR   4  -3.031  12.419  -5.750
   29    HH   TYR   4           HH       TYR   4  -5.637  10.240  -5.621
   30    H    CYS   5           HN       CYS   5   2.861   9.676  -2.509
   31    HA   CYS   5           HA       CYS   5   3.608   6.933  -2.299
   32   1HB   CYS   5          HB2       CYS   5   5.098   9.494  -1.650
   33   2HB   CYS   5          HB1       CYS   5   5.850   7.902  -1.547
   34    H    GLU   6           HN       GLU   6   3.201   9.416   0.212
   35    HA   GLU   6           HA       GLU   6   4.145   7.872   2.400
   36   1HB   GLU   6          HB2       GLU   6   3.778  10.213   2.722
   37   2HB   GLU   6          HB1       GLU   6   2.091  10.090   2.227
   38   1HG   GLU   6          HG2       GLU   6   3.060   8.504   4.603
   39   2HG   GLU   6          HG1       GLU   6   2.696  10.218   4.794
   40    H    VAL   7           HN       VAL   7   0.836   8.113   1.065
   41    HA   VAL   7           HA       VAL   7  -0.222   6.293   3.062
   42    HB   VAL   7           HB       VAL   7  -1.368   7.187   0.393
   43   1HG1  VAL   7          HG11      VAL   7  -2.485   5.542   2.653
   44   2HG1  VAL   7          HG12      VAL   7  -2.575   5.245   0.920
   45   3HG1  VAL   7          HG13      VAL   7  -3.550   6.520   1.646
   46   1HG2  VAL   7          HG21      VAL   7  -1.482   8.283   3.203
   47   2HG2  VAL   7          HG22      VAL   7  -2.839   8.546   2.110
   48   3HG2  VAL   7          HG23      VAL   7  -1.238   9.143   1.684
   49    H    CYS   8           HN       CYS   8   0.985   5.769  -0.260
   50    HA   CYS   8           HA       CYS   8   0.103   3.081  -0.541
   51   1HB   CYS   8          HB2       CYS   8   1.531   3.012  -2.381
   52   2HB   CYS   8          HB1       CYS   8   1.291   4.745  -2.207
   53    H    GLU   9           HN       GLU   9   3.160   4.377   0.786
   54    HA   GLU   9           HA       GLU   9   4.198   1.799   1.473
   55   1HB   GLU   9          HB2       GLU   9   4.807   4.614   2.391
   56   2HB   GLU   9          HB1       GLU   9   5.617   3.227   3.122
   57   1HG   GLU   9          HG2       GLU   9   5.548   3.690   0.132
   58   2HG   GLU   9          HG1       GLU   9   6.843   4.296   1.164
   59    H    PHE  10           HN       PHE  10   1.967   4.036   3.139
   60    HA   PHE  10           HA       PHE  10   2.227   2.737   5.680
   61   1HB   PHE  10          HB2       PHE  10   1.180   4.967   5.450
   62   2HB   PHE  10          HB1       PHE  10  -0.168   4.231   4.579
   63    HD1  PHE  10           HD1      PHE  10  -1.937   3.158   5.744
   64    HD2  PHE  10           HD2      PHE  10   1.685   4.177   7.809
   65    HE1  PHE  10           HE1      PHE  10  -2.985   2.504   7.904
   66    HE2  PHE  10           HE2      PHE  10   0.644   3.535   9.966
   67    HZ   PHE  10           HZ       PHE  10  -1.691   2.700  10.012
   68    H    LEU  11           HN       LEU  11  -0.110   2.277   2.986
   69    HA   LEU  11           HA       LEU  11  -1.554   0.136   4.256
   70   1HB   LEU  11          HB2       LEU  11  -1.103   0.526   1.278
   71   2HB   LEU  11          HB1       LEU  11  -2.351  -0.478   2.024
   72    HG   LEU  11           HG       LEU  11  -2.116   2.500   2.553
   73   1HD1  LEU  11          HD11      LEU  11  -2.463   2.314   0.182
   74   2HD1  LEU  11          HD12      LEU  11  -4.031   2.680   0.901
   75   3HD1  LEU  11          HD13      LEU  11  -3.654   1.032   0.398
   76   1HD2  LEU  11          HD21      LEU  11  -4.254   0.397   2.989
   77   2HD2  LEU  11          HD22      LEU  11  -4.608   2.123   3.035
   78   3HD2  LEU  11          HD23      LEU  11  -3.481   1.426   4.196
   79    H    VAL  12           HN       VAL  12   1.296   0.086   2.044
   80    HA   VAL  12           HA       VAL  12   1.512  -2.730   1.892
   81    HB   VAL  12           HB       VAL  12   3.472  -0.434   1.689
   82   1HG1  VAL  12          HG11      VAL  12   4.872  -2.188   2.540
   83   2HG1  VAL  12          HG12      VAL  12   5.107  -2.150   0.797
   84   3HG1  VAL  12          HG13      VAL  12   4.083  -3.393   1.520
   85   1HG2  VAL  12          HG21      VAL  12   2.571  -2.500  -0.339
   86   2HG2  VAL  12          HG22      VAL  12   3.466  -1.014  -0.659
   87   3HG2  VAL  12          HG23      VAL  12   1.789  -0.935  -0.121
   88    H    LYS  13           HN       LYS  13   3.036  -0.459   4.240
   89    HA   LYS  13           HA       LYS  13   4.414  -2.437   5.749
   90   1HB   LYS  13          HB2       LYS  13   4.930  -0.136   6.152
   91   2HB   LYS  13          HB1       LYS  13   3.253   0.249   6.530
   92   1HG   LYS  13          HG2       LYS  13   3.357  -0.711   8.653
   93   2HG   LYS  13          HG1       LYS  13   4.645  -1.829   8.202
   94   1HD   LYS  13          HD2       LYS  13   5.417  -0.006   9.733
   95   2HD   LYS  13          HD1       LYS  13   6.277  -0.025   8.194
   96   1HE   LYS  13          HE2       LYS  13   5.426   2.260   9.064
   97   2HE   LYS  13          HE1       LYS  13   5.101   1.853   7.379
   98   1HZ   LYS  13          HZ1       LYS  13   3.134   1.041   9.385
   99   2HZ   LYS  13          HZ2       LYS  13   2.902   1.536   7.777
  100   3HZ   LYS  13          HZ3       LYS  13   3.213   2.688   8.987
  101    H    GLU  14           HN       GLU  14   1.092  -1.230   6.043
  102    HA   GLU  14           HA       GLU  14   0.507  -2.808   8.398
  103   1HB   GLU  14          HB2       GLU  14  -1.208  -1.354   6.380
  104   2HB   GLU  14          HB1       GLU  14  -1.934  -2.334   7.653
  105   1HG   GLU  14          HG2       GLU  14  -0.540  -0.978   9.313
  106   2HG   GLU  14          HG1       GLU  14  -0.181   0.112   7.972
  107    H    VAL  15           HN       VAL  15   0.088  -3.358   4.906
  108    HA   VAL  15           HA       VAL  15  -1.456  -5.741   5.293
  109    HB   VAL  15           HB       VAL  15   0.139  -4.675   2.952
  110   1HG1  VAL  15          HG11      VAL  15  -0.924  -6.578   1.642
  111   2HG1  VAL  15          HG12      VAL  15  -1.305  -7.331   3.189
  112   3HG1  VAL  15          HG13      VAL  15   0.379  -7.070   2.730
  113   1HG2  VAL  15          HG21      VAL  15  -2.073  -3.674   3.551
  114   2HG2  VAL  15          HG22      VAL  15  -2.814  -5.260   3.332
  115   3HG2  VAL  15          HG23      VAL  15  -2.074  -4.434   1.959
  116    H    THR  16           HN       THR  16   2.099  -5.279   4.887
  117    HA   THR  16           HA       THR  16   2.551  -8.083   4.784
  118    HB   THR  16           HB       THR  16   4.787  -7.746   4.937
  119    HG1  THR  16           HG1      THR  16   4.444  -5.383   6.447
  120   1HG2  THR  16          HG21      THR  16   4.374  -4.852   4.448
  121   2HG2  THR  16          HG22      THR  16   3.488  -5.948   3.388
  122   3HG2  THR  16          HG23      THR  16   5.244  -6.036   3.481
  123    H    LYS  17           HN       LYS  17   2.290  -5.914   7.604
  124    HA   LYS  17           HA       LYS  17   3.130  -7.908   9.473
  125   1HB   LYS  17          HB2       LYS  17   2.955  -5.728  10.394
  126   2HB   LYS  17          HB1       LYS  17   1.327  -5.493   9.754
  127   1HG   LYS  17          HG2       LYS  17   0.349  -6.904  11.366
  128   2HG   LYS  17          HG1       LYS  17   1.869  -7.716  11.724
  129   1HD   LYS  17          HD2       LYS  17   2.706  -5.575  12.722
  130   2HD   LYS  17          HD1       LYS  17   1.092  -4.893  12.493
  131   1HE   LYS  17          HE2       LYS  17   0.106  -6.600  13.911
  132   2HE   LYS  17          HE1       LYS  17   1.650  -7.445  14.038
  133   1HZ   LYS  17          HZ1       LYS  17   2.553  -5.755  15.334
  134   2HZ   LYS  17          HZ2       LYS  17   0.970  -5.902  15.935
  135   3HZ   LYS  17          HZ3       LYS  17   1.369  -4.626  14.885
  136    H    LEU  18           HN       LEU  18   0.154  -7.175   7.813
  137    HA   LEU  18           HA       LEU  18  -1.541  -9.030   9.272
  138   1HB   LEU  18          HB2       LEU  18  -1.798  -7.677   6.573
  139   2HB   LEU  18          HB1       LEU  18  -3.034  -8.694   7.234
  140    HG   LEU  18           HG       LEU  18  -2.616  -5.874   7.687
  141   1HD1  LEU  18          HD11      LEU  18  -4.772  -6.001   8.806
  142   2HD1  LEU  18          HD12      LEU  18  -4.625  -7.744   8.945
  143   3HD1  LEU  18          HD13      LEU  18  -4.786  -7.002   7.353
  144   1HD2  LEU  18          HD21      LEU  18  -1.240  -6.606   9.686
  145   2HD2  LEU  18          HD22      LEU  18  -2.684  -7.394  10.315
  146   3HD2  LEU  18          HD23      LEU  18  -2.657  -5.655  10.077
  147    H    ILE  19           HN       ILE  19   0.442  -9.177   6.371
  148    HA   ILE  19           HA       ILE  19  -0.361 -11.863   5.636
  149    HB   ILE  19           HB       ILE  19   2.103 -10.213   4.935
  150   1HG1  ILE  19          HG12      ILE  19  -0.357 -10.943   3.303
  151   2HG1  ILE  19          HG11      ILE  19  -0.120  -9.397   4.094
  152   1HG2  ILE  19          HG21      ILE  19   2.414 -11.892   3.107
  153   2HG2  ILE  19          HG22      ILE  19   1.172 -12.888   3.864
  154   3HG2  ILE  19          HG23      ILE  19   2.679 -12.555   4.716
  155   1HD1  ILE  19          HD11      ILE  19   0.534  -9.198   1.756
  156   2HD1  ILE  19          HD12      ILE  19   1.619 -10.579   1.914
  157   3HD1  ILE  19          HD13      ILE  19   1.972  -9.079   2.766
  158    H    ASP  20           HN       ASP  20   2.044 -10.365   7.681
  159    HA   ASP  20           HA       ASP  20   3.521 -12.812   8.223
  160   1HB   ASP  20          HB2       ASP  20   4.450 -10.466   8.414
  161   2HB   ASP  20          HB1       ASP  20   3.465 -10.270   9.864
  162    H    ASN  21           HN       ASN  21   0.631 -11.318   9.556
  163    HA   ASN  21           HA       ASN  21   0.858 -12.995  11.976
  164   1HB   ASN  21          HB2       ASN  21  -0.068 -10.650  12.147
  165   2HB   ASN  21          HB1       ASN  21  -1.448 -11.174  11.178
  166   1HD2  ASN  21          HD21      ASN  21  -2.799 -12.986  12.137
  167   2HD2  ASN  21          HD22      ASN  21  -2.884 -13.130  13.826
  168    H    ASN  22           HN       ASN  22   0.039 -13.634   8.918
  169    HA   ASN  22           HA       ASN  22  -0.803 -15.644   8.062
  170   1HB   ASN  22          HB2       ASN  22  -2.033 -16.391  10.702
  171   2HB   ASN  22          HB1       ASN  22  -1.376 -17.423   9.439
  172   1HD2  ASN  22          HD21      ASN  22   1.102 -15.915   9.035
  173   2HD2  ASN  22          HD22      ASN  22   2.058 -16.157  10.416
  174    H    LYS  23           HN       LYS  23  -2.451 -13.259   7.836
  175    HA   LYS  23           HA       LYS  23  -5.211 -14.240   8.366
  176   1HB   LYS  23          HB2       LYS  23  -4.521 -11.636   7.124
  177   2HB   LYS  23          HB1       LYS  23  -5.976 -12.066   8.007
  178   1HG   LYS  23          HG2       LYS  23  -3.853 -12.520   9.836
  179   2HG   LYS  23          HG1       LYS  23  -3.445 -11.003   9.048
  180   1HD   LYS  23          HD2       LYS  23  -5.551 -10.010   9.730
  181   2HD   LYS  23          HD1       LYS  23  -6.151 -11.571  10.295
  182   1HE   LYS  23          HE2       LYS  23  -4.260 -11.618  11.952
  183   2HE   LYS  23          HE1       LYS  23  -3.874  -9.967  11.471
  184   1HZ   LYS  23          HZ1       LYS  23  -5.746  -9.145  12.424
  185   2HZ   LYS  23          HZ2       LYS  23  -5.498 -10.475  13.451
  186   3HZ   LYS  23          HZ3       LYS  23  -6.640 -10.568  12.196
  187    H    THR  24           HN       THR  24  -6.719 -14.497   6.604
  188    HA   THR  24           HA       THR  24  -5.516 -15.395   4.083
  189    HB   THR  24           HB       THR  24  -7.567 -16.368   3.636
  190    HG1  THR  24           HG1      THR  24  -9.217 -15.108   3.534
  191   1HG2  THR  24          HG21      THR  24  -8.018 -15.813   6.569
  192   2HG2  THR  24          HG22      THR  24  -6.810 -16.961   5.993
  193   3HG2  THR  24          HG23      THR  24  -8.518 -17.227   5.643
  194    H    GLU  25           HN       GLU  25  -6.386 -14.659   1.986
  195    HA   GLU  25           HA       GLU  25  -6.008 -11.862   1.566
  196   1HB   GLU  25          HB2       GLU  25  -5.960 -13.781  -0.172
  197   2HB   GLU  25          HB1       GLU  25  -7.716 -13.622  -0.217
  198   1HG   GLU  25          HG2       GLU  25  -7.290 -11.112  -0.648
  199   2HG   GLU  25          HG1       GLU  25  -5.630 -11.590  -1.004
  200    H    LYS  26           HN       LYS  26  -8.980 -13.790   1.879
  201    HA   LYS  26           HA       LYS  26 -10.888 -11.754   1.497
  202   1HB   LYS  26          HB2       LYS  26 -11.452 -14.148   1.676
  203   2HB   LYS  26          HB1       LYS  26 -11.056 -14.104   3.394
  204   1HG   LYS  26          HG2       LYS  26 -12.864 -12.634   3.880
  205   2HG   LYS  26          HG1       LYS  26 -13.106 -12.245   2.177
  206   1HD   LYS  26          HD2       LYS  26 -13.740 -14.631   1.771
  207   2HD   LYS  26          HD1       LYS  26 -13.625 -14.920   3.507
  208   1HE   LYS  26          HE2       LYS  26 -15.938 -14.482   3.043
  209   2HE   LYS  26          HE1       LYS  26 -15.299 -13.031   3.816
  210   1HZ   LYS  26          HZ1       LYS  26 -15.864 -11.873   2.035
  211   2HZ   LYS  26          HZ2       LYS  26 -16.482 -13.271   1.294
  212   3HZ   LYS  26          HZ3       LYS  26 -14.859 -12.831   1.061
  213    H    GLU  27           HN       GLU  27  -8.975 -12.463   4.371
  214    HA   GLU  27           HA       GLU  27 -10.546 -10.695   6.074
  215   1HB   GLU  27          HB2       GLU  27  -7.833 -11.985   6.386
  216   2HB   GLU  27          HB1       GLU  27  -8.512 -10.894   7.589
  217   1HG   GLU  27          HG2       GLU  27 -10.425 -12.343   7.902
  218   2HG   GLU  27          HG1       GLU  27  -9.875 -13.400   6.604
  219    H    ILE  28           HN       ILE  28  -7.576 -10.325   4.137
  220    HA   ILE  28           HA       ILE  28  -6.859  -7.765   5.206
  221    HB   ILE  28           HB       ILE  28  -6.306  -8.721   2.386
  222   1HG1  ILE  28          HG12      ILE  28  -5.543  -9.896   4.985
  223   2HG1  ILE  28          HG11      ILE  28  -5.566 -10.637   3.414
  224   1HG2  ILE  28          HG21      ILE  28  -5.590  -6.427   3.039
  225   2HG2  ILE  28          HG22      ILE  28  -4.238  -7.477   2.636
  226   3HG2  ILE  28          HG23      ILE  28  -4.607  -7.126   4.324
  227   1HD1  ILE  28          HD11      ILE  28  -3.301 -10.621   4.261
  228   2HD1  ILE  28          HD12      ILE  28  -3.381  -8.884   4.556
  229   3HD1  ILE  28          HD13      ILE  28  -3.398  -9.496   2.901
  230    H    LEU  29           HN       LEU  29  -8.948  -8.734   2.499
  231    HA   LEU  29           HA       LEU  29  -9.469  -6.006   1.684
  232   1HB   LEU  29          HB2       LEU  29 -11.103  -8.510   1.177
  233   2HB   LEU  29          HB1       LEU  29 -11.166  -7.009   0.252
  234    HG   LEU  29           HG       LEU  29  -8.688  -8.749   0.550
  235   1HD1  LEU  29          HD11      LEU  29 -10.713  -8.482  -1.701
  236   2HD1  LEU  29          HD12      LEU  29 -10.346  -9.934  -0.772
  237   3HD1  LEU  29          HD13      LEU  29  -9.145  -9.269  -1.878
  238   1HD2  LEU  29          HD21      LEU  29  -8.080  -7.268  -1.535
  239   2HD2  LEU  29          HD22      LEU  29  -7.922  -6.567   0.072
  240   3HD2  LEU  29          HD23      LEU  29  -9.325  -6.181  -0.923
  241    H    ASP  30           HN       ASP  30 -10.815  -8.204   4.020
  242    HA   ASP  30           HA       ASP  30 -13.296  -6.758   4.487
  243   1HB   ASP  30          HB2       ASP  30 -11.711  -8.646   6.261
  244   2HB   ASP  30          HB1       ASP  30 -13.318  -8.031   6.652
  245    H    ALA  31           HN       ALA  31 -10.086  -6.717   6.035
  246    HA   ALA  31           HA       ALA  31 -10.775  -4.729   7.997
  247   1HB   ALA  31          HB1       ALA  31  -8.809  -6.331   8.067
  248   2HB   ALA  31          HB2       ALA  31  -8.425  -4.663   8.483
  249   3HB   ALA  31          HB3       ALA  31  -8.017  -5.290   6.885
  250    H    PHE  32           HN       PHE  32  -9.814  -4.477   4.623
  251    HA   PHE  32           HA       PHE  32  -8.777  -1.856   4.501
  252   1HB   PHE  32          HB2       PHE  32 -10.469  -3.553   2.693
  253   2HB   PHE  32          HB1       PHE  32 -10.147  -1.893   2.241
  254    HD1  PHE  32           HD1      PHE  32  -7.470  -3.566   4.176
  255    HD2  PHE  32           HD2      PHE  32  -9.042  -2.861   0.222
  256    HE1  PHE  32           HE1      PHE  32  -5.297  -4.164   3.197
  257    HE2  PHE  32           HE2      PHE  32  -6.852  -3.489  -0.743
  258    HZ   PHE  32           HZ       PHE  32  -4.982  -4.145   0.743
  259    H    ASP  33           HN       ASP  33 -11.798  -2.826   5.712
  260    HA   ASP  33           HA       ASP  33 -13.226  -0.387   4.892
  261   1HB   ASP  33          HB2       ASP  33 -14.421  -2.536   5.124
  262   2HB   ASP  33          HB1       ASP  33 -14.015  -2.571   6.840
  263    H    LYS  34           HN       LYS  34 -11.172  -1.320   7.521
  264    HA   LYS  34           HA       LYS  34 -11.901   1.223   8.916
  265   1HB   LYS  34          HB2       LYS  34 -11.611   0.148  11.076
  266   2HB   LYS  34          HB1       LYS  34 -12.832  -0.730  10.158
  267   1HG   LYS  34          HG2       LYS  34 -11.040  -2.339   9.439
  268   2HG   LYS  34          HG1       LYS  34  -9.930  -1.514  10.538
  269   1HD   LYS  34          HD2       LYS  34 -11.677  -1.937  12.371
  270   2HD   LYS  34          HD1       LYS  34 -12.439  -3.051  11.234
  271   1HE   LYS  34          HE2       LYS  34 -10.385  -4.355  11.076
  272   2HE   LYS  34          HE1       LYS  34  -9.544  -3.206  12.117
  273   1HZ   LYS  34          HZ1       LYS  34 -10.616  -3.942  13.960
  274   2HZ   LYS  34          HZ2       LYS  34 -10.641  -5.386  13.064
  275   3HZ   LYS  34          HZ3       LYS  34 -12.019  -4.393  13.120
  276    H    MET  35           HN       MET  35  -9.627  -0.059   7.083
  277    HA   MET  35           HA       MET  35  -7.290   0.324   8.820
  278   1HB   MET  35          HB2       MET  35  -7.768  -1.054   6.438
  279   2HB   MET  35          HB1       MET  35  -6.720   0.256   5.926
  280   1HG   MET  35          HG2       MET  35  -5.240  -0.410   7.927
  281   2HG   MET  35          HG1       MET  35  -6.190  -1.892   7.967
  282   1HE   MET  35          HE1       MET  35  -4.720  -4.100   5.469
  283   2HE   MET  35          HE2       MET  35  -6.253  -3.687   6.237
  284   3HE   MET  35          HE3       MET  35  -4.792  -3.811   7.211
  285    H    CYS  36           HN       CYS  36  -8.794   2.191   6.067
  286    HA   CYS  36           HA       CYS  36  -6.788   4.243   6.252
  287   1HB   CYS  36          HB2       CYS  36  -9.684   4.577   5.385
  288   2HB   CYS  36          HB1       CYS  36  -8.376   5.706   5.060
  289    H    SER  37           HN       SER  37  -8.977   3.123   8.447
  290    HA   SER  37           HA       SER  37  -9.716   5.702   9.655
  291   1HB   SER  37          HB2       SER  37  -9.893   3.014  11.014
  292   2HB   SER  37          HB1       SER  37 -10.890   4.441  11.277
  293    HG   SER  37           HG       SER  37 -10.819   3.436   8.692
  294    H    LYS  38           HN       LYS  38  -6.811   4.037   9.614
  295    HA   LYS  38           HA       LYS  38  -6.111   4.791  12.424
  296   1HB   LYS  38          HB2       LYS  38  -4.843   2.959  10.386
  297   2HB   LYS  38          HB1       LYS  38  -3.935   3.528  11.787
  298   1HG   LYS  38          HG2       LYS  38  -5.711   2.642  13.274
  299   2HG   LYS  38          HG1       LYS  38  -6.572   2.032  11.861
  300   1HD   LYS  38          HD2       LYS  38  -4.663   0.600  11.289
  301   2HD   LYS  38          HD1       LYS  38  -3.758   1.235  12.665
  302   1HE   LYS  38          HE2       LYS  38  -6.422  -0.191  12.902
  303   2HE   LYS  38          HE1       LYS  38  -4.858  -0.976  13.126
  304   1HZ   LYS  38          HZ1       LYS  38  -5.728  -0.298  15.243
  305   2HZ   LYS  38          HZ2       LYS  38  -5.937   1.299  14.702
  306   3HZ   LYS  38          HZ3       LYS  38  -4.374   0.656  14.879
  307    H    LEU  39           HN       LEU  39  -6.366   6.608   9.917
  308    HA   LEU  39           HA       LEU  39  -3.710   7.971  10.259
  309   1HB   LEU  39          HB2       LEU  39  -5.430   7.870   7.760
  310   2HB   LEU  39          HB1       LEU  39  -3.899   8.718   7.902
  311    HG   LEU  39           HG       LEU  39  -4.243   5.731   8.247
  312   1HD1  LEU  39          HD11      LEU  39  -3.385   5.477   6.047
  313   2HD1  LEU  39          HD12      LEU  39  -2.938   7.175   5.950
  314   3HD1  LEU  39          HD13      LEU  39  -4.636   6.710   5.918
  315   1HD2  LEU  39          HD21      LEU  39  -1.868   7.599   8.280
  316   2HD2  LEU  39          HD22      LEU  39  -1.672   5.902   7.862
  317   3HD2  LEU  39          HD23      LEU  39  -2.289   6.349   9.448
  318    HA   PRO  40           HA       PRO  40  -6.073  11.432  11.738
  319   1HB   PRO  40          HB2       PRO  40  -4.596  13.268   9.944
  320   2HB   PRO  40          HB1       PRO  40  -4.645  13.237  11.714
  321   1HG   PRO  40          HG2       PRO  40  -2.508  12.319  10.069
  322   2HG   PRO  40          HG1       PRO  40  -2.669  12.080  11.815
  323   1HD   PRO  40          HD2       PRO  40  -2.877  10.088   9.754
  324   2HD   PRO  40          HD1       PRO  40  -3.069   9.850  11.495
  325    H    LYS  41           HN       LYS  41  -7.757  13.007  10.853
  326    HA   LYS  41           HA       LYS  41  -9.140  11.853   8.604
  327   1HB   LYS  41          HB2       LYS  41 -10.131  13.254  10.519
  328   2HB   LYS  41          HB1       LYS  41  -9.554  14.659   9.622
  329   1HG   LYS  41          HG2       LYS  41 -10.888  14.050   7.689
  330   2HG   LYS  41          HG1       LYS  41 -11.361  12.527   8.443
  331   1HD   LYS  41          HD2       LYS  41 -12.456  13.829  10.276
  332   2HD   LYS  41          HD1       LYS  41 -12.079  15.312   9.397
  333   1HE   LYS  41          HE2       LYS  41 -13.349  14.423   7.437
  334   2HE   LYS  41          HE1       LYS  41 -13.807  13.025   8.409
  335   1HZ   LYS  41          HZ1       LYS  41 -15.417  14.975   8.315
  336   2HZ   LYS  41          HZ2       LYS  41 -14.324  15.783   9.335
  337   3HZ   LYS  41          HZ3       LYS  41 -15.057  14.338   9.845
  338    H    SER  42           HN       SER  42  -6.565  14.136   8.674
  339    HA   SER  42           HA       SER  42  -7.355  15.496   6.262
  340   1HB   SER  42          HB2       SER  42  -5.003  16.361   6.253
  341   2HB   SER  42          HB1       SER  42  -5.819  16.594   7.796
  342    HG   SER  42           HG       SER  42  -3.620  15.119   7.188
  343    H    LEU  43           HN       LEU  43  -6.040  12.416   6.649
  344    HA   LEU  43           HA       LEU  43  -5.214  12.386   3.748
  345   1HB   LEU  43          HB2       LEU  43  -4.444  10.311   5.804
  346   2HB   LEU  43          HB1       LEU  43  -3.751  10.565   4.205
  347    HG   LEU  43           HG       LEU  43  -3.502  12.370   6.602
  348   1HD1  LEU  43          HD11      LEU  43  -1.985  10.590   6.850
  349   2HD1  LEU  43          HD12      LEU  43  -1.027  11.890   6.147
  350   3HD1  LEU  43          HD13      LEU  43  -1.601  10.569   5.130
  351   1HD2  LEU  43          HD21      LEU  43  -2.642  12.737   3.729
  352   2HD2  LEU  43          HD22      LEU  43  -1.914  13.644   5.052
  353   3HD2  LEU  43          HD23      LEU  43  -3.629  13.826   4.699
  354    H    SER  44           HN       SER  44  -7.710  11.590   5.798
  355    HA   SER  44           HA       SER  44  -8.572   9.033   5.456
  356   1HB   SER  44          HB2       SER  44 -10.074  10.598   6.472
  357   2HB   SER  44          HB1       SER  44 -10.150  11.580   5.011
  358    HG   SER  44           HG       SER  44 -11.525   9.310   5.698
  359    H    GLU  45           HN       GLU  45  -9.493  11.464   3.090
  360    HA   GLU  45           HA       GLU  45 -10.599   9.915   1.166
  361   1HB   GLU  45          HB2       GLU  45  -9.057  12.482   0.834
  362   2HB   GLU  45          HB1       GLU  45 -10.214  11.834  -0.330
  363   1HG   GLU  45          HG2       GLU  45 -10.913  12.419   2.561
  364   2HG   GLU  45          HG1       GLU  45 -11.187  13.556   1.242
  365    H    GLU  46           HN       GLU  46  -7.242  11.071   0.899
  366    HA   GLU  46           HA       GLU  46  -6.712   9.900  -1.619
  367   1HB   GLU  46          HB2       GLU  46  -4.688  10.117   0.609
  368   2HB   GLU  46          HB1       GLU  46  -4.412  10.259  -1.123
  369   1HG   GLU  46          HG2       GLU  46  -5.930  12.211   0.627
  370   2HG   GLU  46          HG1       GLU  46  -4.388  12.487  -0.169
  371    H    CYS  47           HN       CYS  47  -6.985   8.445   1.536
  372    HA   CYS  47           HA       CYS  47  -5.625   5.979   0.741
  373   1HB   CYS  47          HB2       CYS  47  -5.795   6.709   3.132
  374   2HB   CYS  47          HB1       CYS  47  -7.536   6.493   3.057
  375    H    GLN  48           HN       GLN  48  -8.992   7.078   1.056
  376    HA   GLN  48           HA       GLN  48 -10.254   4.656   0.360
  377   1HB   GLN  48          HB2       GLN  48 -11.410   6.788   1.071
  378   2HB   GLN  48          HB1       GLN  48 -11.142   7.406  -0.560
  379   1HG   GLN  48          HG2       GLN  48 -12.459   5.623  -1.525
  380   2HG   GLN  48          HG1       GLN  48 -12.587   4.811   0.035
  381   1HE2  GLN  48          HE21      GLN  48 -14.327   6.769  -2.028
  382   2HE2  GLN  48          HE22      GLN  48 -15.352   7.517  -0.901
  383    H    GLU  49           HN       GLU  49  -9.014   7.228  -1.811
  384    HA   GLU  49           HA       GLU  49  -9.788   5.886  -4.220
  385   1HB   GLU  49          HB2       GLU  49  -7.646   7.971  -3.717
  386   2HB   GLU  49          HB1       GLU  49  -8.199   7.466  -5.314
  387   1HG   GLU  49          HG2       GLU  49 -10.057   8.547  -3.181
  388   2HG   GLU  49          HG1       GLU  49  -9.314   9.559  -4.420
  389    H    VAL  50           HN       VAL  50  -6.705   5.894  -2.379
  390    HA   VAL  50           HA       VAL  50  -5.314   4.293  -4.316
  391    HB   VAL  50           HB       VAL  50  -4.794   4.471  -1.338
  392   1HG1  VAL  50          HG11      VAL  50  -3.110   3.494  -3.648
  393   2HG1  VAL  50          HG12      VAL  50  -3.702   2.542  -2.287
  394   3HG1  VAL  50          HG13      VAL  50  -2.486   3.790  -2.028
  395   1HG2  VAL  50          HG21      VAL  50  -4.722   6.616  -2.950
  396   2HG2  VAL  50          HG22      VAL  50  -3.168   5.929  -3.407
  397   3HG2  VAL  50          HG23      VAL  50  -3.479   6.360  -1.727
  398    H    VAL  51           HN       VAL  51  -6.961   3.466  -1.251
  399    HA   VAL  51           HA       VAL  51  -6.543   0.681  -1.542
  400    HB   VAL  51           HB       VAL  51  -8.724   2.174  -0.037
  401   1HG1  VAL  51          HG11      VAL  51  -9.293  -0.194  -0.289
  402   2HG1  VAL  51          HG12      VAL  51  -8.812   0.144   1.371
  403   3HG1  VAL  51          HG13      VAL  51  -7.685  -0.651   0.273
  404   1HG2  VAL  51          HG21      VAL  51  -6.347   2.757   0.530
  405   2HG2  VAL  51          HG22      VAL  51  -6.087   1.066   0.953
  406   3HG2  VAL  51          HG23      VAL  51  -7.240   2.036   1.868
  407    H    ASP  52           HN       ASP  52  -9.401   2.609  -2.373
  408    HA   ASP  52           HA       ASP  52 -10.943   0.454  -3.393
  409   1HB   ASP  52          HB2       ASP  52 -11.039   3.406  -4.045
  410   2HB   ASP  52          HB1       ASP  52 -12.278   2.235  -4.499
  411    H    THR  53           HN       THR  53  -8.807   2.734  -5.134
  412    HA   THR  53           HA       THR  53  -9.365   1.397  -7.693
  413    HB   THR  53           HB       THR  53  -7.370   3.563  -7.004
  414    HG1  THR  53           HG1      THR  53 -10.080   3.554  -7.725
  415   1HG2  THR  53          HG21      THR  53  -8.476   2.533  -9.630
  416   2HG2  THR  53          HG22      THR  53  -6.803   2.437  -9.079
  417   3HG2  THR  53          HG23      THR  53  -7.515   4.003  -9.465
  418    H    TYR  54           HN       TYR  54  -6.625   1.605  -5.420
  419    HA   TYR  54           HA       TYR  54  -5.250  -0.469  -7.098
  420   1HB   TYR  54          HB2       TYR  54  -4.146   1.520  -5.125
  421   2HB   TYR  54          HB1       TYR  54  -3.190   0.294  -5.952
  422    HD1  TYR  54           HD1      TYR  54  -5.138   3.381  -6.354
  423    HD2  TYR  54           HD2      TYR  54  -2.729   0.460  -8.351
  424    HE1  TYR  54           HE1      TYR  54  -4.956   4.890  -8.295
  425    HE2  TYR  54           HE2      TYR  54  -2.539   1.964 -10.316
  426    HH   TYR  54           HH       TYR  54  -2.986   5.044 -10.320
  427    H    GLY  55           HN       GLY  55  -7.305  -1.126  -5.101
  428   1HA   GLY  55          HA2       GLY  55  -5.888  -2.166  -2.777
  429   2HA   GLY  55          HA1       GLY  55  -7.592  -2.403  -3.138
  430    H    SER  56           HN       SER  56  -7.662  -3.796  -5.475
  431    HA   SER  56           HA       SER  56  -6.783  -6.369  -4.604
  432   1HB   SER  56          HB2       SER  56  -7.448  -5.813  -7.485
  433   2HB   SER  56          HB1       SER  56  -7.790  -7.249  -6.518
  434    HG   SER  56           HG       SER  56  -9.103  -5.643  -5.218
  435    H    SER  57           HN       SER  57  -5.389  -3.932  -6.661
  436    HA   SER  57           HA       SER  57  -3.506  -5.757  -7.865
  437   1HB   SER  57          HB2       SER  57  -2.418  -3.700  -8.791
  438   2HB   SER  57          HB1       SER  57  -4.154  -3.731  -9.088
  439    HG   SER  57           HG       SER  57  -2.644  -2.037  -7.544
  440    H    ILE  58           HN       ILE  58  -3.152  -3.312  -5.280
  441    HA   ILE  58           HA       ILE  58  -0.370  -3.740  -4.777
  442    HB   ILE  58           HB       ILE  58  -2.663  -3.044  -2.917
  443   1HG1  ILE  58          HG12      ILE  58  -0.389  -1.351  -4.001
  444   2HG1  ILE  58          HG11      ILE  58  -1.997  -1.393  -4.710
  445   1HG2  ILE  58          HG21      ILE  58  -0.688  -2.281  -1.404
  446   2HG2  ILE  58          HG22      ILE  58   0.305  -3.339  -2.404
  447   3HG2  ILE  58          HG23      ILE  58  -1.035  -4.008  -1.477
  448   1HD1  ILE  58          HD11      ILE  58  -2.070   0.482  -3.260
  449   2HD1  ILE  58          HD12      ILE  58  -1.161  -0.360  -2.002
  450   3HD1  ILE  58          HD13      ILE  58  -2.840  -0.798  -2.322
  451    H    LEU  59           HN       LEU  59  -3.201  -5.141  -3.273
  452    HA   LEU  59           HA       LEU  59  -1.903  -7.072  -1.665
  453   1HB   LEU  59          HB2       LEU  59  -4.218  -6.448  -1.293
  454   2HB   LEU  59          HB1       LEU  59  -4.675  -7.016  -2.895
  455    HG   LEU  59           HG       LEU  59  -4.183  -9.315  -2.284
  456   1HD1  LEU  59          HD11      LEU  59  -3.095  -8.019   0.223
  457   2HD1  LEU  59          HD12      LEU  59  -2.321  -9.207  -0.824
  458   3HD1  LEU  59          HD13      LEU  59  -3.629  -9.700   0.242
  459   1HD2  LEU  59          HD21      LEU  59  -5.749  -9.432  -0.150
  460   2HD2  LEU  59          HD22      LEU  59  -6.401  -8.886  -1.691
  461   3HD2  LEU  59          HD23      LEU  59  -5.961  -7.712  -0.453
  462    H    SER  60           HN       SER  60  -2.619  -7.092  -5.121
  463    HA   SER  60           HA       SER  60  -2.370  -9.961  -5.233
  464   1HB   SER  60          HB2       SER  60  -2.550  -7.798  -7.312
  465   2HB   SER  60          HB1       SER  60  -2.204  -9.453  -7.801
  466    HG   SER  60           HG       SER  60  -4.130 -10.099  -6.897
  467    H    ILE  61           HN       ILE  61  -0.302  -7.174  -5.838
  468    HA   ILE  61           HA       ILE  61   1.940  -8.547  -7.017
  469    HB   ILE  61           HB       ILE  61   2.048  -5.996  -5.392
  470   1HG1  ILE  61          HG12      ILE  61   0.467  -6.501  -7.789
  471   2HG1  ILE  61          HG11      ILE  61   0.620  -5.016  -6.862
  472   1HG2  ILE  61          HG21      ILE  61   3.923  -5.459  -6.863
  473   2HG2  ILE  61          HG22      ILE  61   3.670  -6.953  -7.767
  474   3HG2  ILE  61          HG23      ILE  61   4.184  -7.016  -6.082
  475   1HD1  ILE  61          HD11      ILE  61   2.485  -5.901  -9.078
  476   2HD1  ILE  61          HD12      ILE  61   2.652  -4.426  -8.122
  477   3HD1  ILE  61          HD13      ILE  61   1.262  -4.637  -9.184
  478    H    LEU  62           HN       LEU  62   1.309  -7.420  -3.691
  479    HA   LEU  62           HA       LEU  62   3.746  -8.174  -2.565
  480   1HB   LEU  62          HB2       LEU  62   1.062  -7.513  -1.625
  481   2HB   LEU  62          HB1       LEU  62   1.786  -8.725  -0.576
  482    HG   LEU  62           HG       LEU  62   3.356  -6.271  -1.392
  483   1HD1  LEU  62          HD11      LEU  62   1.503  -5.190  -0.466
  484   2HD1  LEU  62          HD12      LEU  62   2.558  -5.398   0.928
  485   3HD1  LEU  62          HD13      LEU  62   1.197  -6.486   0.682
  486   1HD2  LEU  62          HD21      LEU  62   4.562  -8.121  -0.326
  487   2HD2  LEU  62          HD22      LEU  62   3.401  -8.142   1.000
  488   3HD2  LEU  62          HD23      LEU  62   4.465  -6.760   0.785
  489    H    LEU  63           HN       LEU  63   1.053 -10.226  -3.480
  490    HA   LEU  63           HA       LEU  63   2.116 -12.568  -2.065
  491   1HB   LEU  63          HB2       LEU  63   0.042 -12.433  -4.276
  492   2HB   LEU  63          HB1       LEU  63   0.353 -13.806  -3.213
  493    HG   LEU  63           HG       LEU  63  -0.610 -11.071  -2.334
  494   1HD1  LEU  63          HD11      LEU  63  -1.972 -13.748  -2.671
  495   2HD1  LEU  63          HD12      LEU  63  -2.423 -12.202  -3.389
  496   3HD1  LEU  63          HD13      LEU  63  -2.647 -12.469  -1.660
  497   1HD2  LEU  63          HD21      LEU  63   0.272 -13.534  -0.844
  498   2HD2  LEU  63          HD22      LEU  63  -1.000 -12.523  -0.157
  499   3HD2  LEU  63          HD23      LEU  63   0.590 -11.837  -0.483
  500    H    GLU  64           HN       GLU  64   2.896 -10.988  -4.987
  501    HA   GLU  64           HA       GLU  64   3.937 -13.453  -6.220
  502   1HB   GLU  64          HB2       GLU  64   3.904 -10.543  -7.045
  503   2HB   GLU  64          HB1       GLU  64   4.890 -11.724  -7.908
  504   1HG   GLU  64          HG2       GLU  64   2.827 -13.107  -8.245
  505   2HG   GLU  64          HG1       GLU  64   1.889 -11.794  -7.534
  506    H    GLU  65           HN       GLU  65   4.871 -12.607  -3.633
  507    HA   GLU  65           HA       GLU  65   6.924 -12.416  -2.435
  508   1HB   GLU  65          HB2       GLU  65   7.744 -13.773  -4.996
  509   2HB   GLU  65          HB1       GLU  65   8.787 -13.617  -3.584
  510   1HG   GLU  65          HG2       GLU  65   7.135 -14.807  -2.209
  511   2HG   GLU  65          HG1       GLU  65   6.059 -14.939  -3.600
  512    H    VAL  66           HN       VAL  66   6.223 -10.098  -4.264
  513    HA   VAL  66           HA       VAL  66   8.886  -9.174  -5.210
  514    HB   VAL  66           HB       VAL  66   6.034  -8.304  -5.541
  515   1HG1  VAL  66          HG11      VAL  66   6.867  -6.196  -4.847
  516   2HG1  VAL  66          HG12      VAL  66   6.961  -6.144  -6.607
  517   3HG1  VAL  66          HG13      VAL  66   8.415  -6.450  -5.654
  518   1HG2  VAL  66          HG21      VAL  66   6.573  -8.347  -7.851
  519   2HG2  VAL  66          HG22      VAL  66   7.455  -9.715  -7.170
  520   3HG2  VAL  66          HG23      VAL  66   8.302  -8.214  -7.534
  521    H    SER  67           HN       SER  67   9.986  -7.433  -4.198
  522    HA   SER  67           HA       SER  67   9.804  -7.168  -1.421
  523   1HB   SER  67          HB2       SER  67  11.521  -6.238  -3.334
  524   2HB   SER  67          HB1       SER  67  10.773  -4.732  -2.813
  525    HG   SER  67           HG       SER  67  11.805  -4.900  -0.991
  526    HA   PRO  68           HA       PRO  68   6.272  -4.605  -0.766
  527   1HB   PRO  68          HB2       PRO  68   7.217  -3.037   1.417
  528   2HB   PRO  68          HB1       PRO  68   6.409  -4.597   1.526
  529   1HG   PRO  68          HG2       PRO  68   9.258  -3.979   1.921
  530   2HG   PRO  68          HG1       PRO  68   8.357  -5.429   2.393
  531   1HD   PRO  68          HD2       PRO  68  10.188  -5.222   0.224
  532   2HD   PRO  68          HD1       PRO  68   9.077  -6.568   0.553
  533    H    GLU  69           HN       GLU  69   9.359  -2.720  -0.672
  534    HA   GLU  69           HA       GLU  69   7.954  -0.249  -1.283
  535   1HB   GLU  69          HB2       GLU  69  10.259   0.691  -1.591
  536   2HB   GLU  69          HB1       GLU  69   9.995  -0.086  -0.033
  537   1HG   GLU  69          HG2       GLU  69  11.042  -2.175  -0.980
  538   2HG   GLU  69          HG1       GLU  69  11.454  -1.246  -2.424
  539    H    LEU  70           HN       LEU  70   8.976  -2.850  -3.255
  540    HA   LEU  70           HA       LEU  70   9.467  -1.197  -5.605
  541   1HB   LEU  70          HB2       LEU  70   8.978  -4.171  -5.233
  542   2HB   LEU  70          HB1       LEU  70   9.148  -3.461  -6.823
  543    HG   LEU  70           HG       LEU  70  11.192  -3.253  -4.640
  544   1HD1  LEU  70          HD11      LEU  70  10.783  -5.568  -5.690
  545   2HD1  LEU  70          HD12      LEU  70  12.437  -4.960  -5.719
  546   3HD1  LEU  70          HD13      LEU  70  11.440  -4.870  -7.168
  547   1HD2  LEU  70          HD21      LEU  70  11.013  -2.138  -7.404
  548   2HD2  LEU  70          HD22      LEU  70  12.593  -2.677  -6.848
  549   3HD2  LEU  70          HD23      LEU  70  11.728  -1.431  -5.958
  550    H    VAL  71           HN       VAL  71   6.782  -2.204  -3.840
  551    HA   VAL  71           HA       VAL  71   4.857  -2.365  -5.943
  552    HB   VAL  71           HB       VAL  71   4.683  -1.871  -2.962
  553   1HG1  VAL  71          HG11      VAL  71   2.426  -1.528  -4.930
  554   2HG1  VAL  71          HG12      VAL  71   2.852  -0.502  -3.559
  555   3HG1  VAL  71          HG13      VAL  71   2.111  -2.071  -3.282
  556   1HG2  VAL  71          HG21      VAL  71   3.317  -3.989  -3.102
  557   2HG2  VAL  71          HG22      VAL  71   4.997  -4.159  -3.609
  558   3HG2  VAL  71          HG23      VAL  71   3.716  -4.055  -4.819
  559    H    CYS  72           HN       CYS  72   5.506   0.442  -3.755
  560    HA   CYS  72           HA       CYS  72   3.713   2.060  -5.210
  561   1HB   CYS  72          HB2       CYS  72   6.165   2.983  -3.652
  562   2HB   CYS  72          HB1       CYS  72   4.764   3.962  -4.055
  563    H    SER  73           HN       SER  73   7.044   1.169  -5.796
  564    HA   SER  73           HA       SER  73   7.527   3.260  -7.802
  565   1HB   SER  73          HB2       SER  73   9.095   0.700  -7.640
  566   2HB   SER  73          HB1       SER  73   9.653   2.304  -8.098
  567    HG   SER  73           HG       SER  73   8.577   1.932  -5.543
  568    H    MET  74           HN       MET  74   6.555  -0.179  -8.013
  569    HA   MET  74           HA       MET  74   6.650  -0.205 -10.939
  570   1HB   MET  74          HB2       MET  74   5.829  -2.077  -8.787
  571   2HB   MET  74          HB1       MET  74   4.933  -2.256 -10.293
  572   1HG   MET  74          HG2       MET  74   7.284  -2.280 -11.426
  573   2HG   MET  74          HG1       MET  74   7.885  -2.616  -9.808
  574   1HE   MET  74          HE1       MET  74   6.383  -4.259  -8.272
  575   2HE   MET  74          HE2       MET  74   5.628  -5.728  -8.875
  576   3HE   MET  74          HE3       MET  74   4.795  -4.187  -9.046
  577    H    LEU  75           HN       LEU  75   3.989   0.322  -8.590
  578    HA   LEU  75           HA       LEU  75   2.004   0.460 -10.700
  579   1HB   LEU  75          HB2       LEU  75   1.823   1.636  -7.910
  580   2HB   LEU  75          HB1       LEU  75   0.479   1.251  -8.981
  581    HG   LEU  75           HG       LEU  75   2.389  -0.708  -7.683
  582   1HD1  LEU  75          HD11      LEU  75  -0.561  -0.154  -7.411
  583   2HD1  LEU  75          HD12      LEU  75   0.677  -0.057  -6.159
  584   3HD1  LEU  75          HD13      LEU  75   0.196  -1.625  -6.804
  585   1HD2  LEU  75          HD21      LEU  75   0.753  -2.394  -8.826
  586   2HD2  LEU  75          HD22      LEU  75   2.044  -1.688  -9.795
  587   3HD2  LEU  75          HD23      LEU  75   0.401  -1.057  -9.920
  588    H    HIS  76           HN       HIS  76   4.502   2.339 -10.603
  589    HA   HIS  76           HA       HIS  76   4.970   4.583 -11.123
  590   1HB   HIS  76          HB2       HIS  76   2.358   4.150 -12.611
  591   2HB   HIS  76          HB1       HIS  76   3.391   5.562 -12.835
  592    HD1  HIS  76           HD1      HIS  76   6.099   4.691 -13.212
  593    HD2  HIS  76           HD2      HIS  76   2.977   2.237 -14.482
  594    HE1  HIS  76           HE1      HIS  76   7.085   3.104 -14.922
  595    H    LEU  77           HN       LEU  77   3.146   3.964  -8.702
  596    HA   LEU  77           HA       LEU  77   1.480   6.369  -8.538
  597   1HB   LEU  77          HB2       LEU  77   1.584   3.839  -7.226
  598   2HB   LEU  77          HB1       LEU  77   1.916   5.028  -5.981
  599    HG   LEU  77           HG       LEU  77  -0.143   6.155  -6.412
  600   1HD1  LEU  77          HD11      LEU  77  -0.833   6.212  -8.584
  601   2HD1  LEU  77          HD12      LEU  77  -1.703   4.737  -8.180
  602   3HD1  LEU  77          HD13      LEU  77  -0.122   4.645  -8.950
  603   1HD2  LEU  77          HD21      LEU  77  -1.660   4.540  -5.601
  604   2HD2  LEU  77          HD22      LEU  77  -0.084   3.945  -5.095
  605   3HD2  LEU  77          HD23      LEU  77  -0.883   3.246  -6.497
  606    H    CYS  78           HN       CYS  78   4.728   5.564  -8.033
  607    HA   CYS  78           HA       CYS  78   5.192   8.159  -6.591
  608   1HB   CYS  78          HB2       CYS  78   6.426   5.448  -6.099
  609   2HB   CYS  78          HB1       CYS  78   7.242   6.929  -5.612
  610    H    SER  79           HN       SER  79   8.073   8.007  -6.799
  611    HA   SER  79           HA       SER  79   8.778   7.151  -9.437
  612   1HB   SER  79          HB2       SER  79   7.691   9.117 -10.278
  613   2HB   SER  79          HB1       SER  79   8.346  10.120  -8.985
  614    HG   SER  79           HG       SER  79   9.704   8.940 -11.176
  615    H    GLY  80           HN       GLY  80  11.177   7.973  -9.986
  616   1HA   GLY  80          HA2       GLY  80  13.330   8.590  -9.132
  617   2HA   GLY  80          HA1       GLY  80  12.657   8.640  -7.499
  618    H    LEU  81           HN       LEU  81  15.008   7.129  -8.656
  619    HA   LEU  81           HA       LEU  81  15.899   4.963  -8.579
  620   1HB   LEU  81          HB2       LEU  81  13.885   4.610  -6.332
  621   2HB   LEU  81          HB1       LEU  81  15.395   3.725  -6.542
  622    HG   LEU  81           HG       LEU  81  15.266   6.732  -6.167
  623   1HD1  LEU  81          HD11      LEU  81  15.579   4.497  -4.155
  624   2HD1  LEU  81          HD12      LEU  81  14.403   5.811  -4.143
  625   3HD1  LEU  81          HD13      LEU  81  16.105   6.148  -3.829
  626   1HD2  LEU  81          HD21      LEU  81  17.692   6.249  -5.438
  627   2HD2  LEU  81          HD22      LEU  81  17.344   6.123  -7.160
  628   3HD2  LEU  81          HD23      LEU  81  17.480   4.664  -6.179
  629    H    VAL  82           HN       VAL  82  14.614   4.636 -10.785
  630    HA   VAL  82           HA       VAL  82  12.468   2.573 -10.329
  631    HB   VAL  82           HB       VAL  82  11.884   3.295 -12.776
  632   1HG1  VAL  82          HG11      VAL  82  10.459   5.123 -11.899
  633   2HG1  VAL  82          HG12      VAL  82  11.402   5.134 -10.409
  634   3HG1  VAL  82          HG13      VAL  82  10.438   3.719 -10.832
  635   1HG2  VAL  82          HG21      VAL  82  14.040   4.692 -12.879
  636   2HG2  VAL  82          HG22      VAL  82  13.221   5.836 -11.815
  637   3HG2  VAL  82          HG23      VAL  82  12.562   5.492 -13.415
  638    HA   PRO  83           HA       PRO  83  15.973   0.407 -12.423
  639   1HB   PRO  83          HB2       PRO  83  15.331  -2.063 -11.161
  640   2HB   PRO  83          HB1       PRO  83  16.623  -0.952 -10.686
  641   1HG   PRO  83          HG2       PRO  83  14.123  -1.498  -9.285
  642   2HG   PRO  83          HG1       PRO  83  15.484  -0.503  -8.749
  643   1HD   PRO  83          HD2       PRO  83  12.910   0.389  -9.755
  644   2HD   PRO  83          HD1       PRO  83  14.255   1.383  -9.161
  645    H    ARG  84           HN       ARG  84  12.926   0.756 -13.012
  646    HA   ARG  84           HA       ARG  84  12.860  -1.037 -15.273
  647   1HB   ARG  84          HB2       ARG  84  12.304  -2.583 -13.333
  648   2HB   ARG  84          HB1       ARG  84  10.834  -1.636 -13.105
  649   1HG   ARG  84          HG2       ARG  84  10.257  -2.079 -15.510
  650   2HG   ARG  84          HG1       ARG  84  11.635  -3.173 -15.589
  651   1HD   ARG  84          HD2       ARG  84  10.311  -4.074 -13.320
  652   2HD   ARG  84          HD1       ARG  84   8.974  -3.604 -14.367
  653    HE   ARG  84           HE       ARG  84  10.432  -5.985 -14.632
  654   1HH1  ARG  84          HH21      ARG  84   9.658  -3.256 -16.604
  655   2HH1  ARG  84          HH22      ARG  84   9.883  -4.110 -18.090
  656   1HH2  ARG  84          HH11      ARG  84  10.711  -7.102 -16.559
  657   2HH2  ARG  84          HH12      ARG  84  10.471  -6.283 -18.066
  Start of MODEL   16
    1   1H    SER   1          HT1       SER   1   7.261  17.082  -0.998
    2   2H    SER   1          HT2       SER   1   6.076  17.179  -2.212
    3   3H    SER   1          HT3       SER   1   6.735  15.673  -1.783
    4    HA   SER   1           HA       SER   1   5.778  15.902   0.453
    5   1HB   SER   1          HB2       SER   1   4.451  18.326  -0.795
    6   2HB   SER   1          HB1       SER   1   4.108  17.676   0.805
    7    HG   SER   1           HG       SER   1   6.693  18.478  -0.038
    8    H    ASP   2           HN       ASP   2   5.462  14.529  -2.077
    9    HA   ASP   2           HA       ASP   2   2.694  14.521  -2.887
   10   1HB   ASP   2          HB2       ASP   2   4.363  13.725  -4.428
   11   2HB   ASP   2          HB1       ASP   2   4.930  12.521  -3.274
   12    H    VAL   3           HN       VAL   3   1.271  14.146  -1.268
   13    HA   VAL   3           HA       VAL   3   1.565  12.396   0.944
   14    HB   VAL   3           HB       VAL   3  -0.664  12.849   1.418
   15   1HG1  VAL   3          HG11      VAL   3   0.806  14.903   1.010
   16   2HG1  VAL   3          HG12      VAL   3  -0.938  15.173   1.019
   17   3HG1  VAL   3          HG13      VAL   3  -0.065  15.092  -0.512
   18   1HG2  VAL   3          HG21      VAL   3  -1.097  13.014  -1.579
   19   2HG2  VAL   3          HG22      VAL   3  -2.296  13.584  -0.417
   20   3HG2  VAL   3          HG23      VAL   3  -1.830  11.883  -0.439
   21    H    TYR   4           HN       TYR   4   1.073  11.550  -2.413
   22    HA   TYR   4           HA       TYR   4  -0.510   9.228  -1.764
   23   1HB   TYR   4          HB2       TYR   4   0.926  10.146  -4.269
   24   2HB   TYR   4          HB1       TYR   4   0.277   8.513  -4.206
   25    HD1  TYR   4           HD1      TYR   4  -2.184   8.204  -3.672
   26    HD2  TYR   4           HD2      TYR   4  -0.487  11.998  -4.721
   27    HE1  TYR   4           HE1      TYR   4  -4.423   9.013  -4.315
   28    HE2  TYR   4           HE2      TYR   4  -2.738  12.830  -5.340
   29    HH   TYR   4           HH       TYR   4  -5.631  10.798  -4.914
   30    H    CYS   5           HN       CYS   5   2.921   9.675  -2.489
   31    HA   CYS   5           HA       CYS   5   3.693   6.941  -2.308
   32   1HB   CYS   5          HB2       CYS   5   5.194   9.487  -1.613
   33   2HB   CYS   5          HB1       CYS   5   5.950   7.895  -1.672
   34    H    GLU   6           HN       GLU   6   3.326   9.392   0.261
   35    HA   GLU   6           HA       GLU   6   4.295   7.772   2.390
   36   1HB   GLU   6          HB2       GLU   6   3.790  10.239   2.495
   37   2HB   GLU   6          HB1       GLU   6   2.082   9.824   2.596
   38   1HG   GLU   6          HG2       GLU   6   2.871  10.112   4.851
   39   2HG   GLU   6          HG1       GLU   6   2.652   8.380   4.601
   40    H    VAL   7           HN       VAL   7   0.985   8.091   1.080
   41    HA   VAL   7           HA       VAL   7  -0.133   6.248   3.030
   42    HB   VAL   7           HB       VAL   7  -1.188   7.241   0.352
   43   1HG1  VAL   7          HG11      VAL   7  -2.340   5.214   0.742
   44   2HG1  VAL   7          HG12      VAL   7  -3.413   6.454   1.387
   45   3HG1  VAL   7          HG13      VAL   7  -2.420   5.492   2.480
   46   1HG2  VAL   7          HG21      VAL   7  -1.456   8.171   3.213
   47   2HG2  VAL   7          HG22      VAL   7  -2.782   8.454   2.088
   48   3HG2  VAL   7          HG23      VAL   7  -1.189   9.122   1.754
   49    H    CYS   8           HN       CYS   8   1.005   5.750  -0.339
   50    HA   CYS   8           HA       CYS   8   0.145   3.047  -0.563
   51   1HB   CYS   8          HB2       CYS   8   1.648   2.902  -2.383
   52   2HB   CYS   8          HB1       CYS   8   1.114   4.581  -2.357
   53    H    GLU   9           HN       GLU   9   2.989   4.467   1.015
   54    HA   GLU   9           HA       GLU   9   4.192   1.849   1.485
   55   1HB   GLU   9          HB2       GLU   9   4.745   4.600   2.644
   56   2HB   GLU   9          HB1       GLU   9   5.691   3.163   3.027
   57   1HG   GLU   9          HG2       GLU   9   5.280   4.228   0.221
   58   2HG   GLU   9          HG1       GLU   9   6.699   4.568   1.210
   59    H    PHE  10           HN       PHE  10   1.931   4.022   3.172
   60    HA   PHE  10           HA       PHE  10   2.216   2.705   5.705
   61   1HB   PHE  10          HB2       PHE  10   1.170   4.944   5.460
   62   2HB   PHE  10          HB1       PHE  10  -0.185   4.200   4.611
   63    HD1  PHE  10           HD1      PHE  10   1.734   4.050   7.813
   64    HD2  PHE  10           HD2      PHE  10  -1.998   3.307   5.824
   65    HE1  PHE  10           HE1      PHE  10   0.694   3.482   9.991
   66    HE2  PHE  10           HE2      PHE  10  -3.048   2.731   8.008
   67    HZ   PHE  10           HZ       PHE  10  -1.697   2.828  10.088
   68    H    LEU  11           HN       LEU  11  -0.147   2.259   3.024
   69    HA   LEU  11           HA       LEU  11  -1.579   0.102   4.287
   70   1HB   LEU  11          HB2       LEU  11  -1.159   0.587   1.320
   71   2HB   LEU  11          HB1       LEU  11  -2.346  -0.517   2.025
   72    HG   LEU  11           HG       LEU  11  -2.285   2.424   2.753
   73   1HD1  LEU  11          HD11      LEU  11  -2.530   2.408   0.352
   74   2HD1  LEU  11          HD12      LEU  11  -4.131   2.676   1.046
   75   3HD1  LEU  11          HD13      LEU  11  -3.692   1.083   0.429
   76   1HD2  LEU  11          HD21      LEU  11  -3.652   1.127   4.238
   77   2HD2  LEU  11          HD22      LEU  11  -4.345   0.203   2.907
   78   3HD2  LEU  11          HD23      LEU  11  -4.762   1.902   3.112
   79    H    VAL  12           HN       VAL  12   1.240   0.066   2.041
   80    HA   VAL  12           HA       VAL  12   1.469  -2.750   1.868
   81    HB   VAL  12           HB       VAL  12   3.410  -0.438   1.667
   82   1HG1  VAL  12          HG11      VAL  12   4.046  -3.390   1.498
   83   2HG1  VAL  12          HG12      VAL  12   4.837  -2.171   2.499
   84   3HG1  VAL  12          HG13      VAL  12   5.050  -2.145   0.753
   85   1HG2  VAL  12          HG21      VAL  12   1.694  -0.998  -0.127
   86   2HG2  VAL  12          HG22      VAL  12   2.575  -2.504  -0.384
   87   3HG2  VAL  12          HG23      VAL  12   3.370  -0.956  -0.675
   88    H    LYS  13           HN       LYS  13   2.957  -0.474   4.202
   89    HA   LYS  13           HA       LYS  13   4.414  -2.369   5.717
   90   1HB   LYS  13          HB2       LYS  13   4.812  -0.054   6.122
   91   2HB   LYS  13          HB1       LYS  13   3.110   0.265   6.432
   92   1HG   LYS  13          HG2       LYS  13   3.164  -0.835   8.536
   93   2HG   LYS  13          HG1       LYS  13   4.714  -1.602   8.188
   94   1HD   LYS  13          HD2       LYS  13   4.509   1.409   8.248
   95   2HD   LYS  13          HD1       LYS  13   4.632   0.513   9.759
   96   1HE   LYS  13          HE2       LYS  13   6.614   0.447   7.462
   97   2HE   LYS  13          HE1       LYS  13   6.863   1.164   9.049
   98   1HZ   LYS  13          HZ1       LYS  13   7.882  -0.949   9.078
   99   2HZ   LYS  13          HZ2       LYS  13   6.523  -1.706   8.397
  100   3HZ   LYS  13          HZ3       LYS  13   6.456  -1.101   9.983
  101    H    GLU  14           HN       GLU  14   1.049  -1.308   6.033
  102    HA   GLU  14           HA       GLU  14   0.533  -2.915   8.392
  103   1HB   GLU  14          HB2       GLU  14  -1.268  -1.525   6.401
  104   2HB   GLU  14          HB1       GLU  14  -1.900  -2.453   7.763
  105   1HG   GLU  14          HG2       GLU  14   0.128  -0.236   8.090
  106   2HG   GLU  14          HG1       GLU  14  -1.612   0.028   8.187
  107    H    VAL  15           HN       VAL  15   0.072  -3.429   4.894
  108    HA   VAL  15           HA       VAL  15  -1.449  -5.819   5.269
  109    HB   VAL  15           HB       VAL  15   0.126  -4.705   2.940
  110   1HG1  VAL  15          HG11      VAL  15  -0.841  -6.619   1.592
  111   2HG1  VAL  15          HG12      VAL  15  -1.243  -7.406   3.117
  112   3HG1  VAL  15          HG13      VAL  15   0.446  -7.095   2.704
  113   1HG2  VAL  15          HG21      VAL  15  -2.105  -4.569   1.932
  114   2HG2  VAL  15          HG22      VAL  15  -2.102  -3.765   3.501
  115   3HG2  VAL  15          HG23      VAL  15  -2.807  -5.374   3.336
  116    H    THR  16           HN       THR  16   2.095  -5.311   4.887
  117    HA   THR  16           HA       THR  16   2.596  -8.103   4.776
  118    HB   THR  16           HB       THR  16   4.822  -7.730   4.939
  119    HG1  THR  16           HG1      THR  16   5.329  -6.932   6.814
  120   1HG2  THR  16          HG21      THR  16   3.486  -5.921   3.410
  121   2HG2  THR  16          HG22      THR  16   5.243  -6.022   3.477
  122   3HG2  THR  16          HG23      THR  16   4.393  -4.840   4.464
  123    H    LYS  17           HN       LYS  17   2.321  -5.949   7.604
  124    HA   LYS  17           HA       LYS  17   3.162  -7.940   9.473
  125   1HB   LYS  17          HB2       LYS  17   2.960  -5.762  10.387
  126   2HB   LYS  17          HB1       LYS  17   1.329  -5.550   9.749
  127   1HG   LYS  17          HG2       LYS  17   0.366  -6.939  11.379
  128   2HG   LYS  17          HG1       LYS  17   1.877  -7.782  11.701
  129   1HD   LYS  17          HD2       LYS  17   2.770  -5.694  12.734
  130   2HD   LYS  17          HD1       LYS  17   1.188  -4.944  12.503
  131   1HE   LYS  17          HE2       LYS  17   0.125  -6.513  13.965
  132   2HE   LYS  17          HE1       LYS  17   1.543  -7.563  13.990
  133   1HZ   LYS  17          HZ1       LYS  17   1.292  -6.153  15.994
  134   2HZ   LYS  17          HZ2       LYS  17   1.516  -4.777  15.022
  135   3HZ   LYS  17          HZ3       LYS  17   2.764  -5.919  15.184
  136    H    LEU  18           HN       LEU  18   0.179  -7.234   7.806
  137    HA   LEU  18           HA       LEU  18  -1.499  -9.115   9.256
  138   1HB   LEU  18          HB2       LEU  18  -1.763  -7.741   6.569
  139   2HB   LEU  18          HB1       LEU  18  -2.992  -8.773   7.216
  140    HG   LEU  18           HG       LEU  18  -2.592  -5.955   7.699
  141   1HD1  LEU  18          HD11      LEU  18  -4.747  -6.116   8.833
  142   2HD1  LEU  18          HD12      LEU  18  -4.594  -7.860   8.912
  143   3HD1  LEU  18          HD13      LEU  18  -4.756  -7.067   7.348
  144   1HD2  LEU  18          HD21      LEU  18  -2.657  -7.502  10.310
  145   2HD2  LEU  18          HD22      LEU  18  -2.641  -5.761  10.091
  146   3HD2  LEU  18          HD23      LEU  18  -1.218  -6.697   9.694
  147    H    ILE  19           HN       ILE  19   0.455  -9.217   6.326
  148    HA   ILE  19           HA       ILE  19  -0.326 -11.903   5.575
  149    HB   ILE  19           HB       ILE  19   2.113 -10.215   4.862
  150   1HG1  ILE  19          HG12      ILE  19  -0.328 -10.978   3.218
  151   2HG1  ILE  19          HG11      ILE  19  -0.162  -9.449   4.061
  152   1HG2  ILE  19          HG21      ILE  19   2.398 -11.876   3.002
  153   2HG2  ILE  19          HG22      ILE  19   1.202 -12.900   3.798
  154   3HG2  ILE  19          HG23      ILE  19   2.729 -12.533   4.602
  155   1HD1  ILE  19          HD11      ILE  19   1.702 -10.480   1.906
  156   2HD1  ILE  19          HD12      ILE  19   1.876  -8.949   2.755
  157   3HD1  ILE  19          HD13      ILE  19   0.494  -9.213   1.698
  158    H    ASP  20           HN       ASP  20   2.068 -10.399   7.624
  159    HA   ASP  20           HA       ASP  20   3.577 -12.837   8.128
  160   1HB   ASP  20          HB2       ASP  20   3.500 -10.250   9.706
  161   2HB   ASP  20          HB1       ASP  20   4.735 -11.506   9.812
  162    H    ASN  21           HN       ASN  21   0.688 -11.367   9.497
  163    HA   ASN  21           HA       ASN  21   0.943 -13.062  11.900
  164   1HB   ASN  21          HB2       ASN  21  -0.006 -10.746  12.136
  165   2HB   ASN  21          HB1       ASN  21  -1.365 -11.231  11.118
  166   1HD2  ASN  21          HD21      ASN  21  -0.190 -13.766  13.142
  167   2HD2  ASN  21          HD22      ASN  21  -1.395 -13.669  14.335
  168    H    ASN  22           HN       ASN  22   0.136 -13.704   8.852
  169    HA   ASN  22           HA       ASN  22  -0.698 -15.711   7.985
  170   1HB   ASN  22          HB2       ASN  22  -1.897 -16.490  10.629
  171   2HB   ASN  22          HB1       ASN  22  -1.229 -17.505   9.358
  172   1HD2  ASN  22          HD21      ASN  22  -0.508 -16.668  12.407
  173   2HD2  ASN  22          HD22      ASN  22   1.187 -16.600  12.327
  174    H    LYS  23           HN       LYS  23  -2.376 -13.340   7.797
  175    HA   LYS  23           HA       LYS  23  -5.117 -14.358   8.350
  176   1HB   LYS  23          HB2       LYS  23  -4.508 -11.735   7.107
  177   2HB   LYS  23          HB1       LYS  23  -5.910 -12.193   8.060
  178   1HG   LYS  23          HG2       LYS  23  -3.720 -12.618   9.796
  179   2HG   LYS  23          HG1       LYS  23  -3.330 -11.115   8.975
  180   1HD   LYS  23          HD2       LYS  23  -5.458 -10.134   9.700
  181   2HD   LYS  23          HD1       LYS  23  -5.947 -11.678  10.402
  182   1HE   LYS  23          HE2       LYS  23  -5.097 -10.257  12.174
  183   2HE   LYS  23          HE1       LYS  23  -3.956 -11.575  11.904
  184   1HZ   LYS  23          HZ1       LYS  23  -3.639  -8.740  11.454
  185   2HZ   LYS  23          HZ2       LYS  23  -3.078  -9.715  10.181
  186   3HZ   LYS  23          HZ3       LYS  23  -2.468  -9.930  11.752
  187    H    THR  24           HN       THR  24  -6.644 -14.612   6.604
  188    HA   THR  24           HA       THR  24  -5.464 -15.489   4.070
  189    HB   THR  24           HB       THR  24  -7.521 -16.457   3.634
  190    HG1  THR  24           HG1      THR  24  -9.475 -15.468   4.451
  191   1HG2  THR  24          HG21      THR  24  -8.476 -17.304   5.662
  192   2HG2  THR  24          HG22      THR  24  -7.892 -15.922   6.585
  193   3HG2  THR  24          HG23      THR  24  -6.748 -17.105   5.953
  194    H    GLU  25           HN       GLU  25  -6.442 -14.749   1.991
  195    HA   GLU  25           HA       GLU  25  -6.030 -11.944   1.589
  196   1HB   GLU  25          HB2       GLU  25  -6.023 -13.857  -0.163
  197   2HB   GLU  25          HB1       GLU  25  -7.776 -13.670  -0.189
  198   1HG   GLU  25          HG2       GLU  25  -7.300 -11.154  -0.592
  199   2HG   GLU  25          HG1       GLU  25  -5.661 -11.674  -0.991
  200    H    LYS  26           HN       LYS  26  -8.999 -13.865   1.933
  201    HA   LYS  26           HA       LYS  26 -10.895 -11.812   1.585
  202   1HB   LYS  26          HB2       LYS  26 -11.067 -14.460   2.067
  203   2HB   LYS  26          HB1       LYS  26 -11.450 -13.872   3.680
  204   1HG   LYS  26          HG2       LYS  26 -12.879 -13.142   1.103
  205   2HG   LYS  26          HG1       LYS  26 -13.514 -14.139   2.412
  206   1HD   LYS  26          HD2       LYS  26 -13.071 -12.051   3.912
  207   2HD   LYS  26          HD1       LYS  26 -12.994 -11.168   2.387
  208   1HE   LYS  26          HE2       LYS  26 -15.320 -12.894   3.282
  209   2HE   LYS  26          HE1       LYS  26 -15.279 -11.132   3.340
  210   1HZ   LYS  26          HZ1       LYS  26 -15.956 -11.112   1.249
  211   2HZ   LYS  26          HZ2       LYS  26 -15.895 -12.808   1.163
  212   3HZ   LYS  26          HZ3       LYS  26 -14.522 -11.884   0.777
  213    H    GLU  27           HN       GLU  27  -8.945 -12.544   4.434
  214    HA   GLU  27           HA       GLU  27 -10.492 -10.774   6.159
  215   1HB   GLU  27          HB2       GLU  27  -7.790 -12.095   6.435
  216   2HB   GLU  27          HB1       GLU  27  -8.405 -10.967   7.638
  217   1HG   GLU  27          HG2       GLU  27 -10.423 -12.383   7.896
  218   2HG   GLU  27          HG1       GLU  27  -9.727 -13.537   6.763
  219    H    ILE  28           HN       ILE  28  -7.560 -10.403   4.170
  220    HA   ILE  28           HA       ILE  28  -6.829  -7.846   5.241
  221    HB   ILE  28           HB       ILE  28  -6.309  -8.796   2.408
  222   1HG1  ILE  28          HG12      ILE  28  -5.519  -9.987   4.985
  223   2HG1  ILE  28          HG11      ILE  28  -5.530 -10.706   3.405
  224   1HG2  ILE  28          HG21      ILE  28  -4.230  -7.555   2.631
  225   2HG2  ILE  28          HG22      ILE  28  -4.595  -7.179   4.316
  226   3HG2  ILE  28          HG23      ILE  28  -5.585  -6.505   3.024
  227   1HD1  ILE  28          HD11      ILE  28  -3.271 -10.677   4.275
  228   2HD1  ILE  28          HD12      ILE  28  -3.366  -8.939   4.561
  229   3HD1  ILE  28          HD13      ILE  28  -3.374  -9.559   2.909
  230    H    LEU  29           HN       LEU  29  -8.929  -8.799   2.538
  231    HA   LEU  29           HA       LEU  29  -9.452  -6.075   1.734
  232   1HB   LEU  29          HB2       LEU  29 -11.072  -8.593   1.257
  233   2HB   LEU  29          HB1       LEU  29 -11.210  -7.082   0.355
  234    HG   LEU  29           HG       LEU  29  -8.661  -8.731   0.558
  235   1HD1  LEU  29          HD11      LEU  29 -10.773  -8.567  -1.622
  236   2HD1  LEU  29          HD12      LEU  29 -10.320  -9.994  -0.690
  237   3HD1  LEU  29          HD13      LEU  29  -9.182  -9.296  -1.843
  238   1HD2  LEU  29          HD21      LEU  29  -7.951  -6.567   0.014
  239   2HD2  LEU  29          HD22      LEU  29  -9.444  -6.163  -0.833
  240   3HD2  LEU  29          HD23      LEU  29  -8.257  -7.215  -1.596
  241    H    ASP  30           HN       ASP  30 -10.830  -8.283   4.062
  242    HA   ASP  30           HA       ASP  30 -13.278  -6.802   4.549
  243   1HB   ASP  30          HB2       ASP  30 -12.910  -9.186   5.255
  244   2HB   ASP  30          HB1       ASP  30 -11.768  -8.607   6.468
  245    H    ALA  31           HN       ALA  31 -10.073  -6.831   6.115
  246    HA   ALA  31           HA       ALA  31 -10.729  -4.870   8.100
  247   1HB   ALA  31          HB1       ALA  31  -8.754  -6.493   8.072
  248   2HB   ALA  31          HB2       ALA  31  -8.406  -4.853   8.610
  249   3HB   ALA  31          HB3       ALA  31  -7.968  -5.358   6.977
  250    H    PHE  32           HN       PHE  32  -9.812  -4.554   4.725
  251    HA   PHE  32           HA       PHE  32  -8.771  -1.923   4.652
  252   1HB   PHE  32          HB2       PHE  32 -10.480  -3.554   2.794
  253   2HB   PHE  32          HB1       PHE  32 -10.113  -1.889   2.395
  254    HD1  PHE  32           HD1      PHE  32  -7.478  -3.642   4.303
  255    HD2  PHE  32           HD2      PHE  32  -9.029  -2.861   0.354
  256    HE1  PHE  32           HE1      PHE  32  -5.314  -4.262   3.321
  257    HE2  PHE  32           HE2      PHE  32  -6.848  -3.514  -0.614
  258    HZ   PHE  32           HZ       PHE  32  -4.995  -4.220   0.867
  259    H    ASP  33           HN       ASP  33 -11.828  -2.978   5.737
  260    HA   ASP  33           HA       ASP  33 -13.270  -0.529   5.045
  261   1HB   ASP  33          HB2       ASP  33 -14.444  -2.688   5.227
  262   2HB   ASP  33          HB1       ASP  33 -14.005  -2.782   6.933
  263    H    LYS  34           HN       LYS  34 -11.227  -1.548   7.677
  264    HA   LYS  34           HA       LYS  34 -11.972   0.957   9.145
  265   1HB   LYS  34          HB2       LYS  34 -11.370  -0.325  11.258
  266   2HB   LYS  34          HB1       LYS  34 -12.883  -0.797  10.486
  267   1HG   LYS  34          HG2       LYS  34 -11.783  -2.699   9.417
  268   2HG   LYS  34          HG1       LYS  34 -10.228  -2.205  10.084
  269   1HD   LYS  34          HD2       LYS  34 -10.930  -3.861  11.596
  270   2HD   LYS  34          HD1       LYS  34 -11.416  -2.371  12.399
  271   1HE   LYS  34          HE2       LYS  34 -13.705  -2.639  11.649
  272   2HE   LYS  34          HE1       LYS  34 -13.260  -4.011  10.633
  273   1HZ   LYS  34          HZ1       LYS  34 -13.863  -5.197  12.414
  274   2HZ   LYS  34          HZ2       LYS  34 -13.700  -3.890  13.488
  275   3HZ   LYS  34          HZ3       LYS  34 -12.334  -4.784  13.019
  276    H    MET  35           HN       MET  35  -9.663  -0.246   7.276
  277    HA   MET  35           HA       MET  35  -7.341   0.163   9.029
  278   1HB   MET  35          HB2       MET  35  -7.774  -1.175   6.613
  279   2HB   MET  35          HB1       MET  35  -6.761   0.174   6.136
  280   1HG   MET  35          HG2       MET  35  -5.261  -0.499   8.112
  281   2HG   MET  35          HG1       MET  35  -6.180  -2.001   8.136
  282   1HE   MET  35          HE1       MET  35  -4.704  -4.140   5.584
  283   2HE   MET  35          HE2       MET  35  -6.249  -3.753   6.339
  284   3HE   MET  35          HE3       MET  35  -4.800  -3.890   7.330
  285    H    CYS  36           HN       CYS  36  -8.941   2.005   6.344
  286    HA   CYS  36           HA       CYS  36  -7.015   4.133   6.507
  287   1HB   CYS  36          HB2       CYS  36  -9.806   3.885   5.392
  288   2HB   CYS  36          HB1       CYS  36  -9.137   5.502   5.605
  289    H    SER  37           HN       SER  37  -9.075   2.920   8.754
  290    HA   SER  37           HA       SER  37  -9.881   5.480   9.976
  291   1HB   SER  37          HB2       SER  37 -11.179   3.280  10.137
  292   2HB   SER  37          HB1       SER  37  -9.956   2.763  11.294
  293    HG   SER  37           HG       SER  37 -11.415   3.736  12.551
  294    H    LYS  38           HN       LYS  38  -6.904   4.430   9.659
  295    HA   LYS  38           HA       LYS  38  -6.117   5.006  12.507
  296   1HB   LYS  38          HB2       LYS  38  -4.928   3.120  10.470
  297   2HB   LYS  38          HB1       LYS  38  -3.969   3.727  11.819
  298   1HG   LYS  38          HG2       LYS  38  -5.639   2.859  13.407
  299   2HG   LYS  38          HG1       LYS  38  -6.616   2.266  12.063
  300   1HD   LYS  38          HD2       LYS  38  -4.699   0.840  11.346
  301   2HD   LYS  38          HD1       LYS  38  -3.806   1.374  12.770
  302   1HE   LYS  38          HE2       LYS  38  -6.455  -0.103  12.783
  303   2HE   LYS  38          HE1       LYS  38  -4.887  -0.784  13.217
  304   1HZ   LYS  38          HZ1       LYS  38  -6.660   0.815  14.779
  305   2HZ   LYS  38          HZ2       LYS  38  -5.098   1.482  14.730
  306   3HZ   LYS  38          HZ3       LYS  38  -5.327  -0.112  15.272
  307    H    LEU  39           HN       LEU  39  -6.455   6.728   9.910
  308    HA   LEU  39           HA       LEU  39  -3.782   8.085  10.124
  309   1HB   LEU  39          HB2       LEU  39  -5.603   7.924   7.703
  310   2HB   LEU  39          HB1       LEU  39  -4.076   8.789   7.762
  311    HG   LEU  39           HG       LEU  39  -4.354   5.809   8.220
  312   1HD1  LEU  39          HD11      LEU  39  -3.266   7.203   5.780
  313   2HD1  LEU  39          HD12      LEU  39  -4.935   6.652   5.890
  314   3HD1  LEU  39          HD13      LEU  39  -3.614   5.490   5.972
  315   1HD2  LEU  39          HD21      LEU  39  -1.823   6.002   7.651
  316   2HD2  LEU  39          HD22      LEU  39  -2.333   6.514   9.254
  317   3HD2  LEU  39          HD23      LEU  39  -2.018   7.714   8.002
  318    HA   PRO  40           HA       PRO  40  -6.087  11.586  11.583
  319   1HB   PRO  40          HB2       PRO  40  -4.594  13.414   9.804
  320   2HB   PRO  40          HB1       PRO  40  -4.607  13.349  11.574
  321   1HG   PRO  40          HG2       PRO  40  -2.529  12.410   9.848
  322   2HG   PRO  40          HG1       PRO  40  -2.632  12.188  11.601
  323   1HD   PRO  40          HD2       PRO  40  -2.931  10.178   9.571
  324   2HD   PRO  40          HD1       PRO  40  -3.088   9.963  11.319
  325    H    LYS  41           HN       LYS  41  -7.760  13.166  10.700
  326    HA   LYS  41           HA       LYS  41  -9.126  12.028   8.432
  327   1HB   LYS  41          HB2       LYS  41 -10.058  13.485  10.392
  328   2HB   LYS  41          HB1       LYS  41  -9.593  14.845   9.374
  329   1HG   LYS  41          HG2       LYS  41 -10.914  13.769   7.497
  330   2HG   LYS  41          HG1       LYS  41 -11.526  12.616   8.679
  331   1HD   LYS  41          HD2       LYS  41 -11.781  15.624   8.971
  332   2HD   LYS  41          HD1       LYS  41 -13.040  14.598   8.285
  333   1HE   LYS  41          HE2       LYS  41 -12.863  13.232  10.473
  334   2HE   LYS  41          HE1       LYS  41 -11.979  14.619  11.111
  335   1HZ   LYS  41          HZ1       LYS  41 -14.600  14.424  11.249
  336   2HZ   LYS  41          HZ2       LYS  41 -14.484  15.165   9.725
  337   3HZ   LYS  41          HZ3       LYS  41 -13.811  15.918  11.091
  338    H    SER  42           HN       SER  42  -6.522  14.255   8.536
  339    HA   SER  42           HA       SER  42  -7.258  15.664   6.128
  340   1HB   SER  42          HB2       SER  42  -5.735  16.779   7.612
  341   2HB   SER  42          HB1       SER  42  -4.629  15.409   7.605
  342    HG   SER  42           HG       SER  42  -5.219  16.371   5.109
  343    H    LEU  43           HN       LEU  43  -6.020  12.552   6.484
  344    HA   LEU  43           HA       LEU  43  -5.150  12.559   3.595
  345   1HB   LEU  43          HB2       LEU  43  -4.453  10.439   5.630
  346   2HB   LEU  43          HB1       LEU  43  -3.743  10.688   4.038
  347    HG   LEU  43           HG       LEU  43  -3.464  12.467   6.448
  348   1HD1  LEU  43          HD11      LEU  43  -0.996  11.935   5.992
  349   2HD1  LEU  43          HD12      LEU  43  -1.602  10.630   4.973
  350   3HD1  LEU  43          HD13      LEU  43  -1.986  10.659   6.694
  351   1HD2  LEU  43          HD21      LEU  43  -3.546  13.953   4.578
  352   2HD2  LEU  43          HD22      LEU  43  -2.613  12.845   3.578
  353   3HD2  LEU  43          HD23      LEU  43  -1.833  13.707   4.901
  354    H    SER  44           HN       SER  44  -7.700  11.783   5.573
  355    HA   SER  44           HA       SER  44  -8.592   9.243   5.163
  356   1HB   SER  44          HB2       SER  44 -10.145  11.809   4.753
  357   2HB   SER  44          HB1       SER  44 -10.912  10.224   4.780
  358    HG   SER  44           HG       SER  44 -10.918  11.130   6.848
  359    H    GLU  45           HN       GLU  45  -9.484  11.730   2.843
  360    HA   GLU  45           HA       GLU  45 -10.606  10.230   0.902
  361   1HB   GLU  45          HB2       GLU  45  -9.031  12.782   0.607
  362   2HB   GLU  45          HB1       GLU  45 -10.197  12.169  -0.566
  363   1HG   GLU  45          HG2       GLU  45 -10.897  12.692   2.335
  364   2HG   GLU  45          HG1       GLU  45 -11.130  13.881   1.054
  365    H    GLU  46           HN       GLU  46  -7.222  11.334   0.617
  366    HA   GLU  46           HA       GLU  46  -6.797  10.126  -1.925
  367   1HB   GLU  46          HB2       GLU  46  -4.813  10.645   0.301
  368   2HB   GLU  46          HB1       GLU  46  -4.395  10.299  -1.372
  369   1HG   GLU  46          HG2       GLU  46  -4.330  12.669  -1.222
  370   2HG   GLU  46          HG1       GLU  46  -5.876  12.312  -1.989
  371    H    CYS  47           HN       CYS  47  -6.954   8.727   1.267
  372    HA   CYS  47           HA       CYS  47  -5.559   6.293   0.464
  373   1HB   CYS  47          HB2       CYS  47  -5.833   5.633   2.671
  374   2HB   CYS  47          HB1       CYS  47  -6.158   7.351   2.902
  375    H    GLN  48           HN       GLN  48  -8.950   7.265   0.875
  376    HA   GLN  48           HA       GLN  48 -10.173   4.817   0.226
  377   1HB   GLN  48          HB2       GLN  48 -11.343   6.963   0.915
  378   2HB   GLN  48          HB1       GLN  48 -11.149   7.519  -0.747
  379   1HG   GLN  48          HG2       GLN  48 -13.332   6.528  -0.607
  380   2HG   GLN  48          HG1       GLN  48 -12.312   5.381  -1.479
  381   1HE2  GLN  48          HE21      GLN  48 -14.165   3.881  -0.574
  382   2HE2  GLN  48          HE22      GLN  48 -13.882   3.189   0.950
  383    H    GLU  49           HN       GLU  49  -8.906   7.334  -1.947
  384    HA   GLU  49           HA       GLU  49  -9.726   6.027  -4.368
  385   1HB   GLU  49          HB2       GLU  49  -7.608   8.100  -3.761
  386   2HB   GLU  49          HB1       GLU  49  -7.951   7.532  -5.396
  387   1HG   GLU  49          HG2       GLU  49 -10.253   8.280  -5.233
  388   2HG   GLU  49          HG1       GLU  49 -10.034   8.706  -3.535
  389    H    VAL  50           HN       VAL  50  -6.715   5.912  -2.462
  390    HA   VAL  50           HA       VAL  50  -5.308   4.284  -4.363
  391    HB   VAL  50           HB       VAL  50  -4.843   4.481  -1.380
  392   1HG1  VAL  50          HG11      VAL  50  -3.132   3.460  -3.649
  393   2HG1  VAL  50          HG12      VAL  50  -3.757   2.532  -2.286
  394   3HG1  VAL  50          HG13      VAL  50  -2.532   3.770  -2.023
  395   1HG2  VAL  50          HG21      VAL  50  -4.711   6.604  -3.033
  396   2HG2  VAL  50          HG22      VAL  50  -3.148   5.898  -3.417
  397   3HG2  VAL  50          HG23      VAL  50  -3.520   6.362  -1.758
  398    H    VAL  51           HN       VAL  51  -6.940   3.478  -1.262
  399    HA   VAL  51           HA       VAL  51  -6.548   0.699  -1.551
  400    HB   VAL  51           HB       VAL  51  -8.801   2.112  -0.065
  401   1HG1  VAL  51          HG11      VAL  51  -8.678   0.113   1.418
  402   2HG1  VAL  51          HG12      VAL  51  -7.531  -0.609   0.291
  403   3HG1  VAL  51          HG13      VAL  51  -9.186  -0.281  -0.224
  404   1HG2  VAL  51          HG21      VAL  51  -7.338   2.210   1.848
  405   2HG2  VAL  51          HG22      VAL  51  -6.469   2.915   0.484
  406   3HG2  VAL  51          HG23      VAL  51  -6.100   1.272   1.008
  407    H    ASP  52           HN       ASP  52  -9.449   2.587  -2.335
  408    HA   ASP  52           HA       ASP  52 -10.954   0.410  -3.343
  409   1HB   ASP  52          HB2       ASP  52 -11.908   2.594  -2.724
  410   2HB   ASP  52          HB1       ASP  52 -11.137   3.326  -4.129
  411    H    THR  53           HN       THR  53  -8.838   2.697  -5.088
  412    HA   THR  53           HA       THR  53  -9.407   1.377  -7.653
  413    HB   THR  53           HB       THR  53  -7.338   3.490  -7.050
  414    HG1  THR  53           HG1      THR  53 -10.066   3.744  -7.769
  415   1HG2  THR  53          HG21      THR  53  -7.554   3.996  -9.417
  416   2HG2  THR  53          HG22      THR  53  -8.849   2.812  -9.584
  417   3HG2  THR  53          HG23      THR  53  -7.205   2.278  -9.234
  418    H    TYR  54           HN       TYR  54  -6.649   1.574  -5.393
  419    HA   TYR  54           HA       TYR  54  -5.284  -0.486  -7.097
  420   1HB   TYR  54          HB2       TYR  54  -4.177   1.499  -5.124
  421   2HB   TYR  54          HB1       TYR  54  -3.220   0.251  -5.917
  422    HD1  TYR  54           HD1      TYR  54  -2.731   0.368  -8.318
  423    HD2  TYR  54           HD2      TYR  54  -5.114   3.357  -6.390
  424    HE1  TYR  54           HE1      TYR  54  -2.493   1.842 -10.300
  425    HE2  TYR  54           HE2      TYR  54  -4.884   4.836  -8.347
  426    HH   TYR  54           HH       TYR  54  -3.080   5.052 -10.283
  427    H    GLY  55           HN       GLY  55  -7.335  -1.137  -5.088
  428   1HA   GLY  55          HA2       GLY  55  -5.908  -2.210  -2.783
  429   2HA   GLY  55          HA1       GLY  55  -7.620  -2.419  -3.127
  430    H    SER  56           HN       SER  56  -7.686  -3.757  -5.515
  431    HA   SER  56           HA       SER  56  -6.892  -6.376  -4.681
  432   1HB   SER  56          HB2       SER  56  -7.535  -5.694  -7.545
  433   2HB   SER  56          HB1       SER  56  -7.884  -7.176  -6.655
  434    HG   SER  56           HG       SER  56  -9.507  -5.208  -7.015
  435    H    SER  57           HN       SER  57  -5.425  -3.935  -6.683
  436    HA   SER  57           HA       SER  57  -3.564  -5.782  -7.902
  437   1HB   SER  57          HB2       SER  57  -2.517  -3.805  -8.908
  438   2HB   SER  57          HB1       SER  57  -4.269  -3.670  -9.032
  439    HG   SER  57           HG       SER  57  -3.963  -1.835  -8.052
  440    H    ILE  58           HN       ILE  58  -3.205  -3.362  -5.290
  441    HA   ILE  58           HA       ILE  58  -0.422  -3.753  -4.803
  442    HB   ILE  58           HB       ILE  58  -2.720  -3.083  -2.943
  443   1HG1  ILE  58          HG12      ILE  58  -0.425  -1.392  -3.989
  444   2HG1  ILE  58          HG11      ILE  58  -2.025  -1.420  -4.716
  445   1HG2  ILE  58          HG21      ILE  58  -0.768  -2.334  -1.398
  446   2HG2  ILE  58          HG22      ILE  58   0.242  -3.382  -2.390
  447   3HG2  ILE  58          HG23      ILE  58  -1.110  -4.061  -1.486
  448   1HD1  ILE  58          HD11      ILE  58  -1.193  -0.378  -2.014
  449   2HD1  ILE  58          HD12      ILE  58  -2.869  -0.845  -2.303
  450   3HD1  ILE  58          HD13      ILE  58  -2.137   0.441  -3.260
  451    H    LEU  59           HN       LEU  59  -3.219  -5.282  -3.322
  452    HA   LEU  59           HA       LEU  59  -1.783  -7.137  -1.736
  453   1HB   LEU  59          HB2       LEU  59  -4.012  -6.801  -1.103
  454   2HB   LEU  59          HB1       LEU  59  -4.608  -6.958  -2.748
  455    HG   LEU  59           HG       LEU  59  -4.185  -9.395  -2.685
  456   1HD1  LEU  59          HD11      LEU  59  -2.259  -9.208  -0.980
  457   2HD1  LEU  59          HD12      LEU  59  -3.383 -10.532  -0.733
  458   3HD1  LEU  59          HD13      LEU  59  -3.504  -9.077   0.254
  459   1HD2  LEU  59          HD21      LEU  59  -5.710  -9.467  -0.265
  460   2HD2  LEU  59          HD22      LEU  59  -6.300  -9.499  -1.922
  461   3HD2  LEU  59          HD23      LEU  59  -6.123  -7.963  -1.083
  462    H    SER  60           HN       SER  60  -2.617  -7.188  -5.170
  463    HA   SER  60           HA       SER  60  -2.295 -10.039  -5.305
  464   1HB   SER  60          HB2       SER  60  -3.684  -8.991  -6.975
  465   2HB   SER  60          HB1       SER  60  -2.379  -7.915  -7.468
  466    HG   SER  60           HG       SER  60  -2.455  -9.591  -8.926
  467    H    ILE  61           HN       ILE  61  -0.310  -7.199  -5.879
  468    HA   ILE  61           HA       ILE  61   1.974  -8.478  -7.077
  469    HB   ILE  61           HB       ILE  61   1.982  -5.955  -5.407
  470   1HG1  ILE  61          HG12      ILE  61   0.427  -6.463  -7.806
  471   2HG1  ILE  61          HG11      ILE  61   0.571  -4.969  -6.891
  472   1HG2  ILE  61          HG21      ILE  61   3.675  -6.837  -7.761
  473   2HG2  ILE  61          HG22      ILE  61   4.165  -6.864  -6.068
  474   3HG2  ILE  61          HG23      ILE  61   3.852  -5.328  -6.866
  475   1HD1  ILE  61          HD11      ILE  61   2.455  -5.858  -9.091
  476   2HD1  ILE  61          HD12      ILE  61   2.578  -4.358  -8.167
  477   3HD1  ILE  61          HD13      ILE  61   1.201  -4.628  -9.233
  478    H    LEU  62           HN       LEU  62   1.323  -7.403  -3.731
  479    HA   LEU  62           HA       LEU  62   3.780  -8.177  -2.626
  480   1HB   LEU  62          HB2       LEU  62   1.150  -7.393  -1.675
  481   2HB   LEU  62          HB1       LEU  62   1.764  -8.682  -0.645
  482    HG   LEU  62           HG       LEU  62   3.501  -6.310  -1.366
  483   1HD1  LEU  62          HD11      LEU  62   1.715  -5.157  -0.402
  484   2HD1  LEU  62          HD12      LEU  62   2.735  -5.496   0.992
  485   3HD1  LEU  62          HD13      LEU  62   1.312  -6.482   0.682
  486   1HD2  LEU  62          HD21      LEU  62   4.573  -6.959   0.789
  487   2HD2  LEU  62          HD22      LEU  62   4.584  -8.278  -0.375
  488   3HD2  LEU  62          HD23      LEU  62   3.420  -8.277   0.947
  489    H    LEU  63           HN       LEU  63   0.872 -10.110  -3.198
  490    HA   LEU  63           HA       LEU  63   1.870 -12.526  -1.944
  491   1HB   LEU  63          HB2       LEU  63  -0.310 -11.879  -3.928
  492   2HB   LEU  63          HB1       LEU  63   0.106 -13.555  -3.590
  493    HG   LEU  63           HG       LEU  63  -0.591 -13.399  -1.334
  494   1HD1  LEU  63          HD11      LEU  63  -0.367 -10.414  -1.648
  495   2HD1  LEU  63          HD12      LEU  63   0.501 -11.455  -0.531
  496   3HD1  LEU  63          HD13      LEU  63  -1.211 -11.166  -0.302
  497   1HD2  LEU  63          HD21      LEU  63  -2.481 -11.473  -2.675
  498   2HD2  LEU  63          HD22      LEU  63  -2.855 -12.692  -1.455
  499   3HD2  LEU  63          HD23      LEU  63  -2.426 -13.185  -3.093
  500    H    GLU  64           HN       GLU  64   2.697 -10.902  -4.833
  501    HA   GLU  64           HA       GLU  64   3.710 -13.350  -6.124
  502   1HB   GLU  64          HB2       GLU  64   2.617 -11.342  -7.331
  503   2HB   GLU  64          HB1       GLU  64   4.145 -10.516  -7.071
  504   1HG   GLU  64          HG2       GLU  64   4.319 -11.517  -9.231
  505   2HG   GLU  64          HG1       GLU  64   5.261 -12.554  -8.161
  506    H    GLU  65           HN       GLU  65   4.759 -12.624  -3.598
  507    HA   GLU  65           HA       GLU  65   6.842 -12.356  -2.466
  508   1HB   GLU  65          HB2       GLU  65   7.590 -13.701  -5.053
  509   2HB   GLU  65          HB1       GLU  65   8.636 -13.602  -3.636
  510   1HG   GLU  65          HG2       GLU  65   5.841 -14.764  -3.547
  511   2HG   GLU  65          HG1       GLU  65   7.283 -15.743  -3.821
  512    H    VAL  66           HN       VAL  66   6.144 -10.011  -4.298
  513    HA   VAL  66           HA       VAL  66   8.820  -9.150  -5.264
  514    HB   VAL  66           HB       VAL  66   5.993  -8.181  -5.555
  515   1HG1  VAL  66          HG11      VAL  66   6.943  -6.103  -4.925
  516   2HG1  VAL  66          HG12      VAL  66   7.019  -6.093  -6.687
  517   3HG1  VAL  66          HG13      VAL  66   8.464  -6.457  -5.743
  518   1HG2  VAL  66          HG21      VAL  66   6.504  -8.269  -7.883
  519   2HG2  VAL  66          HG22      VAL  66   7.272  -9.697  -7.184
  520   3HG2  VAL  66          HG23      VAL  66   8.240  -8.277  -7.576
  521    H    SER  67           HN       SER  67   9.955  -7.429  -4.241
  522    HA   SER  67           HA       SER  67   9.821  -7.167  -1.468
  523   1HB   SER  67          HB2       SER  67  10.715  -4.792  -3.073
  524   2HB   SER  67          HB1       SER  67  11.481  -5.543  -1.679
  525    HG   SER  67           HG       SER  67  12.148  -7.220  -2.974
  526    HA   PRO  68           HA       PRO  68   6.264  -4.653  -0.725
  527   1HB   PRO  68          HB2       PRO  68   7.227  -3.113   1.470
  528   2HB   PRO  68          HB1       PRO  68   6.428  -4.679   1.562
  529   1HG   PRO  68          HG2       PRO  68   9.282  -4.051   1.927
  530   2HG   PRO  68          HG1       PRO  68   8.392  -5.508   2.397
  531   1HD   PRO  68          HD2       PRO  68  10.192  -5.283   0.212
  532   2HD   PRO  68          HD1       PRO  68   9.076  -6.627   0.530
  533    H    GLU  69           HN       GLU  69   9.336  -2.740  -0.623
  534    HA   GLU  69           HA       GLU  69   7.904  -0.277  -1.211
  535   1HB   GLU  69          HB2       GLU  69  10.204   0.691  -1.502
  536   2HB   GLU  69          HB1       GLU  69   9.936  -0.095   0.052
  537   1HG   GLU  69          HG2       GLU  69  11.014  -2.168  -0.892
  538   2HG   GLU  69          HG1       GLU  69  11.422  -1.233  -2.333
  539    H    LEU  70           HN       LEU  70   8.966  -2.845  -3.202
  540    HA   LEU  70           HA       LEU  70   9.464  -1.171  -5.533
  541   1HB   LEU  70          HB2       LEU  70   9.006  -4.147  -5.173
  542   2HB   LEU  70          HB1       LEU  70   9.160  -3.437  -6.765
  543    HG   LEU  70           HG       LEU  70  11.205  -3.086  -4.600
  544   1HD1  LEU  70          HD11      LEU  70  12.493  -4.854  -5.540
  545   2HD1  LEU  70          HD12      LEU  70  11.457  -4.943  -6.962
  546   3HD1  LEU  70          HD13      LEU  70  10.858  -5.498  -5.400
  547   1HD2  LEU  70          HD21      LEU  70  11.680  -1.380  -6.096
  548   2HD2  LEU  70          HD22      LEU  70  11.034  -2.266  -7.472
  549   3HD2  LEU  70          HD23      LEU  70  12.613  -2.682  -6.822
  550    H    VAL  71           HN       VAL  71   6.765  -2.232  -3.806
  551    HA   VAL  71           HA       VAL  71   4.846  -2.362  -5.918
  552    HB   VAL  71           HB       VAL  71   4.647  -1.880  -2.935
  553   1HG1  VAL  71          HG11      VAL  71   2.087  -2.189  -3.304
  554   2HG1  VAL  71          HG12      VAL  71   2.412  -1.641  -4.949
  555   3HG1  VAL  71          HG13      VAL  71   2.768  -0.590  -3.580
  556   1HG2  VAL  71          HG21      VAL  71   3.377  -4.054  -3.077
  557   2HG2  VAL  71          HG22      VAL  71   5.062  -4.160  -3.586
  558   3HG2  VAL  71          HG23      VAL  71   3.778  -4.106  -4.795
  559    H    CYS  72           HN       CYS  72   5.476   0.395  -3.667
  560    HA   CYS  72           HA       CYS  72   3.694   2.066  -5.043
  561   1HB   CYS  72          HB2       CYS  72   4.996   2.344  -2.759
  562   2HB   CYS  72          HB1       CYS  72   6.148   3.240  -3.735
  563    H    SER  73           HN       SER  73   7.017   1.185  -5.697
  564    HA   SER  73           HA       SER  73   7.483   3.298  -7.683
  565   1HB   SER  73          HB2       SER  73   9.065   0.742  -7.537
  566   2HB   SER  73          HB1       SER  73   9.613   2.349  -8.000
  567    HG   SER  73           HG       SER  73   9.098   1.274  -5.460
  568    H    MET  74           HN       MET  74   6.556  -0.150  -7.925
  569    HA   MET  74           HA       MET  74   6.637  -0.155 -10.851
  570   1HB   MET  74          HB2       MET  74   5.835  -2.048  -8.710
  571   2HB   MET  74          HB1       MET  74   4.928  -2.217 -10.210
  572   1HG   MET  74          HG2       MET  74   7.267  -2.223 -11.363
  573   2HG   MET  74          HG1       MET  74   7.884  -2.569  -9.753
  574   1HE   MET  74          HE1       MET  74   5.637  -5.702  -8.833
  575   2HE   MET  74          HE2       MET  74   4.812  -4.153  -8.971
  576   3HE   MET  74          HE3       MET  74   6.400  -4.233  -8.217
  577    H    LEU  75           HN       LEU  75   3.991   0.344  -8.488
  578    HA   LEU  75           HA       LEU  75   1.995   0.497 -10.586
  579   1HB   LEU  75          HB2       LEU  75   1.824   1.630  -7.779
  580   2HB   LEU  75          HB1       LEU  75   0.478   1.258  -8.854
  581    HG   LEU  75           HG       LEU  75   2.392  -0.716  -7.590
  582   1HD1  LEU  75          HD11      LEU  75   0.214  -1.656  -6.718
  583   2HD1  LEU  75          HD12      LEU  75  -0.565  -0.195  -7.317
  584   3HD1  LEU  75          HD13      LEU  75   0.669  -0.084  -6.062
  585   1HD2  LEU  75          HD21      LEU  75   0.766  -2.390  -8.760
  586   2HD2  LEU  75          HD22      LEU  75   2.050  -1.661  -9.719
  587   3HD2  LEU  75          HD23      LEU  75   0.403  -1.037  -9.831
  588    H    HIS  76           HN       HIS  76   4.475   2.343 -10.555
  589    HA   HIS  76           HA       HIS  76   4.974   4.592 -11.043
  590   1HB   HIS  76          HB2       HIS  76   3.690   5.524 -12.849
  591   2HB   HIS  76          HB1       HIS  76   3.748   3.782 -13.104
  592    HD1  HIS  76           HD1      HIS  76   1.427   6.386 -11.565
  593    HD2  HIS  76           HD2      HIS  76   1.248   2.619 -13.341
  594    HE1  HIS  76           HE1      HIS  76  -1.031   5.809 -11.776
  595    H    LEU  77           HN       LEU  77   3.247   4.013  -8.597
  596    HA   LEU  77           HA       LEU  77   1.578   6.419  -8.396
  597   1HB   LEU  77          HB2       LEU  77   1.753   3.868  -7.078
  598   2HB   LEU  77          HB1       LEU  77   1.986   5.095  -5.846
  599    HG   LEU  77           HG       LEU  77  -0.113   6.110  -6.351
  600   1HD1  LEU  77          HD11      LEU  77  -1.504   4.606  -8.212
  601   2HD1  LEU  77          HD12      LEU  77   0.113   4.661  -8.909
  602   3HD1  LEU  77          HD13      LEU  77  -0.734   6.156  -8.535
  603   1HD2  LEU  77          HD21      LEU  77   0.078   3.723  -5.160
  604   2HD2  LEU  77          HD22      LEU  77  -0.934   3.247  -6.519
  605   3HD2  LEU  77          HD23      LEU  77  -1.478   4.500  -5.422
  606    H    CYS  78           HN       CYS  78   4.821   5.581  -7.915
  607    HA   CYS  78           HA       CYS  78   5.316   8.144  -6.438
  608   1HB   CYS  78          HB2       CYS  78   5.612   5.743  -5.255
  609   2HB   CYS  78          HB1       CYS  78   7.184   5.842  -6.032
  610    H    SER  79           HN       SER  79   8.249   7.778  -6.649
  611    HA   SER  79           HA       SER  79   8.887   7.048  -9.314
  612   1HB   SER  79          HB2       SER  79   9.478   9.801  -9.654
  613   2HB   SER  79          HB1       SER  79   8.204   8.901 -10.471
  614    HG   SER  79           HG       SER  79   7.014  10.312  -9.428
  615    H    GLY  80           HN       GLY  80   9.755   8.524  -6.332
  616   1HA   GLY  80          HA2       GLY  80  11.839   8.358  -5.221
  617   2HA   GLY  80          HA1       GLY  80  12.508   7.594  -6.665
  618    H    LEU  81           HN       LEU  81  14.383   8.969  -6.603
  619    HA   LEU  81           HA       LEU  81  14.049  11.876  -6.723
  620   1HB   LEU  81          HB2       LEU  81  16.566  10.344  -7.396
  621   2HB   LEU  81          HB1       LEU  81  16.423  11.984  -6.763
  622    HG   LEU  81           HG       LEU  81  15.728   9.425  -5.290
  623   1HD1  LEU  81          HD11      LEU  81  18.130   9.814  -5.421
  624   2HD1  LEU  81          HD12      LEU  81  17.577  10.187  -3.787
  625   3HD1  LEU  81          HD13      LEU  81  17.916  11.492  -4.923
  626   1HD2  LEU  81          HD21      LEU  81  15.373  12.351  -4.603
  627   2HD2  LEU  81          HD22      LEU  81  15.478  11.112  -3.352
  628   3HD2  LEU  81          HD23      LEU  81  14.172  11.062  -4.535
  629    H    VAL  82           HN       VAL  82  12.852  10.069  -8.828
  630    HA   VAL  82           HA       VAL  82  13.929  11.554 -11.182
  631    HB   VAL  82           HB       VAL  82  15.056   9.481 -11.397
  632   1HG1  VAL  82          HG11      VAL  82  12.486   7.917 -11.132
  633   2HG1  VAL  82          HG12      VAL  82  13.467   8.294  -9.720
  634   3HG1  VAL  82          HG13      VAL  82  14.143   7.337 -11.030
  635   1HG2  VAL  82          HG21      VAL  82  13.764  10.354 -13.415
  636   2HG2  VAL  82          HG22      VAL  82  12.560   9.115 -13.065
  637   3HG2  VAL  82          HG23      VAL  82  14.210   8.649 -13.471
  638    HA   PRO  83           HA       PRO  83   9.347  11.760 -11.066
  639   1HB   PRO  83          HB2       PRO  83   9.347  14.057 -12.799
  640   2HB   PRO  83          HB1       PRO  83   9.083  14.036 -11.053
  641   1HG   PRO  83          HG2       PRO  83  11.408  15.024 -12.476
  642   2HG   PRO  83          HG1       PRO  83  11.114  15.037 -10.731
  643   1HD   PRO  83          HD2       PRO  83  12.905  13.307 -12.234
  644   2HD   PRO  83          HD1       PRO  83  12.683  13.389 -10.474
  645    H    ARG  84           HN       ARG  84   9.911   9.731 -12.446
  646    HA   ARG  84           HA       ARG  84  10.155   9.937 -15.291
  647   1HB   ARG  84          HB2       ARG  84  10.618   7.874 -13.911
  648   2HB   ARG  84          HB1       ARG  84   8.874   7.670 -13.741
  649   1HG   ARG  84          HG2       ARG  84   8.638   7.551 -16.187
  650   2HG   ARG  84          HG1       ARG  84  10.377   7.781 -16.373
  651   1HD   ARG  84          HD2       ARG  84   9.932   5.411 -16.533
  652   2HD   ARG  84          HD1       ARG  84  10.720   5.705 -14.984
  653    HE   ARG  84           HE       ARG  84   8.020   5.857 -14.388
  654   1HH1  ARG  84          HH21      ARG  84  10.114   3.613 -15.958
  655   2HH1  ARG  84          HH22      ARG  84   9.194   2.221 -15.487
  656   1HH2  ARG  84          HH11      ARG  84   6.808   4.054 -13.763
  657   2HH2  ARG  84          HH12      ARG  84   7.324   2.471 -14.245
  Start of MODEL   17
    1   1H    SER   1          HT1       SER   1   7.026  17.244  -0.473
    2   2H    SER   1          HT2       SER   1   5.851  17.971  -1.463
    3   3H    SER   1          HT3       SER   1   6.169  16.307  -1.598
    4    HA   SER   1           HA       SER   1   5.514  16.312   0.926
    5   1HB   SER   1          HB2       SER   1   3.991  18.653  -0.256
    6   2HB   SER   1          HB1       SER   1   3.713  17.941   1.330
    7    HG   SER   1           HG       SER   1   6.244  18.913   0.523
    8    H    ASP   2           HN       ASP   2   5.308  15.008  -1.630
    9    HA   ASP   2           HA       ASP   2   2.630  14.782  -2.580
   10   1HB   ASP   2          HB2       ASP   2   3.443  12.797  -3.741
   11   2HB   ASP   2          HB1       ASP   2   4.693  14.036  -3.783
   12    H    VAL   3           HN       VAL   3   1.000  14.251  -1.245
   13    HA   VAL   3           HA       VAL   3   1.262  12.565   1.095
   14    HB   VAL   3           HB       VAL   3  -0.897  13.174   1.583
   15   1HG1  VAL   3          HG11      VAL   3  -0.307  15.270  -0.509
   16   2HG1  VAL   3          HG12      VAL   3   0.580  15.169   1.012
   17   3HG1  VAL   3          HG13      VAL   3  -1.159  15.468   1.022
   18   1HG2  VAL   3          HG21      VAL   3  -2.134  12.107  -0.183
   19   2HG2  VAL   3          HG22      VAL   3  -1.456  13.192  -1.400
   20   3HG2  VAL   3          HG23      VAL   3  -2.593  13.811  -0.205
   21    H    TYR   4           HN       TYR   4   0.621  11.801  -2.300
   22    HA   TYR   4           HA       TYR   4  -0.979   9.514  -1.674
   23   1HB   TYR   4          HB2       TYR   4   0.362  10.591  -4.142
   24   2HB   TYR   4          HB1       TYR   4  -0.158   8.916  -4.175
   25    HD1  TYR   4           HD1      TYR   4  -1.196  12.342  -4.476
   26    HD2  TYR   4           HD2      TYR   4  -2.593   8.384  -3.574
   27    HE1  TYR   4           HE1      TYR   4  -3.524  13.049  -4.958
   28    HE2  TYR   4           HE2      TYR   4  -4.914   9.085  -4.065
   29    HH   TYR   4           HH       TYR   4  -5.818  12.348  -4.372
   30    H    CYS   5           HN       CYS   5   2.453   9.832  -2.527
   31    HA   CYS   5           HA       CYS   5   3.140   7.058  -2.378
   32   1HB   CYS   5          HB2       CYS   5   4.692   9.604  -1.798
   33   2HB   CYS   5          HB1       CYS   5   5.426   8.019  -1.556
   34    H    GLU   6           HN       GLU   6   3.001   9.541   0.215
   35    HA   GLU   6           HA       GLU   6   3.945   7.961   2.326
   36   1HB   GLU   6          HB2       GLU   6   3.468  10.310   2.666
   37   2HB   GLU   6          HB1       GLU   6   1.758  10.062   2.315
   38   1HG   GLU   6          HG2       GLU   6   1.416   8.834   4.324
   39   2HG   GLU   6          HG1       GLU   6   3.149   8.638   4.590
   40    H    VAL   7           HN       VAL   7   0.639   8.045   0.971
   41    HA   VAL   7           HA       VAL   7  -0.325   6.166   2.968
   42    HB   VAL   7           HB       VAL   7  -1.553   6.940   0.297
   43   1HG1  VAL   7          HG11      VAL   7  -2.689   4.996   0.922
   44   2HG1  VAL   7          HG12      VAL   7  -3.665   6.243   1.693
   45   3HG1  VAL   7          HG13      VAL   7  -2.510   5.319   2.646
   46   1HG2  VAL   7          HG21      VAL   7  -3.042   8.293   2.047
   47   2HG2  VAL   7          HG22      VAL   7  -1.524   8.968   1.469
   48   3HG2  VAL   7          HG23      VAL   7  -1.593   8.188   3.047
   49    H    CYS   8           HN       CYS   8   0.928   5.675  -0.375
   50    HA   CYS   8           HA       CYS   8   0.144   2.938  -0.586
   51   1HB   CYS   8          HB2       CYS   8   0.956   4.136  -2.513
   52   2HB   CYS   8          HB1       CYS   8   2.513   4.424  -1.759
   53    H    GLU   9           HN       GLU   9   3.150   4.395   0.764
   54    HA   GLU   9           HA       GLU   9   4.265   1.833   1.411
   55   1HB   GLU   9          HB2       GLU   9   4.840   4.685   2.170
   56   2HB   GLU   9          HB1       GLU   9   5.563   3.412   3.151
   57   1HG   GLU   9          HG2       GLU   9   6.716   2.487   1.272
   58   2HG   GLU   9          HG1       GLU   9   5.794   3.467   0.133
   59    H    PHE  10           HN       PHE  10   2.000   4.034   3.087
   60    HA   PHE  10           HA       PHE  10   2.260   2.716   5.623
   61   1HB   PHE  10          HB2       PHE  10   1.210   4.946   5.415
   62   2HB   PHE  10          HB1       PHE  10  -0.136   4.212   4.534
   63    HD1  PHE  10           HD1      PHE  10   1.690   4.199   7.774
   64    HD2  PHE  10           HD2      PHE  10  -1.868   3.033   5.672
   65    HE1  PHE  10           HE1      PHE  10   0.654   3.513   9.920
   66    HE2  PHE  10           HE2      PHE  10  -2.912   2.343   7.821
   67    HZ   PHE  10           HZ       PHE  10  -1.650   2.593   9.943
   68    H    LEU  11           HN       LEU  11  -0.061   2.307   2.922
   69    HA   LEU  11           HA       LEU  11  -1.545   0.180   4.149
   70   1HB   LEU  11          HB2       LEU  11  -1.044   0.724   1.198
   71   2HB   LEU  11          HB1       LEU  11  -2.227  -0.432   1.826
   72    HG   LEU  11           HG       LEU  11  -2.241   2.503   2.602
   73   1HD1  LEU  11          HD11      LEU  11  -3.650   1.116   0.303
   74   2HD1  LEU  11          HD12      LEU  11  -2.489   2.440   0.194
   75   3HD1  LEU  11          HD13      LEU  11  -4.082   2.719   0.899
   76   1HD2  LEU  11          HD21      LEU  11  -4.190   0.196   2.839
   77   2HD2  LEU  11          HD22      LEU  11  -4.735   1.870   2.925
   78   3HD2  LEU  11          HD23      LEU  11  -3.587   1.257   4.112
   79    H    VAL  12           HN       VAL  12   1.332   0.111   1.981
   80    HA   VAL  12           HA       VAL  12   1.520  -2.713   1.819
   81    HB   VAL  12           HB       VAL  12   3.478  -0.421   1.594
   82   1HG1  VAL  12          HG11      VAL  12   5.152  -2.146   0.776
   83   2HG1  VAL  12          HG12      VAL  12   4.137  -3.376   1.534
   84   3HG1  VAL  12          HG13      VAL  12   4.897  -2.124   2.518
   85   1HG2  VAL  12          HG21      VAL  12   2.632  -2.566  -0.377
   86   2HG2  VAL  12          HG22      VAL  12   3.529  -1.088  -0.733
   87   3HG2  VAL  12          HG23      VAL  12   1.841  -0.996  -0.231
   88    H    LYS  13           HN       LYS  13   2.994  -0.429   4.163
   89    HA   LYS  13           HA       LYS  13   4.407  -2.340   5.705
   90   1HB   LYS  13          HB2       LYS  13   4.821   0.005   6.056
   91   2HB   LYS  13          HB1       LYS  13   3.134   0.305   6.464
   92   1HG   LYS  13          HG2       LYS  13   3.321  -0.900   8.530
   93   2HG   LYS  13          HG1       LYS  13   4.903  -1.542   8.089
   94   1HD   LYS  13          HD2       LYS  13   4.511   1.445   8.230
   95   2HD   LYS  13          HD1       LYS  13   4.721   0.533   9.723
   96   1HE   LYS  13          HE2       LYS  13   6.643   0.562   7.373
   97   2HE   LYS  13          HE1       LYS  13   6.890   1.346   8.931
   98   1HZ   LYS  13          HZ1       LYS  13   7.860  -0.554   9.516
   99   2HZ   LYS  13          HZ2       LYS  13   7.216  -1.410   8.197
  100   3HZ   LYS  13          HZ3       LYS  13   6.297  -1.205   9.612
  101    H    GLU  14           HN       GLU  14   1.085  -1.145   6.015
  102    HA   GLU  14           HA       GLU  14   0.480  -2.726   8.364
  103   1HB   GLU  14          HB2       GLU  14  -0.875  -0.787   6.670
  104   2HB   GLU  14          HB1       GLU  14  -1.957  -2.136   6.998
  105   1HG   GLU  14          HG2       GLU  14  -2.255  -0.494   8.749
  106   2HG   GLU  14          HG1       GLU  14  -1.415  -1.876   9.448
  107    H    VAL  15           HN       VAL  15   0.056  -3.246   4.872
  108    HA   VAL  15           HA       VAL  15  -1.506  -5.633   5.228
  109    HB   VAL  15           HB       VAL  15   0.035  -4.463   2.916
  110   1HG1  VAL  15          HG11      VAL  15   0.401  -6.714   2.387
  111   2HG1  VAL  15          HG12      VAL  15  -1.175  -6.438   1.631
  112   3HG1  VAL  15          HG13      VAL  15  -1.077  -7.249   3.191
  113   1HG2  VAL  15          HG21      VAL  15  -2.891  -5.154   3.332
  114   2HG2  VAL  15          HG22      VAL  15  -2.212  -4.302   1.945
  115   3HG2  VAL  15          HG23      VAL  15  -2.190  -3.549   3.540
  116    H    THR  16           HN       THR  16   2.037  -5.175   4.721
  117    HA   THR  16           HA       THR  16   2.498  -7.971   4.573
  118    HB   THR  16           HB       THR  16   4.753  -7.623   4.769
  119    HG1  THR  16           HG1      THR  16   4.026  -5.473   6.445
  120   1HG2  THR  16          HG21      THR  16   4.500  -4.791   4.107
  121   2HG2  THR  16          HG22      THR  16   3.339  -5.776   3.219
  122   3HG2  THR  16          HG23      THR  16   5.059  -6.121   3.099
  123    H    LYS  17           HN       LYS  17   2.361  -5.822   7.428
  124    HA   LYS  17           HA       LYS  17   3.241  -7.849   9.234
  125   1HB   LYS  17          HB2       LYS  17   3.192  -5.722  10.228
  126   2HB   LYS  17          HB1       LYS  17   1.603  -5.339   9.570
  127   1HG   LYS  17          HG2       LYS  17   0.473  -6.587  11.201
  128   2HG   LYS  17          HG1       LYS  17   1.861  -7.621  11.522
  129   1HD   LYS  17          HD2       LYS  17   3.015  -5.638  12.550
  130   2HD   LYS  17          HD1       LYS  17   1.510  -4.732  12.364
  131   1HE   LYS  17          HE2       LYS  17   0.323  -6.259  13.802
  132   2HE   LYS  17          HE1       LYS  17   1.686  -7.379  13.833
  133   1HZ   LYS  17          HZ1       LYS  17   2.944  -5.327  14.753
  134   2HZ   LYS  17          HZ2       LYS  17   1.955  -6.237  15.791
  135   3HZ   LYS  17          HZ3       LYS  17   1.395  -4.765  15.154
  136    H    LEU  18           HN       LEU  18   0.206  -7.064   7.720
  137    HA   LEU  18           HA       LEU  18  -1.452  -8.915   9.240
  138   1HB   LEU  18          HB2       LEU  18  -1.790  -7.566   6.545
  139   2HB   LEU  18          HB1       LEU  18  -3.009  -8.569   7.254
  140    HG   LEU  18           HG       LEU  18  -2.681  -5.771   7.605
  141   1HD1  LEU  18          HD11      LEU  18  -4.386  -7.649   9.241
  142   2HD1  LEU  18          HD12      LEU  18  -4.801  -7.033   7.641
  143   3HD1  LEU  18          HD13      LEU  18  -4.654  -5.927   9.007
  144   1HD2  LEU  18          HD21      LEU  18  -2.429  -5.412   9.973
  145   2HD2  LEU  18          HD22      LEU  18  -1.004  -6.257   9.414
  146   3HD2  LEU  18          HD23      LEU  18  -2.260  -7.130  10.287
  147    H    ILE  19           HN       ILE  19   0.486  -9.072   6.325
  148    HA   ILE  19           HA       ILE  19  -0.342 -11.762   5.592
  149    HB   ILE  19           HB       ILE  19   2.110 -10.112   4.852
  150   1HG1  ILE  19          HG12      ILE  19  -0.387 -10.861   3.280
  151   2HG1  ILE  19          HG11      ILE  19  -0.117  -9.301   4.029
  152   1HG2  ILE  19          HG21      ILE  19   2.689 -12.457   4.645
  153   2HG2  ILE  19          HG22      ILE  19   2.394 -11.816   3.033
  154   3HG2  ILE  19          HG23      ILE  19   1.166 -12.804   3.827
  155   1HD1  ILE  19          HD11      ILE  19   0.544  -8.974   1.784
  156   2HD1  ILE  19          HD12      ILE  19   1.360 -10.536   1.710
  157   3HD1  ILE  19          HD13      ILE  19   2.064  -9.218   2.644
  158    H    ASP  20           HN       ASP  20   2.081 -10.256   7.622
  159    HA   ASP  20           HA       ASP  20   3.585 -12.689   8.151
  160   1HB   ASP  20          HB2       ASP  20   4.476 -10.323   8.338
  161   2HB   ASP  20          HB1       ASP  20   3.512 -10.158   9.806
  162    H    ASN  21           HN       ASN  21   0.715 -11.205   9.532
  163    HA   ASN  21           HA       ASN  21   0.970 -12.889  11.944
  164   1HB   ASN  21          HB2       ASN  21   0.039 -10.581  12.181
  165   2HB   ASN  21          HB1       ASN  21  -1.309 -11.039  11.139
  166   1HD2  ASN  21          HD21      ASN  21  -2.528 -10.393  13.262
  167   2HD2  ASN  21          HD22      ASN  21  -2.773 -11.629  14.399
  168    H    ASN  22           HN       ASN  22   0.165 -13.543   8.904
  169    HA   ASN  22           HA       ASN  22  -0.682 -15.558   8.050
  170   1HB   ASN  22          HB2       ASN  22  -1.897 -16.306  10.696
  171   2HB   ASN  22          HB1       ASN  22  -1.230 -17.335   9.435
  172   1HD2  ASN  22          HD21      ASN  22   1.274 -16.279   8.953
  173   2HD2  ASN  22          HD22      ASN  22   2.216 -16.311  10.365
  174    H    LYS  23           HN       LYS  23  -2.345 -13.134   7.925
  175    HA   LYS  23           HA       LYS  23  -5.093 -14.141   8.449
  176   1HB   LYS  23          HB2       LYS  23  -4.443 -11.528   7.208
  177   2HB   LYS  23          HB1       LYS  23  -5.874 -11.970   8.121
  178   1HG   LYS  23          HG2       LYS  23  -3.700 -12.398   9.903
  179   2HG   LYS  23          HG1       LYS  23  -3.339 -10.874   9.107
  180   1HD   LYS  23          HD2       LYS  23  -5.444  -9.919   9.837
  181   2HD   LYS  23          HD1       LYS  23  -6.003 -11.490  10.415
  182   1HE   LYS  23          HE2       LYS  23  -4.095 -11.512  12.035
  183   2HE   LYS  23          HE1       LYS  23  -3.711  -9.865  11.532
  184   1HZ   LYS  23          HZ1       LYS  23  -6.222  -9.494  12.048
  185   2HZ   LYS  23          HZ2       LYS  23  -5.076  -9.474  13.301
  186   3HZ   LYS  23          HZ3       LYS  23  -6.025 -10.858  13.036
  187    H    THR  24           HN       THR  24  -6.605 -14.401   6.701
  188    HA   THR  24           HA       THR  24  -5.400 -15.273   4.183
  189    HB   THR  24           HB       THR  24  -7.459 -16.234   3.717
  190    HG1  THR  24           HG1      THR  24  -8.409 -13.890   4.880
  191   1HG2  THR  24          HG21      THR  24  -7.778 -15.767   6.687
  192   2HG2  THR  24          HG22      THR  24  -6.658 -16.943   5.999
  193   3HG2  THR  24          HG23      THR  24  -8.394 -17.124   5.745
  194    H    GLU  25           HN       GLU  25  -6.008 -14.436   2.101
  195    HA   GLU  25           HA       GLU  25  -5.804 -11.615   1.812
  196   1HB   GLU  25          HB2       GLU  25  -6.217 -13.874   0.057
  197   2HB   GLU  25          HB1       GLU  25  -7.351 -12.612  -0.412
  198   1HG   GLU  25          HG2       GLU  25  -5.223 -12.373  -1.618
  199   2HG   GLU  25          HG1       GLU  25  -5.487 -10.999  -0.546
  200    H    LYS  26           HN       LYS  26  -8.693 -13.686   1.960
  201    HA   LYS  26           HA       LYS  26 -10.704 -11.743   1.584
  202   1HB   LYS  26          HB2       LYS  26 -10.559 -14.325   3.115
  203   2HB   LYS  26          HB1       LYS  26 -11.982 -13.304   3.311
  204   1HG   LYS  26          HG2       LYS  26 -12.518 -13.433   0.989
  205   2HG   LYS  26          HG1       LYS  26 -10.945 -14.120   0.590
  206   1HD   LYS  26          HD2       LYS  26 -12.747 -15.839   0.625
  207   2HD   LYS  26          HD1       LYS  26 -11.483 -16.165   1.811
  208   1HE   LYS  26          HE2       LYS  26 -13.953 -16.353   2.588
  209   2HE   LYS  26          HE1       LYS  26 -12.827 -15.470   3.618
  210   1HZ   LYS  26          HZ1       LYS  26 -13.778 -13.497   3.129
  211   2HZ   LYS  26          HZ2       LYS  26 -15.142 -14.470   2.848
  212   3HZ   LYS  26          HZ3       LYS  26 -14.188 -13.942   1.544
  213    H    GLU  27           HN       GLU  27  -8.777 -12.376   4.468
  214    HA   GLU  27           HA       GLU  27 -10.422 -10.669   6.168
  215   1HB   GLU  27          HB2       GLU  27  -7.675 -11.882   6.491
  216   2HB   GLU  27          HB1       GLU  27  -8.396 -10.820   7.698
  217   1HG   GLU  27          HG2       GLU  27 -10.300 -12.326   7.934
  218   2HG   GLU  27          HG1       GLU  27  -9.646 -13.374   6.677
  219    H    ILE  28           HN       ILE  28  -7.457 -10.197   4.258
  220    HA   ILE  28           HA       ILE  28  -6.821  -7.611   5.338
  221    HB   ILE  28           HB       ILE  28  -6.182  -8.579   2.545
  222   1HG1  ILE  28          HG12      ILE  28  -5.307  -9.547   5.234
  223   2HG1  ILE  28          HG11      ILE  28  -5.645 -10.474   3.799
  224   1HG2  ILE  28          HG21      ILE  28  -4.562  -6.957   4.535
  225   2HG2  ILE  28          HG22      ILE  28  -5.521  -6.254   3.235
  226   3HG2  ILE  28          HG23      ILE  28  -4.146  -7.285   2.854
  227   1HD1  ILE  28          HD11      ILE  28  -3.281 -10.574   4.247
  228   2HD1  ILE  28          HD12      ILE  28  -3.177  -8.816   4.358
  229   3HD1  ILE  28          HD13      ILE  28  -3.519  -9.581   2.805
  230    H    LEU  29           HN       LEU  29  -8.761  -8.645   2.543
  231    HA   LEU  29           HA       LEU  29  -9.388  -5.961   1.704
  232   1HB   LEU  29          HB2       LEU  29 -10.985  -8.490   1.215
  233   2HB   LEU  29          HB1       LEU  29 -10.969  -7.028   0.224
  234    HG   LEU  29           HG       LEU  29  -8.539  -8.796   0.722
  235   1HD1  LEU  29          HD11      LEU  29 -10.110  -8.516  -1.853
  236   2HD1  LEU  29          HD12      LEU  29 -10.462  -9.781  -0.675
  237   3HD1  LEU  29          HD13      LEU  29  -8.879  -9.715  -1.450
  238   1HD2  LEU  29          HD21      LEU  29  -7.778  -7.421  -1.364
  239   2HD2  LEU  29          HD22      LEU  29  -7.735  -6.631   0.210
  240   3HD2  LEU  29          HD23      LEU  29  -9.058  -6.298  -0.908
  241    H    ASP  30           HN       ASP  30 -10.742  -8.212   4.010
  242    HA   ASP  30           HA       ASP  30 -13.239  -6.789   4.470
  243   1HB   ASP  30          HB2       ASP  30 -12.758  -9.180   5.188
  244   2HB   ASP  30          HB1       ASP  30 -11.722  -8.516   6.451
  245    H    ALA  31           HN       ALA  31 -10.040  -6.713   6.026
  246    HA   ALA  31           HA       ALA  31 -10.766  -4.742   7.995
  247   1HB   ALA  31          HB1       ALA  31  -8.776  -6.336   8.034
  248   2HB   ALA  31          HB2       ALA  31  -8.438  -4.676   8.517
  249   3HB   ALA  31          HB3       ALA  31  -7.989  -5.236   6.905
  250    H    PHE  32           HN       PHE  32  -9.808  -4.460   4.617
  251    HA   PHE  32           HA       PHE  32  -8.803  -1.821   4.515
  252   1HB   PHE  32          HB2       PHE  32 -10.449  -3.535   2.688
  253   2HB   PHE  32          HB1       PHE  32 -10.172  -1.866   2.253
  254    HD1  PHE  32           HD1      PHE  32  -9.056  -2.825   0.224
  255    HD2  PHE  32           HD2      PHE  32  -7.435  -3.451   4.172
  256    HE1  PHE  32           HE1      PHE  32  -6.848  -3.374  -0.749
  257    HE2  PHE  32           HE2      PHE  32  -5.248  -3.969   3.184
  258    HZ   PHE  32           HZ       PHE  32  -4.948  -3.944   0.732
  259    H    ASP  33           HN       ASP  33 -11.815  -2.836   5.708
  260    HA   ASP  33           HA       ASP  33 -13.265  -0.407   4.901
  261   1HB   ASP  33          HB2       ASP  33 -15.102  -1.353   6.241
  262   2HB   ASP  33          HB1       ASP  33 -14.455  -2.552   5.121
  263    H    LYS  34           HN       LYS  34 -11.200  -1.333   7.524
  264    HA   LYS  34           HA       LYS  34 -11.941   1.205   8.923
  265   1HB   LYS  34          HB2       LYS  34 -11.601   0.107  11.087
  266   2HB   LYS  34          HB1       LYS  34 -12.884  -0.700  10.188
  267   1HG   LYS  34          HG2       LYS  34 -11.241  -2.406   9.425
  268   2HG   LYS  34          HG1       LYS  34 -10.004  -1.623  10.413
  269   1HD   LYS  34          HD2       LYS  34 -11.650  -1.923  12.383
  270   2HD   LYS  34          HD1       LYS  34 -12.504  -3.049  11.329
  271   1HE   LYS  34          HE2       LYS  34 -10.482  -4.400  11.082
  272   2HE   LYS  34          HE1       LYS  34  -9.568  -3.246  12.053
  273   1HZ   LYS  34          HZ1       LYS  34 -10.554  -5.343  13.163
  274   2HZ   LYS  34          HZ2       LYS  34 -12.012  -4.471  13.144
  275   3HZ   LYS  34          HZ3       LYS  34 -10.661  -3.853  13.968
  276    H    MET  35           HN       MET  35  -9.658  -0.080   7.096
  277    HA   MET  35           HA       MET  35  -7.325   0.299   8.835
  278   1HB   MET  35          HB2       MET  35  -7.791  -1.071   6.457
  279   2HB   MET  35          HB1       MET  35  -6.765   0.251   5.935
  280   1HG   MET  35          HG2       MET  35  -5.255  -0.393   7.913
  281   2HG   MET  35          HG1       MET  35  -6.191  -1.883   7.981
  282   1HE   MET  35          HE1       MET  35  -4.846  -3.806   7.212
  283   2HE   MET  35          HE2       MET  35  -4.753  -4.102   5.477
  284   3HE   MET  35          HE3       MET  35  -6.297  -3.678   6.210
  285    H    CYS  36           HN       CYS  36  -8.817   2.188   6.090
  286    HA   CYS  36           HA       CYS  36  -6.801   4.222   6.293
  287   1HB   CYS  36          HB2       CYS  36  -9.693   4.613   5.437
  288   2HB   CYS  36          HB1       CYS  36  -8.354   5.702   5.097
  289    H    SER  37           HN       SER  37  -8.976   3.113   8.494
  290    HA   SER  37           HA       SER  37  -9.726   5.679   9.702
  291   1HB   SER  37          HB2       SER  37  -9.828   3.000  11.085
  292   2HB   SER  37          HB1       SER  37 -10.856   4.405  11.344
  293    HG   SER  37           HG       SER  37 -11.580   4.084   9.144
  294    H    LYS  38           HN       LYS  38  -6.834   3.912   9.703
  295    HA   LYS  38           HA       LYS  38  -6.088   4.771  12.460
  296   1HB   LYS  38          HB2       LYS  38  -4.888   2.875  10.447
  297   2HB   LYS  38          HB1       LYS  38  -3.896   3.508  11.760
  298   1HG   LYS  38          HG2       LYS  38  -4.907   1.372  12.415
  299   2HG   LYS  38          HG1       LYS  38  -5.566   2.682  13.396
  300   1HD   LYS  38          HD2       LYS  38  -7.605   2.717  12.170
  301   2HD   LYS  38          HD1       LYS  38  -6.928   1.735  10.870
  302   1HE   LYS  38          HE2       LYS  38  -8.458   0.501  12.488
  303   2HE   LYS  38          HE1       LYS  38  -6.864  -0.217  12.255
  304   1HZ   LYS  38          HZ1       LYS  38  -7.689   1.541  14.502
  305   2HZ   LYS  38          HZ2       LYS  38  -6.117   0.943  14.261
  306   3HZ   LYS  38          HZ3       LYS  38  -7.395  -0.128  14.588
  307    H    LEU  39           HN       LEU  39  -6.366   6.552   9.925
  308    HA   LEU  39           HA       LEU  39  -3.697   7.902  10.207
  309   1HB   LEU  39          HB2       LEU  39  -5.467   7.799   7.745
  310   2HB   LEU  39          HB1       LEU  39  -3.924   8.632   7.852
  311    HG   LEU  39           HG       LEU  39  -4.304   5.647   8.204
  312   1HD1  LEU  39          HD11      LEU  39  -3.480   5.387   5.995
  313   2HD1  LEU  39          HD12      LEU  39  -2.969   7.069   5.907
  314   3HD1  LEU  39          HD13      LEU  39  -4.685   6.669   5.876
  315   1HD2  LEU  39          HD21      LEU  39  -1.735   5.778   7.809
  316   2HD2  LEU  39          HD22      LEU  39  -2.334   6.236   9.398
  317   3HD2  LEU  39          HD23      LEU  39  -1.899   7.478   8.228
  318    HA   PRO  40           HA       PRO  40  -6.023  11.381  11.694
  319   1HB   PRO  40          HB2       PRO  40  -4.532  13.221   9.921
  320   2HB   PRO  40          HB1       PRO  40  -4.560  13.159  11.691
  321   1HG   PRO  40          HG2       PRO  40  -2.458  12.237   9.993
  322   2HG   PRO  40          HG1       PRO  40  -2.586  11.996  11.741
  323   1HD   PRO  40          HD2       PRO  40  -2.850  10.009   9.683
  324   2HD   PRO  40          HD1       PRO  40  -3.021   9.772  11.427
  325    H    LYS  41           HN       LYS  41  -7.691  12.962  10.825
  326    HA   LYS  41           HA       LYS  41  -9.088  11.856   8.562
  327   1HB   LYS  41          HB2       LYS  41 -10.061  13.254  10.486
  328   2HB   LYS  41          HB1       LYS  41  -9.450  14.659   9.612
  329   1HG   LYS  41          HG2       LYS  41 -10.780  14.090   7.657
  330   2HG   LYS  41          HG1       LYS  41 -11.303  12.582   8.405
  331   1HD   LYS  41          HD2       LYS  41 -12.371  13.915  10.232
  332   2HD   LYS  41          HD1       LYS  41 -11.945  15.387   9.356
  333   1HE   LYS  41          HE2       LYS  41 -13.719  13.148   8.337
  334   2HE   LYS  41          HE1       LYS  41 -14.249  14.758   8.823
  335   1HZ   LYS  41          HZ1       LYS  41 -12.504  14.049   6.533
  336   2HZ   LYS  41          HZ2       LYS  41 -12.728  15.643   7.076
  337   3HZ   LYS  41          HZ3       LYS  41 -14.046  14.753   6.478
  338    H    SER  42           HN       SER  42  -6.479  14.102   8.668
  339    HA   SER  42           HA       SER  42  -7.227  15.503   6.275
  340   1HB   SER  42          HB2       SER  42  -4.929  16.383   6.282
  341   2HB   SER  42          HB1       SER  42  -5.604  16.436   7.908
  342    HG   SER  42           HG       SER  42  -3.795  14.551   6.804
  343    H    LEU  43           HN       LEU  43  -5.998  12.373   6.619
  344    HA   LEU  43           HA       LEU  43  -5.238  12.349   3.702
  345   1HB   LEU  43          HB2       LEU  43  -4.462  10.227   5.703
  346   2HB   LEU  43          HB1       LEU  43  -3.793  10.509   4.100
  347    HG   LEU  43           HG       LEU  43  -3.480  12.268   6.522
  348   1HD1  LEU  43          HD11      LEU  43  -1.018  11.730   6.042
  349   2HD1  LEU  43          HD12      LEU  43  -1.638  10.427   5.028
  350   3HD1  LEU  43          HD13      LEU  43  -2.006  10.457   6.753
  351   1HD2  LEU  43          HD21      LEU  43  -2.611  12.636   3.652
  352   2HD2  LEU  43          HD22      LEU  43  -1.878  13.524   4.985
  353   3HD2  LEU  43          HD23      LEU  43  -3.587  13.736   4.622
  354    H    SER  44           HN       SER  44  -7.710  11.582   5.801
  355    HA   SER  44           HA       SER  44  -8.627   9.048   5.462
  356   1HB   SER  44          HB2       SER  44 -10.110  10.605   6.496
  357   2HB   SER  44          HB1       SER  44 -10.155  11.630   5.065
  358    HG   SER  44           HG       SER  44 -11.082   8.947   5.139
  359    H    GLU  45           HN       GLU  45  -9.644  11.454   3.123
  360    HA   GLU  45           HA       GLU  45 -10.724   9.870   1.215
  361   1HB   GLU  45          HB2       GLU  45  -9.256  12.475   0.830
  362   2HB   GLU  45          HB1       GLU  45 -10.446  11.792  -0.280
  363   1HG   GLU  45          HG2       GLU  45 -12.153  11.844   1.509
  364   2HG   GLU  45          HG1       GLU  45 -10.967  12.543   2.613
  365    H    GLU  46           HN       GLU  46  -7.402  11.113   0.946
  366    HA   GLU  46           HA       GLU  46  -6.838   9.976  -1.576
  367   1HB   GLU  46          HB2       GLU  46  -4.658  10.023   0.474
  368   2HB   GLU  46          HB1       GLU  46  -4.654  10.633  -1.176
  369   1HG   GLU  46          HG2       GLU  46  -5.884  11.929   1.267
  370   2HG   GLU  46          HG1       GLU  46  -4.594  12.554   0.249
  371    H    CYS  47           HN       CYS  47  -7.151   8.467   1.542
  372    HA   CYS  47           HA       CYS  47  -5.749   6.026   0.726
  373   1HB   CYS  47          HB2       CYS  47  -5.945   6.739   3.128
  374   2HB   CYS  47          HB1       CYS  47  -7.677   6.474   3.037
  375    H    GLN  48           HN       GLN  48  -9.125   7.094   1.037
  376    HA   GLN  48           HA       GLN  48 -10.351   4.660   0.324
  377   1HB   GLN  48          HB2       GLN  48 -11.345   7.056   0.957
  378   2HB   GLN  48          HB1       GLN  48 -11.464   7.229  -0.792
  379   1HG   GLN  48          HG2       GLN  48 -12.635   4.941   0.825
  380   2HG   GLN  48          HG1       GLN  48 -13.549   6.303   0.179
  381   1HE2  GLN  48          HE21      GLN  48 -12.001   6.408  -2.359
  382   2HE2  GLN  48          HE22      GLN  48 -12.492   5.057  -3.264
  383    H    GLU  49           HN       GLU  49  -9.102   7.246  -1.826
  384    HA   GLU  49           HA       GLU  49  -9.870   5.923  -4.250
  385   1HB   GLU  49          HB2       GLU  49  -7.808   8.055  -3.652
  386   2HB   GLU  49          HB1       GLU  49  -8.166   7.494  -5.285
  387   1HG   GLU  49          HG2       GLU  49 -10.457   8.210  -5.113
  388   2HG   GLU  49          HG1       GLU  49 -10.281   8.543  -3.390
  389    H    VAL  50           HN       VAL  50  -6.786   5.924  -2.406
  390    HA   VAL  50           HA       VAL  50  -5.392   4.337  -4.352
  391    HB   VAL  50           HB       VAL  50  -4.855   4.451  -1.375
  392   1HG1  VAL  50          HG11      VAL  50  -3.734   2.597  -2.480
  393   2HG1  VAL  50          HG12      VAL  50  -2.558   3.840  -2.063
  394   3HG1  VAL  50          HG13      VAL  50  -3.118   3.683  -3.728
  395   1HG2  VAL  50          HG21      VAL  50  -3.645   6.417  -1.682
  396   2HG2  VAL  50          HG22      VAL  50  -4.862   6.660  -2.933
  397   3HG2  VAL  50          HG23      VAL  50  -3.273   6.048  -3.366
  398    H    VAL  51           HN       VAL  51  -7.014   3.496  -1.279
  399    HA   VAL  51           HA       VAL  51  -6.584   0.720  -1.574
  400    HB   VAL  51           HB       VAL  51  -8.793   2.181  -0.079
  401   1HG1  VAL  51          HG11      VAL  51  -7.669  -0.598   0.295
  402   2HG1  VAL  51          HG12      VAL  51  -9.267  -0.221  -0.350
  403   3HG1  VAL  51          HG13      VAL  51  -8.876   0.169   1.323
  404   1HG2  VAL  51          HG21      VAL  51  -7.312   2.112   1.826
  405   2HG2  VAL  51          HG22      VAL  51  -6.416   2.815   0.481
  406   3HG2  VAL  51          HG23      VAL  51  -6.143   1.137   0.940
  407    H    ASP  52           HN       ASP  52  -9.466   2.618  -2.398
  408    HA   ASP  52           HA       ASP  52 -10.981   0.456  -3.431
  409   1HB   ASP  52          HB2       ASP  52 -11.938   2.627  -2.819
  410   2HB   ASP  52          HB1       ASP  52 -11.117   3.383  -4.183
  411    H    THR  53           HN       THR  53  -8.831   2.736  -5.149
  412    HA   THR  53           HA       THR  53  -9.377   1.407  -7.716
  413    HB   THR  53           HB       THR  53  -7.415   3.598  -7.012
  414    HG1  THR  53           HG1      THR  53  -9.433   4.370  -6.668
  415   1HG2  THR  53          HG21      THR  53  -7.549   4.040  -9.476
  416   2HG2  THR  53          HG22      THR  53  -8.475   2.548  -9.648
  417   3HG2  THR  53          HG23      THR  53  -6.805   2.490  -9.081
  418    H    TYR  54           HN       TYR  54  -6.646   1.631  -5.431
  419    HA   TYR  54           HA       TYR  54  -5.241  -0.421  -7.113
  420   1HB   TYR  54          HB2       TYR  54  -4.174   1.566  -5.119
  421   2HB   TYR  54          HB1       TYR  54  -3.198   0.342  -5.926
  422    HD1  TYR  54           HD1      TYR  54  -2.646   0.532  -8.295
  423    HD2  TYR  54           HD2      TYR  54  -5.186   3.401  -6.385
  424    HE1  TYR  54           HE1      TYR  54  -2.420   2.040 -10.252
  425    HE2  TYR  54           HE2      TYR  54  -4.968   4.914  -8.319
  426    HH   TYR  54           HH       TYR  54  -3.626   3.883 -11.300
  427    H    GLY  55           HN       GLY  55  -7.313  -1.076  -5.117
  428   1HA   GLY  55          HA2       GLY  55  -5.895  -2.136  -2.802
  429   2HA   GLY  55          HA1       GLY  55  -7.604  -2.354  -3.151
  430    H    SER  56           HN       SER  56  -7.785  -3.789  -5.419
  431    HA   SER  56           HA       SER  56  -6.864  -6.348  -4.574
  432   1HB   SER  56          HB2       SER  56  -7.485  -6.088  -7.458
  433   2HB   SER  56          HB1       SER  56  -8.159  -7.178  -6.243
  434    HG   SER  56           HG       SER  56  -9.581  -5.466  -7.102
  435    H    SER  57           HN       SER  57  -5.506  -3.929  -6.675
  436    HA   SER  57           HA       SER  57  -3.639  -5.755  -7.903
  437   1HB   SER  57          HB2       SER  57  -2.611  -3.765  -8.917
  438   2HB   SER  57          HB1       SER  57  -4.365  -3.638  -9.021
  439    HG   SER  57           HG       SER  57  -4.239  -2.383  -7.056
  440    H    ILE  58           HN       ILE  58  -3.240  -3.297  -5.324
  441    HA   ILE  58           HA       ILE  58  -0.466  -3.753  -4.827
  442    HB   ILE  58           HB       ILE  58  -2.772  -3.032  -2.996
  443   1HG1  ILE  58          HG12      ILE  58  -0.378  -1.450  -3.998
  444   2HG1  ILE  58          HG11      ILE  58  -1.982  -1.371  -4.714
  445   1HG2  ILE  58          HG21      ILE  58   0.160  -3.464  -2.388
  446   2HG2  ILE  58          HG22      ILE  58  -1.236  -4.121  -1.539
  447   3HG2  ILE  58          HG23      ILE  58  -0.838  -2.411  -1.386
  448   1HD1  ILE  58          HD11      ILE  58  -2.660  -0.837  -2.157
  449   2HD1  ILE  58          HD12      ILE  58  -2.149   0.433  -3.268
  450   3HD1  ILE  58          HD13      ILE  58  -0.994  -0.258  -2.126
  451    H    LEU  59           HN       LEU  59  -3.357  -5.324  -3.601
  452    HA   LEU  59           HA       LEU  59  -2.078  -7.308  -1.986
  453   1HB   LEU  59          HB2       LEU  59  -4.758  -6.608  -2.880
  454   2HB   LEU  59          HB1       LEU  59  -4.558  -8.342  -3.023
  455    HG   LEU  59           HG       LEU  59  -5.506  -7.755  -0.877
  456   1HD1  LEU  59          HD11      LEU  59  -2.704  -8.504  -0.109
  457   2HD1  LEU  59          HD12      LEU  59  -3.564  -9.561  -1.228
  458   3HD1  LEU  59          HD13      LEU  59  -4.238  -9.230   0.364
  459   1HD2  LEU  59          HD21      LEU  59  -2.966  -6.334  -0.089
  460   2HD2  LEU  59          HD22      LEU  59  -4.566  -6.241   0.642
  461   3HD2  LEU  59          HD23      LEU  59  -4.258  -5.451  -0.905
  462    H    SER  60           HN       SER  60  -2.626  -7.242  -5.483
  463    HA   SER  60           HA       SER  60  -2.279 -10.094  -5.579
  464   1HB   SER  60          HB2       SER  60  -3.558  -9.310  -7.365
  465   2HB   SER  60          HB1       SER  60  -2.504  -7.922  -7.628
  466    HG   SER  60           HG       SER  60  -2.282  -9.598  -9.225
  467    H    ILE  61           HN       ILE  61  -0.250  -7.276  -6.047
  468    HA   ILE  61           HA       ILE  61   2.038  -8.617  -7.175
  469    HB   ILE  61           HB       ILE  61   2.025  -6.043  -5.586
  470   1HG1  ILE  61          HG12      ILE  61   0.728  -6.715  -8.175
  471   2HG1  ILE  61          HG11      ILE  61   0.481  -5.334  -7.121
  472   1HG2  ILE  61          HG21      ILE  61   4.215  -7.074  -6.203
  473   2HG2  ILE  61          HG22      ILE  61   3.964  -5.491  -6.927
  474   3HG2  ILE  61          HG23      ILE  61   3.759  -6.950  -7.901
  475   1HD1  ILE  61          HD11      ILE  61   1.320  -4.547  -9.243
  476   2HD1  ILE  61          HD12      ILE  61   2.695  -5.642  -9.160
  477   3HD1  ILE  61          HD13      ILE  61   2.563  -4.302  -8.018
  478    H    LEU  62           HN       LEU  62   1.226  -7.602  -3.857
  479    HA   LEU  62           HA       LEU  62   3.633  -8.277  -2.605
  480   1HB   LEU  62          HB2       LEU  62   0.767  -8.083  -1.764
  481   2HB   LEU  62          HB1       LEU  62   1.861  -8.873  -0.634
  482    HG   LEU  62           HG       LEU  62   2.816  -6.278  -1.805
  483   1HD1  LEU  62          HD11      LEU  62   0.622  -5.529  -1.397
  484   2HD1  LEU  62          HD12      LEU  62   1.503  -5.084   0.064
  485   3HD1  LEU  62          HD13      LEU  62   0.466  -6.508   0.054
  486   1HD2  LEU  62          HD21      LEU  62   3.566  -5.980   0.556
  487   2HD2  LEU  62          HD22      LEU  62   4.180  -7.467  -0.162
  488   3HD2  LEU  62          HD23      LEU  62   2.827  -7.521   0.966
  489    H    LEU  63           HN       LEU  63   0.896 -10.353  -3.494
  490    HA   LEU  63           HA       LEU  63   1.958 -12.726  -2.188
  491   1HB   LEU  63          HB2       LEU  63  -0.068 -12.500  -4.439
  492   2HB   LEU  63          HB1       LEU  63   0.194 -13.908  -3.405
  493    HG   LEU  63           HG       LEU  63  -0.758 -11.179  -2.493
  494   1HD1  LEU  63          HD11      LEU  63  -2.900 -12.133  -2.227
  495   2HD1  LEU  63          HD12      LEU  63  -2.277 -13.780  -2.312
  496   3HD1  LEU  63          HD13      LEU  63  -2.350 -12.788  -3.768
  497   1HD2  LEU  63          HD21      LEU  63   0.077 -13.660  -1.006
  498   2HD2  LEU  63          HD22      LEU  63  -1.184 -12.629  -0.330
  499   3HD2  LEU  63          HD23      LEU  63   0.422 -11.970  -0.636
  500    H    GLU  64           HN       GLU  64   2.740 -11.087  -5.078
  501    HA   GLU  64           HA       GLU  64   3.805 -13.510  -6.353
  502   1HB   GLU  64          HB2       GLU  64   2.755 -11.473  -7.563
  503   2HB   GLU  64          HB1       GLU  64   4.280 -10.660  -7.248
  504   1HG   GLU  64          HG2       GLU  64   4.433 -11.632  -9.440
  505   2HG   GLU  64          HG1       GLU  64   5.439 -12.613  -8.377
  506    H    GLU  65           HN       GLU  65   4.744 -12.720  -3.767
  507    HA   GLU  65           HA       GLU  65   6.786 -12.540  -2.561
  508   1HB   GLU  65          HB2       GLU  65   7.604 -13.867  -5.136
  509   2HB   GLU  65          HB1       GLU  65   8.640 -13.752  -3.714
  510   1HG   GLU  65          HG2       GLU  65   6.982 -14.952  -2.372
  511   2HG   GLU  65          HG1       GLU  65   5.885 -15.018  -3.753
  512    H    VAL  66           HN       VAL  66   6.149 -10.159  -4.310
  513    HA   VAL  66           HA       VAL  66   8.845  -9.286  -5.229
  514    HB   VAL  66           HB       VAL  66   6.023  -8.346  -5.581
  515   1HG1  VAL  66          HG11      VAL  66   6.949  -6.272  -4.838
  516   2HG1  VAL  66          HG12      VAL  66   6.984  -6.201  -6.600
  517   3HG1  VAL  66          HG13      VAL  66   8.460  -6.560  -5.702
  518   1HG2  VAL  66          HG21      VAL  66   7.391  -9.781  -7.210
  519   2HG2  VAL  66          HG22      VAL  66   8.338  -8.329  -7.525
  520   3HG2  VAL  66          HG23      VAL  66   6.615  -8.350  -7.893
  521    H    SER  67           HN       SER  67   9.959  -7.546  -4.176
  522    HA   SER  67           HA       SER  67   9.723  -7.331  -1.393
  523   1HB   SER  67          HB2       SER  67  10.761  -4.974  -2.943
  524   2HB   SER  67          HB1       SER  67  11.406  -5.717  -1.482
  525    HG   SER  67           HG       SER  67  11.287  -7.124  -3.926
  526    HA   PRO  68           HA       PRO  68   6.197  -4.717  -0.819
  527   1HB   PRO  68          HB2       PRO  68   7.137  -3.282   1.477
  528   2HB   PRO  68          HB1       PRO  68   6.172  -4.752   1.472
  529   1HG   PRO  68          HG2       PRO  68   9.009  -4.451   2.117
  530   2HG   PRO  68          HG1       PRO  68   7.955  -5.851   2.375
  531   1HD   PRO  68          HD2       PRO  68   9.992  -5.602   0.383
  532   2HD   PRO  68          HD1       PRO  68   8.784  -6.897   0.533
  533    H    GLU  69           HN       GLU  69   9.361  -3.059  -0.551
  534    HA   GLU  69           HA       GLU  69   8.242  -0.434  -1.034
  535   1HB   GLU  69          HB2       GLU  69  10.315  -0.525   0.115
  536   2HB   GLU  69          HB1       GLU  69  11.039  -1.573  -1.101
  537   1HG   GLU  69          HG2       GLU  69  11.226   0.181  -2.675
  538   2HG   GLU  69          HG1       GLU  69  10.081   1.202  -1.806
  539    H    LEU  70           HN       LEU  70   9.134  -3.054  -3.090
  540    HA   LEU  70           HA       LEU  70   9.546  -1.397  -5.440
  541   1HB   LEU  70          HB2       LEU  70   9.074  -4.368  -5.082
  542   2HB   LEU  70          HB1       LEU  70   9.236  -3.651  -6.671
  543    HG   LEU  70           HG       LEU  70  11.288  -3.309  -4.509
  544   1HD1  LEU  70          HD11      LEU  70  10.941  -5.728  -5.203
  545   2HD1  LEU  70          HD12      LEU  70  12.566  -5.101  -5.471
  546   3HD1  LEU  70          HD13      LEU  70  11.445  -5.246  -6.822
  547   1HD2  LEU  70          HD21      LEU  70  12.721  -2.953  -6.692
  548   2HD2  LEU  70          HD22      LEU  70  11.736  -1.635  -6.072
  549   3HD2  LEU  70          HD23      LEU  70  11.158  -2.606  -7.422
  550    H    VAL  71           HN       VAL  71   6.850  -2.415  -3.669
  551    HA   VAL  71           HA       VAL  71   4.937  -2.544  -5.796
  552    HB   VAL  71           HB       VAL  71   4.711  -2.121  -2.813
  553   1HG1  VAL  71          HG11      VAL  71   2.512  -1.675  -4.824
  554   2HG1  VAL  71          HG12      VAL  71   2.902  -0.720  -3.393
  555   3HG1  VAL  71          HG13      VAL  71   2.135  -2.294  -3.216
  556   1HG2  VAL  71          HG21      VAL  71   5.027  -4.394  -3.619
  557   2HG2  VAL  71          HG22      VAL  71   3.676  -4.216  -4.739
  558   3HG2  VAL  71          HG23      VAL  71   3.384  -4.227  -2.999
  559    H    CYS  72           HN       CYS  72   5.559   0.247  -3.552
  560    HA   CYS  72           HA       CYS  72   3.777   1.850  -5.054
  561   1HB   CYS  72          HB2       CYS  72   6.131   2.880  -3.420
  562   2HB   CYS  72          HB1       CYS  72   4.666   3.767  -3.812
  563    H    SER  73           HN       SER  73   7.149   1.051  -5.546
  564    HA   SER  73           HA       SER  73   7.616   3.184  -7.512
  565   1HB   SER  73          HB2       SER  73   9.381   1.819  -6.146
  566   2HB   SER  73          HB1       SER  73   9.219   0.642  -7.446
  567    HG   SER  73           HG       SER  73  10.085   3.327  -7.551
  568    H    MET  74           HN       MET  74   6.598  -0.220  -7.809
  569    HA   MET  74           HA       MET  74   6.730  -0.186 -10.741
  570   1HB   MET  74          HB2       MET  74   5.854  -2.088  -8.633
  571   2HB   MET  74          HB1       MET  74   5.005  -2.237 -10.168
  572   1HG   MET  74          HG2       MET  74   7.384  -2.253 -11.231
  573   2HG   MET  74          HG1       MET  74   7.940  -2.604  -9.601
  574   1HE   MET  74          HE1       MET  74   5.654  -5.736  -8.776
  575   2HE   MET  74          HE2       MET  74   4.840  -4.182  -8.937
  576   3HE   MET  74          HE3       MET  74   6.401  -4.273  -8.124
  577    H    LEU  75           HN       LEU  75   4.055   0.328  -8.398
  578    HA   LEU  75           HA       LEU  75   2.087   0.494 -10.520
  579   1HB   LEU  75          HB2       LEU  75   1.897   1.628  -7.720
  580   2HB   LEU  75          HB1       LEU  75   0.556   1.286  -8.810
  581    HG   LEU  75           HG       LEU  75   2.425  -0.722  -7.527
  582   1HD1  LEU  75          HD11      LEU  75   0.721  -0.089  -6.001
  583   2HD1  LEU  75          HD12      LEU  75   0.190  -1.617  -6.701
  584   3HD1  LEU  75          HD13      LEU  75  -0.512  -0.102  -7.262
  585   1HD2  LEU  75          HD21      LEU  75   0.457  -1.006  -9.792
  586   2HD2  LEU  75          HD22      LEU  75   0.765  -2.362  -8.709
  587   3HD2  LEU  75          HD23      LEU  75   2.084  -1.673  -9.651
  588    H    HIS  76           HN       HIS  76   4.573   2.332 -10.450
  589    HA   HIS  76           HA       HIS  76   5.088   4.567 -10.947
  590   1HB   HIS  76          HB2       HIS  76   3.852   5.490 -12.776
  591   2HB   HIS  76          HB1       HIS  76   3.845   3.743 -13.003
  592    HD1  HIS  76           HD1      HIS  76   1.616   6.402 -11.407
  593    HD2  HIS  76           HD2      HIS  76   1.305   2.724 -13.344
  594    HE1  HIS  76           HE1      HIS  76  -0.860   5.928 -11.651
  595    H    LEU  77           HN       LEU  77   3.202   4.008  -8.518
  596    HA   LEU  77           HA       LEU  77   1.668   6.510  -8.394
  597   1HB   LEU  77          HB2       LEU  77   2.229   4.333  -6.367
  598   2HB   LEU  77          HB1       LEU  77   1.344   5.780  -5.954
  599    HG   LEU  77           HG       LEU  77   0.546   3.564  -7.826
  600   1HD1  LEU  77          HD11      LEU  77  -1.453   3.532  -6.372
  601   2HD1  LEU  77          HD12      LEU  77  -0.796   4.883  -5.454
  602   3HD1  LEU  77          HD13      LEU  77   0.025   3.327  -5.431
  603   1HD2  LEU  77          HD21      LEU  77  -0.519   6.391  -7.701
  604   2HD2  LEU  77          HD22      LEU  77  -1.590   5.059  -8.130
  605   3HD2  LEU  77          HD23      LEU  77  -0.183   5.406  -9.127
  606    H    CYS  78           HN       CYS  78   4.870   5.588  -7.878
  607    HA   CYS  78           HA       CYS  78   5.375   8.141  -6.394
  608   1HB   CYS  78          HB2       CYS  78   6.538   5.402  -5.902
  609   2HB   CYS  78          HB1       CYS  78   7.343   6.868  -5.350
  610    H    SER  79           HN       SER  79   7.394   9.157  -6.939
  611    HA   SER  79           HA       SER  79   8.128   9.022  -9.676
  612   1HB   SER  79          HB2       SER  79  10.037  10.437  -9.048
  613   2HB   SER  79          HB1       SER  79   8.579  10.977  -8.222
  614    HG   SER  79           HG       SER  79  10.750   9.468  -7.213
  615    H    GLY  80           HN       GLY  80   9.296   7.236  -6.892
  616   1HA   GLY  80          HA2       GLY  80  10.707   5.360  -6.795
  617   2HA   GLY  80          HA1       GLY  80  10.563   5.253  -8.550
  618    H    LEU  81           HN       LEU  81  12.977   4.654  -8.068
  619    HA   LEU  81           HA       LEU  81  14.750   6.904  -7.503
  620   1HB   LEU  81          HB2       LEU  81  15.568   4.284  -8.769
  621   2HB   LEU  81          HB1       LEU  81  16.530   5.351  -7.747
  622    HG   LEU  81           HG       LEU  81  14.122   3.728  -6.873
  623   1HD1  LEU  81          HD11      LEU  81  17.081   3.531  -6.233
  624   2HD1  LEU  81          HD12      LEU  81  16.130   2.369  -7.161
  625   3HD1  LEU  81          HD13      LEU  81  15.818   2.589  -5.440
  626   1HD2  LEU  81          HD21      LEU  81  14.074   5.735  -5.594
  627   2HD2  LEU  81          HD22      LEU  81  15.832   5.790  -5.467
  628   3HD2  LEU  81          HD23      LEU  81  14.920   4.574  -4.573
  629    H    VAL  82           HN       VAL  82  12.822   6.794  -9.924
  630    HA   VAL  82           HA       VAL  82  14.846   7.371 -12.071
  631    HB   VAL  82           HB       VAL  82  11.939   6.748 -12.474
  632   1HG1  VAL  82          HG11      VAL  82  14.375   6.597 -14.267
  633   2HG1  VAL  82          HG12      VAL  82  13.113   7.828 -14.342
  634   3HG1  VAL  82          HG13      VAL  82  12.736   6.151 -14.740
  635   1HG2  VAL  82          HG21      VAL  82  12.913   4.845 -11.306
  636   2HG2  VAL  82          HG22      VAL  82  14.307   4.861 -12.388
  637   3HG2  VAL  82          HG23      VAL  82  12.714   4.428 -13.009
  638    HA   PRO  83           HA       PRO  83  12.907  11.431 -11.013
  639   1HB   PRO  83          HB2       PRO  83  15.169  12.789 -12.197
  640   2HB   PRO  83          HB1       PRO  83  14.783  12.635 -10.479
  641   1HG   PRO  83          HG2       PRO  83  16.925  11.336 -11.899
  642   2HG   PRO  83          HG1       PRO  83  16.485  11.127 -10.198
  643   1HD   PRO  83          HD2       PRO  83  16.018   9.293 -12.433
  644   2HD   PRO  83          HD1       PRO  83  15.769   9.003 -10.699
  645    H    ARG  84           HN       ARG  84  12.221   9.838 -13.295
  646    HA   ARG  84           HA       ARG  84  11.381  10.055 -15.476
  647   1HB   ARG  84          HB2       ARG  84  10.146  11.897 -14.249
  648   2HB   ARG  84          HB1       ARG  84  11.372  13.017 -14.843
  649   1HG   ARG  84          HG2       ARG  84  10.832  12.319 -17.175
  650   2HG   ARG  84          HG1       ARG  84   9.538  11.301 -16.540
  651   1HD   ARG  84          HD2       ARG  84   8.653  13.480 -17.284
  652   2HD   ARG  84          HD1       ARG  84   8.464  13.286 -15.542
  653    HE   ARG  84           HE       ARG  84  10.898  14.585 -15.801
  654   1HH1  ARG  84          HH21      ARG  84   7.672  15.064 -16.921
  655   2HH1  ARG  84          HH22      ARG  84   7.797  16.791 -16.947
  656   1HH2  ARG  84          HH11      ARG  84  11.078  16.837 -15.828
  657   2HH2  ARG  84          HH12      ARG  84   9.725  17.796 -16.329
  Start of MODEL   18
    1   1H    SER   1          HT1       SER   1   6.149  17.680  -1.557
    2   2H    SER   1          HT2       SER   1   6.251  15.998  -1.774
    3   3H    SER   1          HT3       SER   1   7.240  16.771  -0.629
    4    HA   SER   1           HA       SER   1   5.671  16.024   0.794
    5   1HB   SER   1          HB2       SER   1   4.033  17.793   1.235
    6   2HB   SER   1          HB1       SER   1   5.586  18.511   0.817
    7    HG   SER   1           HG       SER   1   3.336  18.131  -0.876
    8    H    ASP   2           HN       ASP   2   5.326  14.729  -1.775
    9    HA   ASP   2           HA       ASP   2   2.565  14.713  -2.573
   10   1HB   ASP   2          HB2       ASP   2   4.200  13.921  -4.128
   11   2HB   ASP   2          HB1       ASP   2   4.831  12.754  -2.970
   12    H    VAL   3           HN       VAL   3   1.017  14.192  -1.161
   13    HA   VAL   3           HA       VAL   3   1.340  12.471   1.120
   14    HB   VAL   3           HB       VAL   3  -0.851  13.002   1.628
   15   1HG1  VAL   3          HG11      VAL   3   0.593  15.041   1.089
   16   2HG1  VAL   3          HG12      VAL   3  -1.150  15.302   1.133
   17   3HG1  VAL   3          HG13      VAL   3  -0.319  15.160  -0.416
   18   1HG2  VAL   3          HG21      VAL   3  -2.542  13.659  -0.189
   19   2HG2  VAL   3          HG22      VAL   3  -2.078  11.959  -0.142
   20   3HG2  VAL   3          HG23      VAL   3  -1.379  13.028  -1.359
   21    H    TYR   4           HN       TYR   4   0.845  11.686  -2.249
   22    HA   TYR   4           HA       TYR   4  -0.763   9.373  -1.645
   23   1HB   TYR   4          HB2       TYR   4   0.502  10.510  -4.120
   24   2HB   TYR   4          HB1       TYR   4   0.064   8.813  -4.167
   25    HD1  TYR   4           HD1      TYR   4  -2.358   8.235  -3.287
   26    HD2  TYR   4           HD2      TYR   4  -1.125  12.101  -4.687
   27    HE1  TYR   4           HE1      TYR   4  -4.713   8.807  -3.771
   28    HE2  TYR   4           HE2      TYR   4  -3.488  12.685  -5.152
   29    HH   TYR   4           HH       TYR   4  -5.668  12.059  -4.656
   30    H    CYS   5           HN       CYS   5   2.653   9.735  -2.553
   31    HA   CYS   5           HA       CYS   5   3.362   6.967  -2.423
   32   1HB   CYS   5          HB2       CYS   5   4.916   9.508  -1.821
   33   2HB   CYS   5          HB1       CYS   5   5.651   7.912  -1.651
   34    H    GLU   6           HN       GLU   6   3.187   9.432   0.173
   35    HA   GLU   6           HA       GLU   6   4.163   7.844   2.286
   36   1HB   GLU   6          HB2       GLU   6   3.724  10.216   2.586
   37   2HB   GLU   6          HB1       GLU   6   2.000   9.968   2.308
   38   1HG   GLU   6          HG2       GLU   6   1.736   8.767   4.343
   39   2HG   GLU   6          HG1       GLU   6   3.477   8.564   4.539
   40    H    VAL   7           HN       VAL   7   0.826   8.029   1.021
   41    HA   VAL   7           HA       VAL   7  -0.148   6.167   3.029
   42    HB   VAL   7           HB       VAL   7  -1.355   7.087   0.397
   43   1HG1  VAL   7          HG11      VAL   7  -3.496   6.237   1.582
   44   2HG1  VAL   7          HG12      VAL   7  -2.397   5.304   2.596
   45   3HG1  V