*HEADER    VIRUS/VIRAL PROTEIN                     29-JAN-02   1KWD              
*TITLE     SOLUTION STRUCTURE OF THE CENTRAL CONSERVED REGION OF HUMAN           
*TITLE    2 RESPIRATORY SYNCYTIAL VIRUS ATTACHMENT GLYCOPROTEIN G 187            
*COMPND    MOL_ID: 1;                                                            
*COMPND   2 MOLECULE: MAJOR SURFACE GLYCOPROTEIN G;                              
*COMPND   3 CHAIN: A;                                                            
*COMPND   4 FRAGMENT: RESIDUES 172-187;                                          
*COMPND   5 SYNONYM: ATTACHMENT GLYCOPROTEIN G;                                  
*COMPND   6 ENGINEERED: YES                                                      
*SOURCE    MOL_ID: 1;                                                            
*SOURCE   2 SYNTHETIC: YES;                                                      
*SOURCE   3 OTHER_DETAILS: SYNTHESIS OF THE PEPTIDE WAS PERFORMED BY A           
*SOURCE   4 SOLID PHASE METHOD USING FMOC/TBU CHEMISTRY.                         
*KEYWDS    CYSTEINE NOSE                                                         
*EXPDTA    NMR, 16 STRUCTURES                                                    
*AUTHOR    M.SUGAWARA, J.CZAPLICKI, J.FERRAGE, J.F.HAEUW, U.F.POWER,             
*AUTHOR   2 N.CORVAIA, T.NGUYEN, A.BECK, A.MILON                                 
*REVDAT   1   17-JUN-03 1KWD    0                                                

!BIOSYM restraint 1
#NOE_distance
   
1:TRP_12:HZ2 1:TRP_12:HE1 1.80  3.29  3.29  5 5 1000
1:TRP_12:HD1 1:TRP_12:HE1 1.80  2.87  2.87  5 5 1000
1:SER_3:HN 1:CYS_2:HN 1.80  4.11  4.11  5 5 1000
1:TRP_12:HN 1:THR_10:HA 1.80  4.05  4.05  5 5 1000
1:LY+C_16:HN 1:CYS_15:HN 1.80  4.02  4.02  5 5 1000
1:ILE_4:HN 1:SER_3:HN 1.80  3.92  3.92  5 5 1000
1:CYS_11:HN 1:THR_10:HA 1.80  3.69  3.69  5 5 1000
1:SER_6:HN 1:ASN_7:HN 1.80  3.65  3.65  5 5 1000
1:CYS_2:HN 1:CYS_2:HA 1.80  3.62  3.62  5 5 1000
1:ASN_8:HN 1:ASN_7:HA 1.80  3.59  3.59  5 5 1000
1:CYS_5:HN 1:SER_6:HN 1.80  3.53  3.53  5 5 1000
1:ASN_8:HN 1:ASN_8:HA 1.80  3.48  3.48  5 5 1000
1:ILE_4:HN 1:CYS_5:HN 1.80  3.44  3.44  5 5 1000
1:CYS_15:HN 1:CYS_15:HA 1.80  3.36  3.36  5 5 1000
1:ASN_8:HN 1:ASN_7:HN 1.80  3.35  3.35  5 5 1000
1:SER_3:HN 1:SER_3:HA 1.80  3.35  3.35  5 5 1000
1:TRP_12:HN 1:TRP_12:HA 1.80  3.35  3.35  5 5 1000
1:TRP_12:HN 1:CYS_11:HN 1.80  3.34  3.34  5 5 1000
1:THR_10:HN 1:PRO_9:HA 1.80  3.33  3.33  5 5 1000
1:ASN_8:HD22 1:ASN_8:HD21 1.80  2.29  2.29  5 5 1000
1:ASN_7:HD22 1:ASN_7:HD21 1.80  2.32  2.32  5 5 1000
1:ILE_14:HN 1:ILE_14:HA 1.80  3.32  3.32  5 5 1000
1:PRO_9:HD* 1:ASN_8:HA 1.80  3.12  3.12  5 5 1000
1:CYS_11:HN 1:CYS_11:HA 1.80  3.29  3.29  5 5 1000
1:ALA_13:HN 1:TRP_12:HN 1.80  3.25  3.25  5 5 1000
1:LY+C_16:HN 1:LY+C_16:HA 1.80  3.24  3.24  5 5 1000
1:ALA_13:HN 1:ALA_13:HA 1.80  3.24  3.24  5 5 1000
1:ILE_14:HN 1:CYS_15:HN 1.80  3.24  3.24  5 5 1000
1:ALA_13:HN 1:TRP_12:HA 1.80  3.18  3.18  5 5 1000
1:ASN_7:HN 1:SER_6:HA 1.80  3.14  3.14  5 5 1000
1:CYS_2:HN 1:PROn_1:HA 1.80  3.09  3.09  5 5 1000
1:ILE_14:HN 1:ALA_13:HA 1.80  3.08  3.08  5 5 1000
1:ILE_4:HN 1:SER_3:HA 1.80  3.06  3.06  5 5 1000
1:SER_6:HN 1:SER_6:HA 1.80  3.05  3.05  5 5 1000
1:TRP_12:HN 1:CYS_11:HA 1.80  3.04  3.04  5 5 1000
1:ILE_14:HN 1:ALA_13:HN 1.80  3.02  3.02  5 5 1000
1:CYS_15:HN 1:ILE_14:HA 1.80  2.99  2.99  5 5 1000
1:THR_10:HN 1:CYS_11:HN 1.80  2.99  2.99  5 5 1000
1:CYS_11:HN 1:THR_10:HB 1.80  3.46  3.46  5 5 1000
1:ASN_7:HN 1:ASN_7:HA 1.80  2.98  2.98  5 5 1000
1:SER_6:HN 1:CYS_5:HA 1.80  2.97  2.97  5 5 1000
1:ILE_4:HN 1:SER_3:HB* 1.80  4.19  4.19  5 5 1000
1:SER_3:HN 1:SER_3:HB* 1.80  3.71  3.71  5 5 1000
1:ASN_7:HN 1:SER_6:HB* 1.80  3.84  3.84  5 5 1000
1:SER_6:HN 1:SER_6:HB* 1.80  3.91  3.91  5 5 1000
1:TRP_12:HN 1:TRP_12:HB* 1.80  3.89  3.89  5 5 1000
1:ALA_13:HN 1:TRP_12:HB* 1.80  4.61  4.61  5 5 1000
1:TRP_12:HE3 1:TRP_12:HB* 1.80  4.00  4.00  5 5 1000
1:LY+C_16:HN 1:CYS_15:HB* 1.80  4.31  4.31  5 5 1000
1:CYS_15:HN 1:CYS_15:HB* 1.80  3.95  3.95  5 5 1000
1:TRP_12:HN 1:CYS_11:HB* 1.80  4.02  4.02  5 5 1000
1:CYS_11:HN 1:CYS_11:HB* 1.80  3.69  3.69  5 5 1000
1:CYS_2:HN 1:CYS_2:HB* 1.80  4.04  4.04  5 5 1000
1:SER_3:HN 1:CYS_2:HB* 1.80  4.46  4.46  5 5 1000
1:ASN_8:HD21 1:ASN_8:HB* 1.80  4.00  4.00  5 5 1000
1:ASN_8:HN 1:PRO_9:HD* 1.80  3.51  3.51  5 5 1000
1:TRP_12:HE1 1:CYS_5:HB* 1.80  4.37  4.37  5 5 1000
1:CYS_5:HN 1:CYS_5:HB* 1.80  3.52  3.52  5 5 1000
1:SER_6:HN 1:CYS_5:HB* 1.80  3.89  3.89  5 5 1000
1:ASN_7:HN 1:ASN_7:HB* 1.80  3.88  3.88  5 5 1000
1:ASN_7:HD21 1:ASN_7:HB* 1.80  4.04  4.04  5 5 1000
1:PRO_9:HA 1:PRO_9:HG* 1.80  4.32  4.32  5 5 1000
1:CYS_15:HN 1:ILE_14:HB 1.80  4.15  4.15  5 5 1000
1:THR_10:HN 1:PRO_9:HB* 1.80  3.98  3.98  5 5 1000
1:ILE_4:HN 1:ILE_4:HB 1.80  3.21  3.21  5 5 1000
1:ILE_14:HN 1:ILE_14:HB 1.80  3.24  3.24  5 5 1000
1:THR_10:HN 1:THR_10:HG2* 1.80  4.86  4.86  5 5 1000
1:TRP_12:HD1 1:CYS_5:HB* 1.80  4.22  4.22  5 5 1000
1:SER_3:HN 1:CYS_2:HA 1.80  2.89  2.89  5 5 1000
1:CYS_5:HN 1:ILE_4:HA 1.80  2.74  2.74  5 5 1000
1:ASN_7:HD22 1:ASN_7:HB* 1.80  3.86  3.86  5 5 1000
1:TRP_12:HE3 1:ALA_13:HA 1.80  4.23  4.23  5 5 1000
1:CYS_2:HN 1:PROn_1:HG* 1.80  5.15  5.15  5 5 1000
1:CYS_5:HN 1:ILE_4:HB 1.80  4.15  4.15  5 5 1000
1:THR_10:HB 1:THR_10:HG2* 1.80  4.80  4.80  5 5 1000
1:LY+C_16:HN 1:CYS_15:HA 1.80  2.69  2.69  5 5 1000

#NMR_dihedral

1:PROn_1:CA 1:PROn_1:C 1:CYS_2:N 1:CYS_2:CA 180 180 50 50 1000
1:CYS_2:CA 1:CYS_2:C 1:SER_3:N 1:SER_3:CA 180 180 50 50 1000
1:SER_3:CA 1:SER_3:C 1:ILE_4:N 1:ILE_4:CA 180 180 50 50 1000
1:ILE_4:CA 1:ILE_4:C 1:CYS_5:N 1:CYS_5:CA 180 180 50 50 1000
1:CYS_5:CA 1:CYS_5:C 1:SER_6:N 1:SER_6:CA 180 180 50 50 1000
1:SER_6:CA 1:SER_6:C 1:ASN_7:N 1:ASN_7:CA 180 180 50 50 1000
1:ASN_7:CA 1:ASN_7:C 1:ASN_8:N 1:ASN_8:CA 180 180 50 50 1000
1:ASN_8:CA 1:ASN_8:C 1:PRO_9:N 1:PRO_9:CA 180 180 50 50 1000
1:PRO_9:CA 1:PRO_9:C 1:THR_10:N 1:THR_10:CA 180 180 50 50 1000
1:THR_10:CA 1:THR_10:C 1:CYS_11:N 1:CYS_11:CA 180 180 50 50 1000
1:CYS_11:CA 1:CYS_11:C 1:TRP_12:N 1:TRP_12:CA 180 180 50 50 1000
1:TRP_12:CA 1:TRP_12:C 1:ALA_13:N 1:ALA_13:CA 180 180 50 50 1000
1:ALA_13:CA 1:ALA_13:C 1:ILE_14:N 1:ILE_14:CA 180 180 50 50 1000
1:ILE_14:CA 1:ILE_14:C 1:CYS_15:N 1:CYS_15:CA 180 180 50 50 1000
1:CYS_15:CA 1:CYS_15:C 1:LY+C_16:N 1:LY+C_16:CA 180 180 50 50 1000
1:CYS_2:C 1:SER_3:N 1:SER_3:CA 1:SER_3:C -70 -50 50 50 1000
1:SER_3:C 1:ILE_4:N 1:ILE_4:CA 1:ILE_4:C -70 -50 50 50 1000
1:THR_10:C 1:CYS_11:N 1:CYS_11:CA 1:CYS_11:C -70 -50 50 50 1000
1:CYS_11:C 1:TRP_12:N 1:TRP_12:CA 1:TRP_12:C -70 -50 50 50 1000
1:TRP_12:C 1:ALA_13:N 1:ALA_13:CA 1:ALA_13:C -70 -50 50 50 1000

#chiral

1:PROn_1:CA S
1:ASN_7:CA S
1:SER_3:CA S
1:SER_6:CA S
1:LY+C_16:CA S
1:CYS_5:CA R
1:THR_10:CA S
1:ALA_13:CA S
1:ILE_14:CA S
1:CYS_11:CA R
1:CYS_2:CA R
1:CYS_15:CA R
1:TRP_12:CA S
1:ILE_4:CA S
1:PRO_9:CA S
1:ILE_4:CB S
1:THR_10:CB S
1:ILE_14:CB S
1:ASN_8:CA S


  Entry H atom name         Submitted Coord H atom name
  Start of MODEL    1
    1   1H    PRO 172          1H        PRO 172   9.140   4.308  -0.875
    2    HA   PRO 172           HA       PRO 172   7.615   6.683  -0.331
    3   1HB   PRO 172          2HB       PRO 172   8.011   5.945  -3.298
    4   2HB   PRO 172          1HB       PRO 172   7.440   7.477  -2.592
    5   1HG   PRO 172          1HG       PRO 172  10.046   7.248  -3.298
    6   2HG   PRO 172          2HG       PRO 172   9.653   8.003  -1.728
    7   1HD   PRO 172          2HD       PRO 172  10.614   5.157  -2.264
    8   2HD   PRO 172          1HD       PRO 172  11.080   6.255  -0.934
    9    H    CYS 173           H        CYS 173   5.580   5.983  -0.053
   10    HA   CYS 173           HA       CYS 173   4.806   3.109  -0.682
   11   1HB   CYS 173          1HB       CYS 173   3.473   5.172   1.159
   12   2HB   CYS 173          2HB       CYS 173   2.916   3.509   0.899
   13    H    SER 174           H        SER 174   3.395   2.757  -2.222
   14    HA   SER 174           HA       SER 174   2.405   4.723  -4.088
   15   1HB   SER 174          2HB       SER 174   3.011   2.374  -4.691
   16   2HB   SER 174          1HB       SER 174   1.634   1.764  -3.755
   17    HG   SER 174           HG       SER 174   1.530   3.557  -5.960
   18    H    ILE 175           H        ILE 175   0.524   5.606  -4.324
   19    HA   ILE 175           HA       ILE 175  -1.479   5.749  -2.171
   20    HB   ILE 175           HB       ILE 175  -0.784   7.752  -3.333
   21   1HG1  ILE 175          1HG1      ILE 175  -3.143   8.915  -3.560
   22   2HG1  ILE 175          2HG1      ILE 175  -3.820   7.327  -3.254
   23   1HG2  ILE 175          1HG2      ILE 175  -2.552   7.053  -5.743
   24   2HG2  ILE 175          2HG2      ILE 175  -1.631   8.563  -5.490
   25   3HG2  ILE 175          3HG2      ILE 175  -0.772   7.023  -5.720
   26   1HD1  ILE 175          1HD1      ILE 175  -3.802   8.799  -1.239
   27   2HD1  ILE 175          2HD1      ILE 175  -2.740   7.397  -0.943
   28   3HD1  ILE 175          3HD1      ILE 175  -2.031   8.984  -1.344
   29    H    CYS 176           H        CYS 176  -2.100   3.718  -2.055
   30    HA   CYS 176           HA       CYS 176  -3.799   2.329  -4.147
   31   1HB   CYS 176          1HB       CYS 176  -2.013   1.087  -2.859
   32   2HB   CYS 176          2HB       CYS 176  -2.995   1.302  -1.391
   33    H    SER 177           H        SER 177  -5.573   3.361  -4.165
   34    HA   SER 177           HA       SER 177  -7.151   4.449  -1.885
   35   1HB   SER 177          2HB       SER 177  -7.813   4.369  -4.860
   36   2HB   SER 177          1HB       SER 177  -8.767   5.200  -3.618
   37    HG   SER 177           HG       SER 177  -6.016   5.633  -4.182
   38    H    ASN 178           H        ASN 178  -7.974   2.982  -0.720
   39    HA   ASN 178           HA       ASN 178  -9.326   1.344   0.261
   40   1HB   ASN 178          2HB       ASN 178 -11.257   2.025  -1.974
   41   2HB   ASN 178          1HB       ASN 178 -11.669   0.950  -0.657
   42   1HD2  ASN 178          2HD2      ASN 178 -11.813   1.866   1.513
   43   2HD2  ASN 178          1HD2      ASN 178 -12.079   3.670   1.715
   44    H    ASN 179           H        ASN 179  -7.831  -0.254   0.038
   45    HA   ASN 179           HA       ASN 179  -8.721  -2.754  -1.131
   46   1HB   ASN 179          2HB       ASN 179  -6.252  -1.567  -2.495
   47   2HB   ASN 179          1HB       ASN 179  -6.502  -3.306  -2.392
   48   1HD2  ASN 179          1HD2      ASN 179  -8.189  -4.216  -3.711
   49   2HD2  ASN 179          2HD2      ASN 179  -9.006  -3.233  -5.028
   50    HA   PRO 180           HA       PRO 180  -6.488  -2.638   3.003
   51   1HB   PRO 180          2HB       PRO 180  -7.732  -5.426   3.212
   52   2HB   PRO 180          1HB       PRO 180  -7.490  -4.212   4.493
   53   1HG   PRO 180          2HG       PRO 180  -9.925  -4.413   3.326
   54   2HG   PRO 180          1HG       PRO 180  -9.235  -2.788   3.595
   55   1HD   PRO 180          2HD       PRO 180  -9.306  -4.380   0.984
   56   2HD   PRO 180          1HD       PRO 180  -9.595  -2.637   1.246
   57    H    THR 181           H        THR 181  -5.973  -5.319   0.769
   58    HA   THR 181           HA       THR 181  -3.560  -6.323   2.235
   59    HB   THR 181           HB       THR 181  -4.686  -7.102  -0.504
   60    HG1  THR 181           1HG      THR 181  -3.145  -8.744  -0.441
   61   1HG2  THR 181          1HG2      THR 181  -4.471  -8.799   2.071
   62   2HG2  THR 181          2HG2      THR 181  -5.982  -8.112   1.416
   63   3HG2  THR 181          3HG2      THR 181  -5.094  -9.355   0.494
   64    H    CYS 182           H        CYS 182  -3.859  -4.445  -0.835
   65    HA   CYS 182           HA       CYS 182  -1.085  -4.240  -1.454
   66   1HB   CYS 182          2HB       CYS 182  -1.720  -2.264  -2.847
   67   2HB   CYS 182          1HB       CYS 182  -2.928  -3.546  -2.991
   68    H    TRP 183           H        TRP 183  -2.594  -2.387   1.058
   69    HA   TRP 183           HA       TRP 183  -0.621  -0.181   0.973
   70   1HB   TRP 183          2HB       TRP 183  -3.199  -0.175   1.938
   71   2HB   TRP 183          1HB       TRP 183  -2.386  -0.498   3.447
   72    HD1  TRP 183           HD       TRP 183  -2.878   2.099   0.700
   73    HE1  TRP 183           1HE      TRP 183  -1.885   4.450   1.220
   74    HE3  TRP 183           3HE      TRP 183  -0.510   0.748   4.998
   75    HZ2  TRP 183           2HZ      TRP 183  -0.368   5.480   3.401
   76    HZ3  TRP 183           3HZ      TRP 183   0.730   2.479   6.254
   77    HH2  TRP 183           HH       TRP 183   0.799   4.799   5.469
   78    H    ALA 184           H        ALA 184  -0.860  -2.932   3.173
   79    HA   ALA 184           HA       ALA 184   1.258  -2.050   4.988
   80   1HB   ALA 184          1HB       ALA 184  -0.463  -3.744   5.628
   81   2HB   ALA 184          2HB       ALA 184   0.244  -4.904   4.473
   82   3HB   ALA 184          3HB       ALA 184   1.174  -4.375   5.899
   83    H    ILE 185           H        ILE 185   1.732  -3.484   1.905
   84    HA   ILE 185           HA       ILE 185   4.520  -4.450   2.641
   85    HB   ILE 185           HB       ILE 185   3.166  -6.129   1.585
   86   1HG1  ILE 185          2HG1      ILE 185   5.557  -5.659  -0.303
   87   2HG1  ILE 185          1HG1      ILE 185   5.812  -5.966   1.388
   88   1HG2  ILE 185          1HG2      ILE 185   2.622  -6.254  -0.851
   89   2HG2  ILE 185          2HG2      ILE 185   1.804  -4.866  -0.087
   90   3HG2  ILE 185          3HG2      ILE 185   3.250  -4.602  -1.097
   91   1HD1  ILE 185          1HD1      ILE 185   6.147  -8.033   0.174
   92   2HD1  ILE 185          2HD1      ILE 185   4.755  -8.206   1.277
   93   3HD1  ILE 185          3HD1      ILE 185   4.485  -7.989  -0.473
   94    H    CYS 186           H        CYS 186   5.041  -2.333   2.993
   95    HA   CYS 186           HA       CYS 186   6.005  -0.761   0.521
   96   1HB   CYS 186          1HB       CYS 186   4.070   0.400   1.578
   97   2HB   CYS 186          2HB       CYS 186   4.931   0.452   3.132
   98    H    LYS 187           H        LYS 187   8.115  -0.963   0.538
   99    HA   LYS 187           HA       LYS 187   9.791  -0.686   3.093
  100   1HB   LYS 187          1HB       LYS 187   9.531  -3.158   2.230
  101   2HB   LYS 187          2HB       LYS 187  10.409  -2.648   0.791
  102   1HG   LYS 187          1HG       LYS 187  12.383  -2.027   2.294
  103   2HG   LYS 187          2HG       LYS 187  11.460  -2.565   3.698
  104   1HD   LYS 187          2HD       LYS 187  11.358  -4.916   2.724
  105   2HD   LYS 187          1HD       LYS 187  12.284  -4.372   1.321
  106   1HE   LYS 187          2HE       LYS 187  14.240  -3.799   2.830
  107   2HE   LYS 187          1HE       LYS 187  13.311  -4.345   4.238
  108   1HZ   LYS 187          1HZ       LYS 187  14.744  -6.099   3.388
  109   2HZ   LYS 187          2HZ       LYS 187  14.032  -6.047   1.898
  110   3HZ   LYS 187          3HZ       LYS 187  13.166  -6.555   3.209
  Start of MODEL    2
    1   1H    PRO 172          1H        PRO 172   9.689   5.161  -0.537
    2    HA   PRO 172           HA       PRO 172   8.410   5.092  -2.338
    3   1HB   PRO 172          2HB       PRO 172   9.239   2.167  -2.874
    4   2HB   PRO 172          1HB       PRO 172   8.838   3.444  -4.050
    5   1HG   PRO 172          1HG       PRO 172  11.441   2.962  -3.466
    6   2HG   PRO 172          2HG       PRO 172  10.887   4.657  -3.559
    7   1HD   PRO 172          1HD       PRO 172  11.413   2.981  -1.070
    8   2HD   PRO 172          2HD       PRO 172  11.740   4.717  -1.336
    9    H    CYS 173           H        CYS 173   6.265   4.852  -2.158
   10    HA   CYS 173           HA       CYS 173   4.994   2.451  -0.757
   11   1HB   CYS 173          2HB       CYS 173   5.211   4.346   0.899
   12   2HB   CYS 173          1HB       CYS 173   4.225   5.375  -0.156
   13    H    SER 174           H        SER 174   3.315   1.750  -1.884
   14    HA   SER 174           HA       SER 174   2.534   2.771  -4.480
   15   1HB   SER 174          2HB       SER 174   1.280   0.578  -2.719
   16   2HB   SER 174          1HB       SER 174   0.861   0.860  -4.416
   17    HG   SER 174           HG       SER 174   3.063   0.561  -4.939
   18    H    ILE 175           H        ILE 175   0.814   3.818  -5.096
   19    HA   ILE 175           HA       ILE 175  -0.788   5.467  -3.252
   20    HB   ILE 175           HB       ILE 175   0.089   6.422  -5.293
   21   1HG1  ILE 175          1HG1      ILE 175  -2.022   7.837  -6.006
   22   2HG1  ILE 175          2HG1      ILE 175  -2.929   6.809  -4.914
   23   1HG2  ILE 175          1HG2      ILE 175  -0.897   6.246  -7.535
   24   2HG2  ILE 175          2HG2      ILE 175  -2.108   5.067  -6.954
   25   3HG2  ILE 175          3HG2      ILE 175  -0.379   4.639  -6.976
   26   1HD1  ILE 175          1HD1      ILE 175  -1.531   7.747  -2.996
   27   2HD1  ILE 175          2HD1      ILE 175  -0.607   8.721  -4.171
   28   3HD1  ILE 175          3HD1      ILE 175  -2.348   9.028  -3.930
   29    H    CYS 176           H        CYS 176  -1.768   3.991  -2.092
   30    HA   CYS 176           HA       CYS 176  -4.366   2.708  -3.121
   31   1HB   CYS 176          1HB       CYS 176  -2.296   1.428  -1.237
   32   2HB   CYS 176          2HB       CYS 176  -3.950   0.838  -1.437
   33    H    SER 177           H        SER 177  -5.790   3.914  -2.196
   34    HA   SER 177           HA       SER 177  -5.539   5.256   0.465
   35   1HB   SER 177          2HB       SER 177  -7.665   6.332  -0.009
   36   2HB   SER 177          1HB       SER 177  -6.573   6.455  -1.401
   37    HG   SER 177           HG       SER 177  -8.631   4.525  -1.033
   38    H    ASN 178           H        ASN 178  -7.713   2.649  -0.673
   39    HA   ASN 178           HA       ASN 178  -7.876   1.533   2.096
   40   1HB   ASN 178          1HB       ASN 178 -10.266   1.392   2.359
   41   2HB   ASN 178          2HB       ASN 178  -9.702   3.046   2.384
   42   1HD2  ASN 178          1HD2      ASN 178 -10.251   4.404   0.507
   43   2HD2  ASN 178          2HD2      ASN 178 -11.714   3.965  -0.510
   44    H    ASN 179           H        ASN 179  -6.843  -0.197   1.283
   45    HA   ASN 179           HA       ASN 179  -8.295  -2.190  -0.366
   46   1HB   ASN 179          1HB       ASN 179  -7.120  -0.804  -2.154
   47   2HB   ASN 179          2HB       ASN 179  -5.570  -1.248  -1.457
   48   1HD2  ASN 179          2HD2      ASN 179  -4.859  -3.451  -1.788
   49   2HD2  ASN 179          1HD2      ASN 179  -5.702  -4.553  -2.987
   50    HA   PRO 180           HA       PRO 180  -6.025  -3.752   3.492
   51   1HB   PRO 180          2HB       PRO 180  -7.493  -6.280   2.568
   52   2HB   PRO 180          1HB       PRO 180  -7.130  -5.765   4.235
   53   1HG   PRO 180          2HG       PRO 180  -9.585  -5.243   3.205
   54   2HG   PRO 180          1HG       PRO 180  -8.744  -3.962   4.122
   55   1HD   PRO 180          2HD       PRO 180  -9.055  -4.189   1.100
   56   2HD   PRO 180          1HD       PRO 180  -9.034  -2.731   2.129
   57    H    THR 181           H        THR 181  -5.687  -5.333   0.369
   58    HA   THR 181           HA       THR 181  -3.250  -6.865   1.252
   59    HB   THR 181           HB       THR 181  -5.018  -7.789  -0.394
   60    HG1  THR 181           1HG      THR 181  -3.627  -6.034  -2.115
   61   1HG2  THR 181          1HG2      THR 181  -3.480  -8.962  -1.917
   62   2HG2  THR 181          2HG2      THR 181  -2.824  -8.967  -0.258
   63   3HG2  THR 181          3HG2      THR 181  -2.149  -7.857  -1.481
   64    H    CYS 182           H        CYS 182  -3.724  -4.362  -1.308
   65    HA   CYS 182           HA       CYS 182  -0.928  -3.667  -1.596
   66   1HB   CYS 182          2HB       CYS 182  -2.680  -3.094  -3.274
   67   2HB   CYS 182          1HB       CYS 182  -3.469  -2.003  -2.127
   68    H    TRP 183           H        TRP 183  -2.961  -2.629   0.984
   69    HA   TRP 183           HA       TRP 183  -1.571  -0.054   1.454
   70   1HB   TRP 183          1HB       TRP 183  -4.118  -0.816   2.170
   71   2HB   TRP 183          2HB       TRP 183  -3.323  -1.230   3.666
   72    HD1  TRP 183           HD       TRP 183  -4.216   1.668   1.338
   73    HE1  TRP 183           1HE      TRP 183  -3.846   4.035   2.351
   74    HE3  TRP 183           3HE      TRP 183  -1.966   0.082   5.619
   75    HZ2  TRP 183           2HZ      TRP 183  -2.820   4.945   4.853
   76    HZ3  TRP 183           3HZ      TRP 183  -1.275   1.773   7.284
   77    HH2  TRP 183           HH       TRP 183  -1.695   4.158   6.906
   78    H    ALA 184           H        ALA 184  -1.222  -3.159   3.088
   79    HA   ALA 184           HA       ALA 184   0.517  -2.172   5.231
   80   1HB   ALA 184          1HB       ALA 184  -0.775  -4.305   5.401
   81   2HB   ALA 184          2HB       ALA 184   0.949  -4.587   5.713
   82   3HB   ALA 184          3HB       ALA 184   0.251  -5.030   4.134
   83    H    ILE 185           H        ILE 185   1.497  -2.943   1.981
   84    HA   ILE 185           HA       ILE 185   4.370  -3.444   2.765
   85    HB   ILE 185           HB       ILE 185   4.811  -3.657   0.299
   86   1HG1  ILE 185          2HG1      ILE 185   2.925  -4.407  -1.307
   87   2HG1  ILE 185          1HG1      ILE 185   1.788  -3.724  -0.163
   88   1HG2  ILE 185          1HG2      ILE 185   2.871  -5.763   1.356
   89   2HG2  ILE 185          2HG2      ILE 185   4.594  -5.635   1.788
   90   3HG2  ILE 185          3HG2      ILE 185   4.132  -6.007   0.119
   91   1HD1  ILE 185          1HD1      ILE 185   2.191  -2.268  -2.138
   92   2HD1  ILE 185          2HD1      ILE 185   3.936  -2.194  -1.772
   93   3HD1  ILE 185          3HD1      ILE 185   2.760  -1.432  -0.668
   94    H    CYS 186           H        CYS 186   4.052  -1.315   3.836
   95    HA   CYS 186           HA       CYS 186   5.765   0.688   2.312
   96   1HB   CYS 186          1HB       CYS 186   3.168   1.500   3.752
   97   2HB   CYS 186          2HB       CYS 186   4.440   2.637   3.251
   98    H    LYS 187           H        LYS 187   7.461   0.971   3.552
   99    HA   LYS 187           HA       LYS 187   7.290   1.093   6.612
  100   1HB   LYS 187          1HB       LYS 187   8.163  -1.205   5.673
  101   2HB   LYS 187          2HB       LYS 187   9.542  -0.314   5.037
  102   1HG   LYS 187          2HG       LYS 187  10.115   0.382   7.431
  103   2HG   LYS 187          1HG       LYS 187   8.726  -0.539   8.011
  104   1HD   LYS 187          2HD       LYS 187   9.759  -2.673   7.080
  105   2HD   LYS 187          1HD       LYS 187  11.147  -1.746   6.502
  106   1HE   LYS 187          2HE       LYS 187  11.713  -1.101   8.889
  107   2HE   LYS 187          1HE       LYS 187  10.318  -2.032   9.468
  108   1HZ   LYS 187          1HZ       LYS 187  12.354  -3.337   9.555
  109   2HZ   LYS 187          2HZ       LYS 187  12.612  -3.160   7.933
  110   3HZ   LYS 187          3HZ       LYS 187  11.314  -4.027   8.472
  Start of MODEL    3
    1   1H    PRO 172          1H        PRO 172   9.951   4.312  -2.667
    2    HA   PRO 172           HA       PRO 172   8.280   5.645  -3.231
    3   1HB   PRO 172          1HB       PRO 172   7.673   3.916  -5.713
    4   2HB   PRO 172          2HB       PRO 172   7.489   5.677  -5.511
    5   1HG   PRO 172          2HG       PRO 172   9.726   4.715  -6.701
    6   2HG   PRO 172          1HG       PRO 172   9.897   6.009  -5.483
    7   1HD   PRO 172          2HD       PRO 172  10.416   3.026  -5.146
    8   2HD   PRO 172          1HD       PRO 172  11.316   4.402  -4.447
    9    H    CYS 173           H        CYS 173   6.370   5.523  -2.215
   10    HA   CYS 173           HA       CYS 173   5.109   2.833  -1.538
   11   1HB   CYS 173          1HB       CYS 173   5.762   4.372   0.335
   12   2HB   CYS 173          2HB       CYS 173   4.639   5.596  -0.291
   13    H    SER 174           H        SER 174   3.436   2.315  -2.735
   14    HA   SER 174           HA       SER 174   2.126   3.954  -4.726
   15   1HB   SER 174          1HB       SER 174   2.499   1.490  -4.937
   16   2HB   SER 174          2HB       SER 174   1.368   1.189  -3.602
   17    HG   SER 174           HG       SER 174  -0.240   2.230  -4.863
   18    H    ILE 175           H        ILE 175   0.187   4.803  -4.787
   19    HA   ILE 175           HA       ILE 175  -1.202   5.658  -2.330
   20    HB   ILE 175           HB       ILE 175  -0.839   7.215  -4.116
   21   1HG1  ILE 175          1HG1      ILE 175  -3.872   7.261  -3.585
   22   2HG1  ILE 175          2HG1      ILE 175  -2.742   7.454  -2.279
   23   1HG2  ILE 175          1HG2      ILE 175  -1.376   5.921  -6.183
   24   2HG2  ILE 175          2HG2      ILE 175  -3.114   5.956  -5.779
   25   3HG2  ILE 175          3HG2      ILE 175  -2.252   7.473  -6.156
   26   1HD1  ILE 175          1HD1      ILE 175  -1.770   9.519  -3.249
   27   2HD1  ILE 175          2HD1      ILE 175  -3.524   9.645  -2.948
   28   3HD1  ILE 175          3HD1      ILE 175  -2.920   9.417  -4.610
   29    H    CYS 176           H        CYS 176  -1.745   3.761  -1.531
   30    HA   CYS 176           HA       CYS 176  -3.754   1.858  -2.681
   31   1HB   CYS 176          1HB       CYS 176  -1.736   1.195  -1.258
   32   2HB   CYS 176          2HB       CYS 176  -2.591   1.899   0.133
   33    H    SER 177           H        SER 177  -5.390   3.238  -2.948
   34    HA   SER 177           HA       SER 177  -6.920   4.558  -0.674
   35   1HB   SER 177          2HB       SER 177  -6.515   5.873  -2.680
   36   2HB   SER 177          1HB       SER 177  -7.389   4.681  -3.679
   37    HG   SER 177           HG       SER 177  -8.696   6.420  -3.010
   38    H    ASN 178           H        ASN 178  -7.725   2.946   0.326
   39    HA   ASN 178           HA       ASN 178  -9.046   1.170   1.099
   40   1HB   ASN 178          1HB       ASN 178 -10.753   2.977   0.623
   41   2HB   ASN 178          2HB       ASN 178 -11.166   2.128  -0.852
   42   1HD2  ASN 178          1HD2      ASN 178 -11.295   1.959   2.673
   43   2HD2  ASN 178          2HD2      ASN 178 -12.561   0.633   2.724
   44    H    ASN 179           H        ASN 179  -7.584  -0.379   0.395
   45    HA   ASN 179           HA       ASN 179  -8.670  -2.553  -1.254
   46   1HB   ASN 179          2HB       ASN 179  -7.572  -1.168  -3.070
   47   2HB   ASN 179          1HB       ASN 179  -6.023  -1.347  -2.269
   48   1HD2  ASN 179          1HD2      ASN 179  -4.986  -3.423  -2.439
   49   2HD2  ASN 179          2HD2      ASN 179  -5.614  -4.725  -3.571
   50    HA   PRO 180           HA       PRO 180  -6.496  -3.494   2.859
   51   1HB   PRO 180          1HB       PRO 180  -7.677  -6.238   2.134
   52   2HB   PRO 180          2HB       PRO 180  -7.454  -5.521   3.750
   53   1HG   PRO 180          1HG       PRO 180  -9.881  -5.348   2.562
   54   2HG   PRO 180          2HG       PRO 180  -9.215  -3.901   3.367
   55   1HD   PRO 180          2HD       PRO 180  -9.317  -4.497   0.379
   56   2HD   PRO 180          1HD       PRO 180  -9.522  -2.939   1.226
   57    H    THR 181           H        THR 181  -5.740  -5.147  -0.109
   58    HA   THR 181           HA       THR 181  -3.456  -6.679   1.058
   59    HB   THR 181           HB       THR 181  -4.950  -7.470  -0.908
   60    HG1  THR 181           1HG      THR 181  -4.793  -5.500  -2.006
   61   1HG2  THR 181          1HG2      THR 181  -2.849  -8.732  -0.450
   62   2HG2  THR 181          2HG2      THR 181  -3.207  -8.634  -2.195
   63   3HG2  THR 181          3HG2      THR 181  -1.939  -7.598  -1.484
   64    H    CYS 182           H        CYS 182  -3.440  -4.024  -1.410
   65    HA   CYS 182           HA       CYS 182  -0.597  -3.560  -1.197
   66   1HB   CYS 182          2HB       CYS 182  -0.990  -1.473  -2.497
   67   2HB   CYS 182          1HB       CYS 182  -1.818  -2.882  -3.149
   68    H    TRP 183           H        TRP 183  -2.735  -2.546   1.173
   69    HA   TRP 183           HA       TRP 183  -1.365  -0.033   1.886
   70   1HB   TRP 183          1HB       TRP 183  -3.913  -0.804   2.445
   71   2HB   TRP 183          2HB       TRP 183  -3.189  -1.390   3.926
   72    HD1  TRP 183           HD       TRP 183  -3.974   1.762   1.905
   73    HE1  TRP 183           1HE      TRP 183  -3.557   4.004   3.175
   74    HE3  TRP 183           3HE      TRP 183  -1.865  -0.324   6.042
   75    HZ2  TRP 183           2HZ      TRP 183  -2.581   4.613   5.774
   76    HZ3  TRP 183           3HZ      TRP 183  -1.176   1.164   7.891
   77    HH2  TRP 183           HH       TRP 183  -1.527   3.586   7.758
   78    H    ALA 184           H        ALA 184  -1.062  -3.224   3.378
   79    HA   ALA 184           HA       ALA 184   0.636  -2.318   5.589
   80   1HB   ALA 184          1HB       ALA 184  -0.709  -4.396   5.728
   81   2HB   ALA 184          2HB       ALA 184   0.305  -5.153   4.469
   82   3HB   ALA 184          3HB       ALA 184   1.006  -4.734   6.054
   83    H    ILE 185           H        ILE 185   1.687  -3.385   2.400
   84    HA   ILE 185           HA       ILE 185   4.485  -2.584   3.104
   85    HB   ILE 185           HB       ILE 185   4.465  -4.926   3.736
   86   1HG1  ILE 185          2HG1      ILE 185   6.656  -5.683   2.425
   87   2HG1  ILE 185          1HG1      ILE 185   6.450  -4.204   1.509
   88   1HG2  ILE 185          1HG2      ILE 185   4.484  -6.864   2.227
   89   2HG2  ILE 185          2HG2      ILE 185   4.230  -5.807   0.808
   90   3HG2  ILE 185          3HG2      ILE 185   2.960  -5.962   2.049
   91   1HD1  ILE 185          1HD1      ILE 185   8.156  -4.017   3.321
   92   2HD1  ILE 185          2HD1      ILE 185   6.808  -2.903   3.675
   93   3HD1  ILE 185          3HD1      ILE 185   6.945  -4.448   4.557
   94    H    CYS 186           H        CYS 186   4.079  -0.904   1.848
   95    HA   CYS 186           HA       CYS 186   3.497  -1.190  -1.131
   96   1HB   CYS 186          2HB       CYS 186   3.240   1.224  -1.192
   97   2HB   CYS 186          1HB       CYS 186   2.199   0.497   0.043
   98    H    LYS 187           H        LYS 187   5.328  -2.028  -1.911
   99    HA   LYS 187           HA       LYS 187   8.061  -0.831  -1.376
  100   1HB   LYS 187          1HB       LYS 187   9.089  -2.634  -2.490
  101   2HB   LYS 187          2HB       LYS 187   8.010  -3.197  -1.229
  102   1HG   LYS 187          1HG       LYS 187   6.342  -3.946  -2.982
  103   2HG   LYS 187          2HG       LYS 187   7.429  -3.379  -4.252
  104   1HD   LYS 187          1HD       LYS 187   9.201  -5.027  -3.472
  105   2HD   LYS 187          2HD       LYS 187   8.114  -5.594  -2.201
  106   1HE   LYS 187          1HE       LYS 187   6.463  -6.378  -3.959
  107   2HE   LYS 187          2HE       LYS 187   7.555  -5.810  -5.235
  108   1HZ   LYS 187          1HZ       LYS 187   8.235  -7.873  -3.194
  109   2HZ   LYS 187          2HZ       LYS 187   9.253  -7.342  -4.382
  110   3HZ   LYS 187          3HZ       LYS 187   7.875  -8.163  -4.779
  Start of MODEL    4
    1   1H    PRO 172          1H        PRO 172   9.783   4.586  -3.307
    2    HA   PRO 172           HA       PRO 172   8.129   6.006  -3.671
    3   1HB   PRO 172          1HB       PRO 172   7.482   4.639  -6.362
    4   2HB   PRO 172          2HB       PRO 172   7.323   6.358  -5.919
    5   1HG   PRO 172          1HG       PRO 172   9.541   5.537  -7.246
    6   2HG   PRO 172          2HG       PRO 172   9.736   6.652  -5.865
    7   1HD   PRO 172          2HD       PRO 172  10.216   3.645  -5.941
    8   2HD   PRO 172          1HD       PRO 172  11.139   4.899  -5.069
    9    H    CYS 173           H        CYS 173   6.221   5.772  -2.665
   10    HA   CYS 173           HA       CYS 173   4.950   3.034  -2.326
   11   1HB   CYS 173          1HB       CYS 173   5.562   4.232  -0.277
   12   2HB   CYS 173          2HB       CYS 173   4.596   5.643  -0.746
   13    H    SER 174           H        SER 174   3.152   2.633  -3.339
   14    HA   SER 174           HA       SER 174   1.748   4.413  -5.175
   15   1HB   SER 174          1HB       SER 174   0.330   2.426  -5.620
   16   2HB   SER 174          2HB       SER 174   2.043   1.988  -5.613
   17    HG   SER 174           HG       SER 174   0.210   1.703  -3.453
   18    H    ILE 175           H        ILE 175  -0.313   5.117  -5.081
   19    HA   ILE 175           HA       ILE 175  -1.394   6.048  -2.476
   20    HB   ILE 175           HB       ILE 175  -2.807   6.500  -5.139
   21   1HG1  ILE 175          2HG1      ILE 175  -1.866   9.031  -4.900
   22   2HG1  ILE 175          1HG1      ILE 175  -0.688   8.319  -3.812
   23   1HG2  ILE 175          1HG2      ILE 175  -3.160   8.065  -2.501
   24   2HG2  ILE 175          2HG2      ILE 175  -4.038   8.372  -4.028
   25   3HG2  ILE 175          3HG2      ILE 175  -4.281   6.854  -3.156
   26   1HD1  ILE 175          1HD1      ILE 175   0.136   8.722  -6.149
   27   2HD1  ILE 175          2HD1      ILE 175  -1.110   7.628  -6.802
   28   3HD1  ILE 175          3HD1      ILE 175   0.204   6.980  -5.782
   29    H    CYS 176           H        CYS 176  -1.808   4.186  -1.528
   30    HA   CYS 176           HA       CYS 176  -3.792   2.100  -2.449
   31   1HB   CYS 176          1HB       CYS 176  -1.596   1.553  -1.289
   32   2HB   CYS 176          2HB       CYS 176  -2.263   2.304   0.181
   33    H    SER 177           H        SER 177  -5.476   3.544  -2.552
   34    HA   SER 177           HA       SER 177  -6.735   4.825  -0.172
   35   1HB   SER 177          1HB       SER 177  -8.403   5.744  -1.664
   36   2HB   SER 177          2HB       SER 177  -6.769   5.981  -2.307
   37    HG   SER 177           HG       SER 177  -8.577   3.902  -3.012
   38    H    ASN 178           H        ASN 178  -8.114   2.255  -2.273
   39    HA   ASN 178           HA       ASN 178  -9.392   0.983   0.171
   40   1HB   ASN 178          2HB       ASN 178 -11.089   2.627  -0.745
   41   2HB   ASN 178          1HB       ASN 178 -11.117   1.739  -2.259
   42   1HD2  ASN 178          1HD2      ASN 178 -12.202  -0.333  -2.235
   43   2HD2  ASN 178          2HD2      ASN 178 -13.263  -0.831  -0.824
   44    H    ASN 179           H        ASN 179  -7.777  -0.519  -0.181
   45    HA   ASN 179           HA       ASN 179  -8.381  -2.800  -1.905
   46   1HB   ASN 179          1HB       ASN 179  -5.808  -1.306  -2.645
   47   2HB   ASN 179          2HB       ASN 179  -6.034  -3.018  -2.963
   48   1HD2  ASN 179          1HD2      ASN 179  -7.514  -3.612  -4.656
   49   2HD2  ASN 179          2HD2      ASN 179  -8.175  -2.363  -5.826
   50    HA   PRO 180           HA       PRO 180  -6.676  -3.472   2.456
   51   1HB   PRO 180          1HB       PRO 180  -7.638  -6.307   1.767
   52   2HB   PRO 180          2HB       PRO 180  -7.653  -5.480   3.344
   53   1HG   PRO 180          2HG       PRO 180  -9.920  -5.517   1.866
   54   2HG   PRO 180          1HG       PRO 180  -9.429  -3.985   2.640
   55   1HD   PRO 180          2HD       PRO 180  -9.101  -4.789  -0.288
   56   2HD   PRO 180          1HD       PRO 180  -9.535  -3.199   0.403
   57    H    THR 181           H        THR 181  -5.565  -5.240  -0.334
   58    HA   THR 181           HA       THR 181  -3.306  -6.583   1.118
   59    HB   THR 181           HB       THR 181  -3.973  -6.477  -1.869
   60    HG1  THR 181           1HG      THR 181  -2.299  -7.968  -2.084
   61   1HG2  THR 181          1HG2      THR 181  -3.937  -8.910   0.037
   62   2HG2  THR 181          2HG2      THR 181  -5.407  -8.124  -0.598
   63   3HG2  THR 181          3HG2      THR 181  -4.286  -8.948  -1.713
   64    H    CYS 182           H        CYS 182  -3.332  -3.829  -1.266
   65    HA   CYS 182           HA       CYS 182  -0.481  -3.405  -1.111
   66   1HB   CYS 182          1HB       CYS 182  -0.905  -1.214  -2.228
   67   2HB   CYS 182          2HB       CYS 182  -1.766  -2.562  -2.963
   68    H    TRP 183           H        TRP 183  -2.641  -2.439   1.321
   69    HA   TRP 183           HA       TRP 183  -1.092  -0.073   2.182
   70   1HB   TRP 183          1HB       TRP 183  -3.725  -0.639   2.627
   71   2HB   TRP 183          2HB       TRP 183  -3.099  -1.301   4.120
   72    HD1  TRP 183           HD       TRP 183  -3.449   1.939   2.079
   73    HE1  TRP 183           1HE      TRP 183  -2.981   4.119   3.436
   74    HE3  TRP 183           3HE      TRP 183  -1.905  -0.381   6.342
   75    HZ2  TRP 183           2HZ      TRP 183  -2.173   4.604   6.119
   76    HZ3  TRP 183           3HZ      TRP 183  -1.262   1.016   8.277
   77    HH2  TRP 183           HH       TRP 183  -1.395   3.461   8.165
   78    H    ALA 184           H        ALA 184  -1.144  -3.331   3.547
   79    HA   ALA 184           HA       ALA 184   0.591  -2.693   5.828
   80   1HB   ALA 184          1HB       ALA 184  -0.928  -4.660   5.830
   81   2HB   ALA 184          2HB       ALA 184   0.747  -5.158   6.159
   82   3HB   ALA 184          3HB       ALA 184   0.042  -5.425   4.543
   83    H    ILE 185           H        ILE 185   1.576  -3.416   2.585
   84    HA   ILE 185           HA       ILE 185   4.444  -3.084   3.342
   85    HB   ILE 185           HB       ILE 185   3.834  -5.536   1.593
   86   1HG1  ILE 185          1HG1      ILE 185   5.078  -6.922   3.585
   87   2HG1  ILE 185          2HG1      ILE 185   4.622  -5.551   4.579
   88   1HG2  ILE 185          1HG2      ILE 185   6.542  -4.589   2.719
   89   2HG2  ILE 185          2HG2      ILE 185   6.284  -6.009   1.664
   90   3HG2  ILE 185          3HG2      ILE 185   5.972  -4.381   1.047
   91   1HD1  ILE 185          1HD1      ILE 185   2.172  -6.126   4.063
   92   2HD1  ILE 185          2HD1      ILE 185   2.739  -7.463   3.035
   93   3HD1  ILE 185          3HD1      ILE 185   3.065  -7.486   4.787
   94    H    CYS 186           H        CYS 186   4.382  -1.266   2.233
   95    HA   CYS 186           HA       CYS 186   2.908  -0.851  -0.353
   96   1HB   CYS 186          1HB       CYS 186   2.895   0.854   1.539
   97   2HB   CYS 186          2HB       CYS 186   4.590   1.218   1.146
   98    H    LYS 187           H        LYS 187   3.927  -1.714  -1.996
   99    HA   LYS 187           HA       LYS 187   6.943  -1.469  -2.459
  100   1HB   LYS 187          2HB       LYS 187   5.662  -3.747  -2.605
  101   2HB   LYS 187          1HB       LYS 187   4.870  -3.110  -4.044
  102   1HG   LYS 187          1HG       LYS 187   7.175  -2.883  -5.130
  103   2HG   LYS 187          2HG       LYS 187   7.907  -3.541  -3.666
  104   1HD   LYS 187          1HD       LYS 187   6.609  -5.707  -3.996
  105   2HD   LYS 187          2HD       LYS 187   5.879  -5.043  -5.460
  106   1HE   LYS 187          2HE       LYS 187   8.174  -4.866  -6.527
  107   2HE   LYS 187          1HE       LYS 187   8.906  -5.532  -5.055
  108   1HZ   LYS 187          1HZ       LYS 187   6.881  -6.926  -6.742
  109   2HZ   LYS 187          2HZ       LYS 187   7.563  -7.546  -5.372
  110   3HZ   LYS 187          3HZ       LYS 187   8.499  -7.256  -6.702
  Start of MODEL    5
    1   1H    PRO 172          1H        PRO 172   9.123   2.704  -0.663
    2    HA   PRO 172           HA       PRO 172   8.364   5.372  -1.415
    3   1HB   PRO 172          1HB       PRO 172   8.257   3.230  -3.630
    4   2HB   PRO 172          2HB       PRO 172   8.197   5.003  -3.784
    5   1HG   PRO 172          1HG       PRO 172  10.560   3.733  -4.157
    6   2HG   PRO 172          2HG       PRO 172  10.541   5.222  -3.171
    7   1HD   PRO 172          2HD       PRO 172  10.632   2.327  -2.213
    8   2HD   PRO 172          1HD       PRO 172  11.506   3.740  -1.559
    9    H    CYS 173           H        CYS 173   6.261   5.502  -0.925
   10    HA   CYS 173           HA       CYS 173   4.650   3.022  -0.177
   11   1HB   CYS 173          2HB       CYS 173   4.942   4.753   1.570
   12   2HB   CYS 173          1HB       CYS 173   4.211   5.978   0.514
   13    H    SER 174           H        SER 174   3.373   2.367  -1.740
   14    HA   SER 174           HA       SER 174   2.669   3.807  -4.178
   15   1HB   SER 174          2HB       SER 174   1.618   1.148  -3.049
   16   2HB   SER 174          1HB       SER 174   1.295   1.740  -4.688
   17    HG   SER 174           HG       SER 174   3.856   1.295  -3.549
   18    H    ILE 175           H        ILE 175   0.944   4.894  -4.617
   19    HA   ILE 175           HA       ILE 175  -1.081   5.685  -2.622
   20    HB   ILE 175           HB       ILE 175  -0.171   7.313  -4.105
   21   1HG1  ILE 175          1HG1      ILE 175  -2.038   7.951  -2.868
   22   2HG1  ILE 175          2HG1      ILE 175  -1.989   8.820  -4.372
   23   1HG2  ILE 175          1HG2      ILE 175  -0.052   6.200  -6.311
   24   2HG2  ILE 175          2HG2      ILE 175  -0.783   7.822  -6.410
   25   3HG2  ILE 175          3HG2      ILE 175  -1.817   6.369  -6.500
   26   1HD1  ILE 175          1HD1      ILE 175  -4.327   8.357  -3.698
   27   2HD1  ILE 175          2HD1      ILE 175  -3.984   7.469  -5.207
   28   3HD1  ILE 175          3HD1      ILE 175  -4.019   6.600  -3.649
   29    H    CYS 176           H        CYS 176  -1.925   3.773  -2.156
   30    HA   CYS 176           HA       CYS 176  -3.770   2.265  -4.057
   31   1HB   CYS 176          2HB       CYS 176  -2.059   1.013  -2.653
   32   2HB   CYS 176          1HB       CYS 176  -3.004   1.461  -1.212
   33    H    SER 177           H        SER 177  -5.486   3.366  -4.138
   34    HA   SER 177           HA       SER 177  -6.842   4.894  -1.938
   35   1HB   SER 177          2HB       SER 177  -6.665   5.868  -4.151
   36   2HB   SER 177          1HB       SER 177  -7.643   4.548  -4.847
   37    HG   SER 177           HG       SER 177  -8.433   6.340  -2.786
   38    H    ASN 178           H        ASN 178  -7.409   3.381  -0.614
   39    HA   ASN 178           HA       ASN 178  -8.722   1.895   0.638
   40   1HB   ASN 178          2HB       ASN 178 -10.976   2.815  -1.169
   41   2HB   ASN 178          1HB       ASN 178 -11.227   1.784   0.222
   42   1HD2  ASN 178          1HD2      ASN 178 -10.828   2.695   2.360
   43   2HD2  ASN 178          2HD2      ASN 178 -10.840   4.516   2.581
   44    H    ASN 179           H        ASN 179  -7.611   0.086   0.240
   45    HA   ASN 179           HA       ASN 179  -9.010  -2.196  -0.939
   46   1HB   ASN 179          2HB       ASN 179  -7.866  -1.319  -3.040
   47   2HB   ASN 179          1HB       ASN 179  -6.317  -1.610  -2.283
   48   1HD2  ASN 179          1HD2      ASN 179  -9.096  -3.157  -3.754
   49   2HD2  ASN 179          2HD2      ASN 179  -8.354  -4.834  -3.815
   50    HA   PRO 180           HA       PRO 180  -6.679  -2.644   3.151
   51   1HB   PRO 180          2HB       PRO 180  -8.271  -5.266   3.126
   52   2HB   PRO 180          1HB       PRO 180  -7.836  -4.245   4.520
   53   1HG   PRO 180          1HG       PRO 180 -10.302  -3.989   3.431
   54   2HG   PRO 180          2HG       PRO 180  -9.391  -2.511   3.846
   55   1HD   PRO 180          1HD       PRO 180  -9.776  -3.755   1.084
   56   2HD   PRO 180          2HD       PRO 180  -9.750  -2.032   1.551
   57    H    THR 181           H        THR 181  -6.478  -5.086   0.641
   58    HA   THR 181           HA       THR 181  -4.274  -6.588   1.966
   59    HB   THR 181           HB       THR 181  -6.054  -7.578   0.357
   60    HG1  THR 181           1HG      THR 181  -5.516  -7.412  -1.810
   61   1HG2  THR 181          1HG2      THR 181  -3.166  -8.295  -0.379
   62   2HG2  THR 181          2HG2      THR 181  -4.628  -9.258  -0.728
   63   3HG2  THR 181          3HG2      THR 181  -4.106  -9.007   0.960
   64    H    CYS 182           H        CYS 182  -4.233  -4.508  -0.962
   65    HA   CYS 182           HA       CYS 182  -1.475  -4.439  -1.511
   66   1HB   CYS 182          1HB       CYS 182  -1.887  -2.265  -2.675
   67   2HB   CYS 182          2HB       CYS 182  -3.240  -3.373  -2.937
   68    H    TRP 183           H        TRP 183  -2.775  -2.707   1.193
   69    HA   TRP 183           HA       TRP 183  -0.578  -0.720   1.334
   70   1HB   TRP 183          2HB       TRP 183  -3.208  -0.704   2.349
   71   2HB   TRP 183          1HB       TRP 183  -2.340  -1.111   3.799
   72    HD1  TRP 183           HD       TRP 183  -2.780   1.592   1.112
   73    HE1  TRP 183           1HE      TRP 183  -1.812   3.926   1.776
   74    HE3  TRP 183           3HE      TRP 183  -0.527   0.050   5.411
   75    HZ2  TRP 183           2HZ      TRP 183  -0.335   4.847   4.024
   76    HZ3  TRP 183           3HZ      TRP 183   0.680   1.723   6.774
   77    HH2  TRP 183           HH       TRP 183   0.774   4.074   6.092
   78    H    ALA 184           H        ALA 184  -0.217  -3.868   2.147
   79    HA   ALA 184           HA       ALA 184   1.117  -3.808   4.707
   80   1HB   ALA 184          1HB       ALA 184   1.554  -5.717   2.332
   81   2HB   ALA 184          2HB       ALA 184   0.307  -5.892   3.597
   82   3HB   ALA 184          3HB       ALA 184   2.025  -6.053   4.019
   83    H    ILE 185           H        ILE 185   2.454  -2.378   1.959
   84    HA   ILE 185           HA       ILE 185   5.145  -2.219   3.294
   85    HB   ILE 185           HB       ILE 185   5.379  -4.079   1.777
   86   1HG1  ILE 185          1HG1      ILE 185   7.330  -1.915   0.764
   87   2HG1  ILE 185          2HG1      ILE 185   7.335  -2.392   2.435
   88   1HG2  ILE 185          1HG2      ILE 185   5.595  -3.937  -0.706
   89   2HG2  ILE 185          2HG2      ILE 185   5.110  -2.220  -0.670
   90   3HG2  ILE 185          3HG2      ILE 185   3.953  -3.486  -0.179
   91   1HD1  ILE 185          1HD1      ILE 185   9.124  -3.559   1.302
   92   2HD1  ILE 185          2HD1      ILE 185   7.927  -4.738   1.903
   93   3HD1  ILE 185          3HD1      ILE 185   7.982  -4.328   0.167
   94    H    CYS 186           H        CYS 186   4.484  -0.283   3.899
   95    HA   CYS 186           HA       CYS 186   4.379   1.995   1.825
   96   1HB   CYS 186          1HB       CYS 186   2.116   1.559   2.775
   97   2HB   CYS 186          2HB       CYS 186   2.749   1.769   4.419
   98    H    LYS 187           H        LYS 187   6.200   3.053   2.094
   99    HA   LYS 187           HA       LYS 187   7.675   3.247   4.768
  100   1HB   LYS 187          1HB       LYS 187   8.828   2.442   2.539
  101   2HB   LYS 187          2HB       LYS 187   8.643   4.083   1.989
  102   1HG   LYS 187          2HG       LYS 187  10.846   4.029   2.668
  103   2HG   LYS 187          1HG       LYS 187  10.068   4.848   4.014
  104   1HD   LYS 187          1HD       LYS 187  10.099   2.643   5.316
  105   2HD   LYS 187          2HD       LYS 187  10.898   1.864   3.950
  106   1HE   LYS 187          1HE       LYS 187  12.876   3.435   4.208
  107   2HE   LYS 187          2HE       LYS 187  12.072   4.215   5.582
  108   1HZ   LYS 187          1HZ       LYS 187  13.607   2.494   6.315
  109   2HZ   LYS 187          2HZ       LYS 187  12.069   2.058   6.727
  110   3HZ   LYS 187          3HZ       LYS 187  12.817   1.331   5.447
  Start of MODEL    6
    1   1H    PRO 172          1H        PRO 172   8.570   2.062  -0.919
    2    HA   PRO 172           HA       PRO 172   7.840   4.797  -0.685
    3   1HB   PRO 172          1HB       PRO 172   7.515   4.518  -3.516
    4   2HB   PRO 172          2HB       PRO 172   8.736   5.465  -2.649
    5   1HG   PRO 172          1HG       PRO 172   8.985   2.605  -3.681
    6   2HG   PRO 172          2HG       PRO 172  10.141   3.955  -3.892
    7   1HD   PRO 172          1HD       PRO 172  10.595   2.117  -1.938
    8   2HD   PRO 172          2HD       PRO 172  10.798   3.846  -1.530
    9    H    CYS 173           H        CYS 173   5.661   4.828  -0.627
   10    HA   CYS 173           HA       CYS 173   4.099   2.231  -0.782
   11   1HB   CYS 173          2HB       CYS 173   3.425   4.950   0.480
   12   2HB   CYS 173          1HB       CYS 173   2.297   3.584   0.394
   13    H    SER 174           H        SER 174   2.778   1.906  -2.378
   14    HA   SER 174           HA       SER 174   2.422   3.629  -4.708
   15   1HB   SER 174          2HB       SER 174   2.625   1.135  -4.818
   16   2HB   SER 174          1HB       SER 174   1.117   0.944  -3.898
   17    HG   SER 174           HG       SER 174   1.421   2.268  -6.392
   18    H    ILE 175           H        ILE 175   0.399   4.174  -5.612
   19    HA   ILE 175           HA       ILE 175  -1.332   5.741  -3.792
   20    HB   ILE 175           HB       ILE 175  -0.611   6.725  -5.839
   21   1HG1  ILE 175          2HG1      ILE 175  -2.318   7.822  -4.696
   22   2HG1  ILE 175          1HG1      ILE 175  -2.447   8.122  -6.402
   23   1HG2  ILE 175          1HG2      ILE 175  -2.528   5.087  -7.564
   24   2HG2  ILE 175          2HG2      ILE 175  -0.753   4.922  -7.525
   25   3HG2  ILE 175          3HG2      ILE 175  -1.491   6.441  -8.093
   26   1HD1  ILE 175          1HD1      ILE 175  -4.689   8.014  -5.356
   27   2HD1  ILE 175          2HD1      ILE 175  -4.378   6.369  -4.740
   28   3HD1  ILE 175          3HD1      ILE 175  -4.528   6.651  -6.496
   29    H    CYS 176           H        CYS 176  -2.193   4.245  -2.601
   30    HA   CYS 176           HA       CYS 176  -4.581   2.587  -3.607
   31   1HB   CYS 176          2HB       CYS 176  -2.444   1.743  -1.556
   32   2HB   CYS 176          1HB       CYS 176  -3.998   0.926  -1.764
   33    H    SER 177           H        SER 177  -6.151   3.749  -2.861
   34    HA   SER 177           HA       SER 177  -6.166   5.318  -0.321
   35   1HB   SER 177          1HB       SER 177  -8.355   6.138  -0.973
   36   2HB   SER 177          2HB       SER 177  -7.210   6.251  -2.320
   37    HG   SER 177           HG       SER 177  -9.214   5.366  -2.928
   38    H    ASN 178           H        ASN 178  -8.074   2.449  -1.305
   39    HA   ASN 178           HA       ASN 178  -8.257   1.559   1.560
   40   1HB   ASN 178          2HB       ASN 178 -10.298   3.042   1.249
   41   2HB   ASN 178          1HB       ASN 178 -10.875   1.965  -0.011
   42   1HD2  ASN 178          2HD2      ASN 178 -11.712  -0.104   0.682
   43   2HD2  ASN 178          1HD2      ASN 178 -12.061  -0.445   2.450
   44    H    ASN 179           H        ASN 179  -7.022  -0.129   0.944
   45    HA   ASN 179           HA       ASN 179  -8.153  -2.372  -0.616
   46   1HB   ASN 179          2HB       ASN 179  -7.040  -1.000  -2.461
   47   2HB   ASN 179          1HB       ASN 179  -5.487  -1.245  -1.679
   48   1HD2  ASN 179          2HD2      ASN 179  -4.569  -3.397  -1.804
   49   2HD2  ASN 179          1HD2      ASN 179  -5.253  -4.654  -2.951
   50    HA   PRO 180           HA       PRO 180  -5.857  -3.383   3.400
   51   1HB   PRO 180          2HB       PRO 180  -7.105  -6.103   2.734
   52   2HB   PRO 180          1HB       PRO 180  -6.823  -5.378   4.337
   53   1HG   PRO 180          1HG       PRO 180  -9.286  -5.178   3.223
   54   2HG   PRO 180          2HG       PRO 180  -8.573  -3.737   3.999
   55   1HD   PRO 180          2HD       PRO 180  -8.774  -4.339   1.015
   56   2HD   PRO 180          1HD       PRO 180  -8.936  -2.778   1.866
   57    H    THR 181           H        THR 181  -5.360  -5.222   0.444
   58    HA   THR 181           HA       THR 181  -2.862  -6.527   1.479
   59    HB   THR 181           HB       THR 181  -4.540  -7.638  -0.155
   60    HG1  THR 181           1HG      THR 181  -4.219  -7.091  -2.305
   61   1HG2  THR 181          1HG2      THR 181  -2.310  -8.711   0.133
   62   2HG2  THR 181          2HG2      THR 181  -1.636  -7.660  -1.140
   63   3HG2  THR 181          3HG2      THR 181  -2.907  -8.845  -1.543
   64    H    CYS 182           H        CYS 182  -3.401  -4.180  -1.206
   65    HA   CYS 182           HA       CYS 182  -0.665  -3.428  -1.618
   66   1HB   CYS 182          1HB       CYS 182  -2.500  -2.883  -3.194
   67   2HB   CYS 182          2HB       CYS 182  -3.245  -1.794  -2.014
   68    H    TRP 183           H        TRP 183  -2.615  -2.261   1.001
   69    HA   TRP 183           HA       TRP 183  -0.969   0.182   1.454
   70   1HB   TRP 183          2HB       TRP 183  -3.650  -0.372   2.149
   71   2HB   TRP 183          1HB       TRP 183  -2.864  -0.586   3.685
   72    HD1  TRP 183           HD       TRP 183  -3.559   1.975   0.918
   73    HE1  TRP 183           1HE      TRP 183  -3.278   4.464   1.691
   74    HE3  TRP 183           3HE      TRP 183  -1.624   0.912   5.504
   75    HZ2  TRP 183           2HZ      TRP 183  -2.354   5.652   4.099
   76    HZ3  TRP 183           3HZ      TRP 183  -1.046   2.788   7.005
   77    HH2  TRP 183           HH       TRP 183  -1.404   5.112   6.315
   78    H    ALA 184           H        ALA 184  -1.284  -2.791   3.368
   79    HA   ALA 184           HA       ALA 184   0.777  -2.014   5.323
   80   1HB   ALA 184          1HB       ALA 184   0.504  -4.370   6.153
   81   2HB   ALA 184          2HB       ALA 184  -1.069  -3.604   5.858
   82   3HB   ALA 184          3HB       ALA 184  -0.416  -4.779   4.684
   83    H    ILE 185           H        ILE 185   1.455  -3.040   2.183
   84    HA   ILE 185           HA       ILE 185   4.266  -3.766   2.950
   85    HB   ILE 185           HB       ILE 185   3.151  -5.922   2.851
   86   1HG1  ILE 185          1HG1      ILE 185   4.869  -7.140   1.216
   87   2HG1  ILE 185          2HG1      ILE 185   5.413  -5.524   0.817
   88   1HG2  ILE 185          1HG2      ILE 185   2.769  -5.693  -0.182
   89   2HG2  ILE 185          2HG2      ILE 185   1.473  -5.628   1.038
   90   3HG2  ILE 185          3HG2      ILE 185   2.422  -7.119   0.837
   91   1HD1  ILE 185          1HD1      ILE 185   6.143  -5.254   3.247
   92   2HD1  ILE 185          2HD1      ILE 185   5.509  -6.885   3.598
   93   3HD1  ILE 185          3HD1      ILE 185   6.879  -6.683   2.472
   94    H    CYS 186           H        CYS 186   4.872  -1.889   2.242
   95    HA   CYS 186           HA       CYS 186   4.220  -0.714  -0.438
   96   1HB   CYS 186          1HB       CYS 186   6.158   0.243   1.743
   97   2HB   CYS 186          2HB       CYS 186   5.784   1.127   0.255
   98    H    LYS 187           H        LYS 187   5.195  -1.511  -2.112
   99    HA   LYS 187           HA       LYS 187   6.631  -2.373  -3.694
  100   1HB   LYS 187          2HB       LYS 187   7.887  -0.154  -3.103
  101   2HB   LYS 187          1HB       LYS 187   9.042  -1.162  -2.242
  102   1HG   LYS 187          1HG       LYS 187   9.531  -2.378  -4.437
  103   2HG   LYS 187          2HG       LYS 187   8.375  -1.327  -5.256
  104   1HD   LYS 187          1HD       LYS 187   9.784   0.700  -4.640
  105   2HD   LYS 187          2HD       LYS 187  10.941  -0.354  -3.823
  106   1HE   LYS 187          1HE       LYS 187  11.439  -1.518  -6.020
  107   2HE   LYS 187          2HE       LYS 187  10.278  -0.459  -6.841
  108   1HZ   LYS 187          1HZ       LYS 187  12.534   0.395  -7.016
  109   2HZ   LYS 187          2HZ       LYS 187  12.702   0.470  -5.375
  110   3HZ   LYS 187          3HZ       LYS 187  11.620   1.456  -6.140
  Start of MODEL    7
    1   1H    PRO 172          1H        PRO 172   9.205   3.305  -1.702
    2    HA   PRO 172           HA       PRO 172   7.976   5.903  -1.720
    3   1HB   PRO 172          2HB       PRO 172   8.194   4.458  -4.434
    4   2HB   PRO 172          1HB       PRO 172   7.821   6.168  -4.103
    5   1HG   PRO 172          1HG       PRO 172  10.361   5.479  -4.746
    6   2HG   PRO 172          2HG       PRO 172  10.105   6.618  -3.395
    7   1HD   PRO 172          2HD       PRO 172  10.723   3.633  -3.255
    8   2HD   PRO 172          1HD       PRO 172  11.349   4.946  -2.220
    9    H    CYS 173           H        CYS 173   5.882   5.531  -1.279
   10    HA   CYS 173           HA       CYS 173   4.778   2.704  -1.192
   11   1HB   CYS 173          2HB       CYS 173   3.745   5.304   0.074
   12   2HB   CYS 173          1HB       CYS 173   2.982   3.712   0.230
   13    H    SER 174           H        SER 174   3.183   2.135  -2.484
   14    HA   SER 174           HA       SER 174   2.392   3.584  -4.858
   15   1HB   SER 174          1HB       SER 174   1.293   0.984  -3.606
   16   2HB   SER 174          2HB       SER 174   0.892   1.557  -5.229
   17    HG   SER 174           HG       SER 174   2.633   0.117  -5.223
   18    H    ILE 175           H        ILE 175   0.472   4.415  -5.461
   19    HA   ILE 175           HA       ILE 175  -1.228   5.769  -3.493
   20    HB   ILE 175           HB       ILE 175  -2.535   6.688  -5.342
   21   1HG1  ILE 175          1HG1      ILE 175  -0.596   5.701  -7.522
   22   2HG1  ILE 175          2HG1      ILE 175  -1.980   4.743  -7.102
   23   1HG2  ILE 175          1HG2      ILE 175   0.453   7.279  -5.628
   24   2HG2  ILE 175          2HG2      ILE 175  -0.654   7.959  -4.406
   25   3HG2  ILE 175          3HG2      ILE 175  -0.882   8.352  -6.127
   26   1HD1  ILE 175          1HD1      ILE 175  -3.572   6.544  -7.756
   27   2HD1  ILE 175          2HD1      ILE 175  -2.198   7.581  -8.228
   28   3HD1  ILE 175          3HD1      ILE 175  -2.499   6.048  -9.092
   29    H    CYS 176           H        CYS 176  -2.024   4.186  -2.344
   30    HA   CYS 176           HA       CYS 176  -4.466   2.627  -3.374
   31   1HB   CYS 176          1HB       CYS 176  -2.316   1.710  -1.371
   32   2HB   CYS 176          2HB       CYS 176  -3.888   0.924  -1.567
   33    H    SER 177           H        SER 177  -6.007   3.810  -2.607
   34    HA   SER 177           HA       SER 177  -5.990   5.307  -0.014
   35   1HB   SER 177          1HB       SER 177  -8.198   5.084  -2.099
   36   2HB   SER 177          2HB       SER 177  -8.245   6.121  -0.661
   37    HG   SER 177           HG       SER 177  -6.306   7.089  -1.393
   38    H    ASN 178           H        ASN 178  -7.995   2.553  -1.130
   39    HA   ASN 178           HA       ASN 178  -8.241   1.563   1.699
   40   1HB   ASN 178          1HB       ASN 178 -10.223   3.128   1.419
   41   2HB   ASN 178          2HB       ASN 178 -10.820   2.122   0.110
   42   1HD2  ASN 178          2HD2      ASN 178 -11.742   0.060   0.712
   43   2HD2  ASN 178          1HD2      ASN 178 -12.128  -0.336   2.461
   44    H    ASN 179           H        ASN 179  -7.061  -0.147   1.038
   45    HA   ASN 179           HA       ASN 179  -8.236  -2.288  -0.623
   46   1HB   ASN 179          1HB       ASN 179  -7.061  -0.886  -2.403
   47   2HB   ASN 179          2HB       ASN 179  -5.527  -1.196  -1.610
   48   1HD2  ASN 179          1HD2      ASN 179  -4.654  -3.357  -1.809
   49   2HD2  ASN 179          2HD2      ASN 179  -5.353  -4.559  -3.006
   50    HA   PRO 180           HA       PRO 180  -6.022  -3.529   3.371
   51   1HB   PRO 180          1HB       PRO 180  -7.297  -6.195   2.574
   52   2HB   PRO 180          2HB       PRO 180  -7.037  -5.540   4.210
   53   1HG   PRO 180          1HG       PRO 180  -9.476  -5.258   3.058
   54   2HG   PRO 180          2HG       PRO 180  -8.756  -3.861   3.907
   55   1HD   PRO 180          2HD       PRO 180  -8.909  -4.335   0.896
   56   2HD   PRO 180          1HD       PRO 180  -9.063  -2.808   1.809
   57    H    THR 181           H        THR 181  -5.544  -5.331   0.373
   58    HA   THR 181           HA       THR 181  -3.043  -6.630   1.371
   59    HB   THR 181           HB       THR 181  -2.698  -7.688  -0.714
   60    HG1  THR 181           1HG      THR 181  -4.113  -8.459   0.863
   61   1HG2  THR 181          1HG2      THR 181  -3.600  -6.149  -2.463
   62   2HG2  THR 181          2HG2      THR 181  -5.256  -6.421  -1.858
   63   3HG2  THR 181          3HG2      THR 181  -4.333  -7.772  -2.573
   64    H    CYS 182           H        CYS 182  -3.497  -4.207  -1.235
   65    HA   CYS 182           HA       CYS 182  -0.733  -3.524  -1.576
   66   1HB   CYS 182          1HB       CYS 182  -2.525  -2.901  -3.176
   67   2HB   CYS 182          2HB       CYS 182  -3.270  -1.826  -1.985
   68    H    TRP 183           H        TRP 183  -2.711  -2.388   1.038
   69    HA   TRP 183           HA       TRP 183  -1.060   0.029   1.565
   70   1HB   TRP 183          1HB       TRP 183  -3.739  -0.517   2.217
   71   2HB   TRP 183          2HB       TRP 183  -2.977  -0.819   3.752
   72    HD1  TRP 183           HD       TRP 183  -3.632   1.877   1.123
   73    HE1  TRP 183           1HE      TRP 183  -3.289   4.327   1.999
   74    HE3  TRP 183           3HE      TRP 183  -1.684   0.576   5.638
   75    HZ2  TRP 183           2HZ      TRP 183  -2.329   5.387   4.454
   76    HZ3  TRP 183           3HZ      TRP 183  -1.054   2.371   7.216
   77    HH2  TRP 183           HH       TRP 183  -1.370   4.730   6.633
   78    H    ALA 184           H        ALA 184  -1.381  -2.989   3.408
   79    HA   ALA 184           HA       ALA 184   0.719  -2.239   5.372
   80   1HB   ALA 184          1HB       ALA 184  -0.676  -4.929   4.811
   81   2HB   ALA 184          2HB       ALA 184  -1.197  -3.690   5.989
   82   3HB   ALA 184          3HB       ALA 184   0.331  -4.562   6.231
   83    H    ILE 185           H        ILE 185   1.546  -2.677   2.336
   84    HA   ILE 185           HA       ILE 185   4.146  -4.062   3.022
   85    HB   ILE 185           HB       ILE 185   2.719  -5.806   2.112
   86   1HG1  ILE 185          2HG1      ILE 185   4.420  -6.770   0.321
   87   2HG1  ILE 185          1HG1      ILE 185   5.275  -5.253   0.509
   88   1HG2  ILE 185          1HG2      ILE 185   2.103  -6.104  -0.249
   89   2HG2  ILE 185          2HG2      ILE 185   1.397  -4.596   0.380
   90   3HG2  ILE 185          3HG2      ILE 185   2.830  -4.527  -0.676
   91   1HD1  ILE 185          1HD1      ILE 185   6.292  -7.130   1.803
   92   2HD1  ILE 185          2HD1      ILE 185   5.707  -5.888   2.944
   93   3HD1  ILE 185          3HD1      ILE 185   4.770  -7.386   2.697
   94    H    CYS 186           H        CYS 186   4.901  -2.050   3.172
   95    HA   CYS 186           HA       CYS 186   5.792  -0.727   0.552
   96   1HB   CYS 186          1HB       CYS 186   3.961   0.687   1.496
   97   2HB   CYS 186          2HB       CYS 186   4.877   0.874   3.010
   98    H    LYS 187           H        LYS 187   7.899  -0.988   0.558
   99    HA   LYS 187           HA       LYS 187   9.652  -0.428   2.997
  100   1HB   LYS 187          2HB       LYS 187   9.808  -3.006   1.305
  101   2HB   LYS 187          1HB       LYS 187  11.152  -2.436   2.290
  102   1HG   LYS 187          1HG       LYS 187   9.781  -2.612   4.371
  103   2HG   LYS 187          2HG       LYS 187   8.400  -3.178   3.432
  104   1HD   LYS 187          1HD       LYS 187   9.730  -5.211   2.687
  105   2HD   LYS 187          2HD       LYS 187  11.116  -4.649   3.625
  106   1HE   LYS 187          1HE       LYS 187   9.759  -4.840   5.758
  107   2HE   LYS 187          2HE       LYS 187   8.365  -5.406   4.816
  108   1HZ   LYS 187          1HZ       LYS 187   9.644  -7.256   5.706
  109   2HZ   LYS 187          2HZ       LYS 187  11.018  -6.763   4.932
  110   3HZ   LYS 187          3HZ       LYS 187   9.720  -7.289   4.056
  Start of MODEL    8
    1   1H    PRO 172          1H        PRO 172  10.170   3.677  -0.972
    2    HA   PRO 172           HA       PRO 172   8.648   4.190  -2.491
    3   1HB   PRO 172          2HB       PRO 172   8.022   1.831  -3.989
    4   2HB   PRO 172          1HB       PRO 172   9.296   3.017  -4.312
    5   1HG   PRO 172          1HG       PRO 172   9.530   0.413  -2.738
    6   2HG   PRO 172          2HG       PRO 172  10.605   1.012  -4.037
    7   1HD   PRO 172          1HD       PRO 172  11.343   1.361  -1.439
    8   2HD   PRO 172          2HD       PRO 172  11.530   2.742  -2.561
    9    H    CYS 173           H        CYS 173   6.478   4.361  -2.351
   10    HA   CYS 173           HA       CYS 173   4.816   2.352  -0.732
   11   1HB   CYS 173          2HB       CYS 173   5.439   4.238   0.743
   12   2HB   CYS 173          1HB       CYS 173   4.797   5.410  -0.424
   13    H    SER 174           H        SER 174   3.213   1.713  -1.971
   14    HA   SER 174           HA       SER 174   2.491   2.826  -4.572
   15   1HB   SER 174          2HB       SER 174   2.489   0.379  -4.055
   16   2HB   SER 174          1HB       SER 174   1.182   0.611  -2.878
   17    HG   SER 174           HG       SER 174   1.100   1.231  -5.652
   18    H    ILE 175           H        ILE 175   0.723   3.912  -5.148
   19    HA   ILE 175           HA       ILE 175  -0.810   5.543  -3.234
   20    HB   ILE 175           HB       ILE 175  -1.984   6.495  -5.145
   21   1HG1  ILE 175          2HG1      ILE 175  -2.203   4.917  -6.852
   22   2HG1  ILE 175          1HG1      ILE 175  -1.480   6.357  -7.490
   23   1HG2  ILE 175          1HG2      ILE 175  -0.265   7.987  -5.964
   24   2HG2  ILE 175          2HG2      ILE 175   1.010   6.840  -5.469
   25   3HG2  ILE 175          3HG2      ILE 175  -0.021   7.620  -4.241
   26   1HD1  ILE 175          1HD1      ILE 175   0.756   5.150  -7.670
   27   2HD1  ILE 175          2HD1      ILE 175  -0.547   4.345  -8.586
   28   3HD1  ILE 175          3HD1      ILE 175  -0.014   3.678  -7.020
   29    H    CYS 176           H        CYS 176  -1.732   4.023  -2.018
   30    HA   CYS 176           HA       CYS 176  -4.357   2.765  -2.988
   31   1HB   CYS 176          2HB       CYS 176  -2.238   1.486  -1.159
   32   2HB   CYS 176          1HB       CYS 176  -3.888   0.877  -1.348
   33    H    SER 177           H        SER 177  -5.758   3.958  -2.009
   34    HA   SER 177           HA       SER 177  -5.439   5.256   0.671
   35   1HB   SER 177          2HB       SER 177  -6.493   6.493  -1.167
   36   2HB   SER 177          1HB       SER 177  -7.822   5.318  -1.226
   37    HG   SER 177           HG       SER 177  -8.295   7.135   0.053
   38    H    ASN 178           H        ASN 178  -7.691   2.717  -0.486
   39    HA   ASN 178           HA       ASN 178  -7.808   1.523   2.271
   40   1HB   ASN 178          1HB       ASN 178  -9.681   3.218   2.286
   41   2HB   ASN 178          2HB       ASN 178 -10.428   2.378   0.935
   42   1HD2  ASN 178          1HD2      ASN 178 -12.075   2.630   2.756
   43   2HD2  ASN 178          2HD2      ASN 178 -12.271   1.175   3.855
   44    H    ASN 179           H        ASN 179  -6.821  -0.212   1.408
   45    HA   ASN 179           HA       ASN 179  -8.273  -2.113  -0.337
   46   1HB   ASN 179          2HB       ASN 179  -7.062  -0.675  -2.062
   47   2HB   ASN 179          1HB       ASN 179  -5.525  -1.176  -1.377
   48   1HD2  ASN 179          2HD2      ASN 179  -4.857  -3.382  -1.785
   49   2HD2  ASN 179          1HD2      ASN 179  -5.713  -4.418  -3.034
   50    HA   PRO 180           HA       PRO 180  -6.045  -3.848   3.471
   51   1HB   PRO 180          1HB       PRO 180  -7.529  -6.327   2.443
   52   2HB   PRO 180          2HB       PRO 180  -7.174  -5.876   4.130
   53   1HG   PRO 180          1HG       PRO 180  -9.616  -5.294   3.102
   54   2HG   PRO 180          2HG       PRO 180  -8.770  -4.057   4.072
   55   1HD   PRO 180          1HD       PRO 180  -9.060  -4.170   1.041
   56   2HD   PRO 180          2HD       PRO 180  -9.036  -2.750   2.122
   57    H    THR 181           H        THR 181  -5.700  -5.319   0.294
   58    HA   THR 181           HA       THR 181  -3.277  -6.897   1.143
   59    HB   THR 181           HB       THR 181  -5.047  -7.762  -0.535
   60    HG1  THR 181           1HG      THR 181  -5.135  -5.808  -1.667
   61   1HG2  THR 181          1HG2      THR 181  -3.511  -8.903  -2.087
   62   2HG2  THR 181          2HG2      THR 181  -2.174  -7.820  -1.614
   63   3HG2  THR 181          3HG2      THR 181  -2.861  -8.960  -0.425
   64    H    CYS 182           H        CYS 182  -3.723  -4.322  -1.349
   65    HA   CYS 182           HA       CYS 182  -0.921  -3.643  -1.610
   66   1HB   CYS 182          1HB       CYS 182  -2.663  -3.011  -3.276
   67   2HB   CYS 182          2HB       CYS 182  -3.445  -1.942  -2.102
   68    H    TRP 183           H        TRP 183  -2.961  -2.641   0.982
   69    HA   TRP 183           HA       TRP 183  -1.516  -0.110   1.538
   70   1HB   TRP 183          2HB       TRP 183  -4.092  -0.840   2.207
   71   2HB   TRP 183          1HB       TRP 183  -3.324  -1.294   3.704
   72    HD1  TRP 183           HD       TRP 183  -4.122   1.662   1.403
   73    HE1  TRP 183           1HE      TRP 183  -3.751   4.005   2.478
   74    HE3  TRP 183           3HE      TRP 183  -1.999  -0.040   5.706
   75    HZ2  TRP 183           2HZ      TRP 183  -2.766   4.848   5.016
   76    HZ3  TRP 183           3HZ      TRP 183  -1.329   1.609   7.421
   77    HH2  TRP 183           HH       TRP 183  -1.705   4.006   7.081
   78    H    ALA 184           H        ALA 184  -1.177  -3.285   2.985
   79    HA   ALA 184           HA       ALA 184   0.391  -2.495   5.295
   80   1HB   ALA 184          1HB       ALA 184   1.007  -4.919   5.459
   81   2HB   ALA 184          2HB       ALA 184   0.442  -5.174   3.787
   82   3HB   ALA 184          3HB       ALA 184  -0.714  -4.727   5.069
   83    H    ILE 185           H        ILE 185   1.608  -2.559   2.101
   84    HA   ILE 185           HA       ILE 185   4.480  -2.600   3.129
   85    HB   ILE 185           HB       ILE 185   4.098  -4.610   1.832
   86   1HG1  ILE 185          1HG1      ILE 185   6.190  -4.402   0.212
   87   2HG1  ILE 185          2HG1      ILE 185   6.231  -2.719   0.696
   88   1HG2  ILE 185          1HG2      ILE 185   3.881  -4.756  -0.615
   89   2HG2  ILE 185          2HG2      ILE 185   2.512  -3.845   0.063
   90   3HG2  ILE 185          3HG2      ILE 185   3.833  -2.974  -0.754
   91   1HD1  ILE 185          1HD1      ILE 185   6.592  -5.191   2.528
   92   2HD1  ILE 185          2HD1      ILE 185   6.709  -3.498   3.079
   93   3HD1  ILE 185          3HD1      ILE 185   7.890  -4.137   1.905
   94    H    CYS 186           H        CYS 186   4.170  -0.513   3.612
   95    HA   CYS 186           HA       CYS 186   4.338   1.540   1.317
   96   1HB   CYS 186          2HB       CYS 186   2.144   1.672   2.490
   97   2HB   CYS 186          1HB       CYS 186   2.971   1.900   4.043
   98    H    LYS 187           H        LYS 187   6.341   2.236   1.318
   99    HA   LYS 187           HA       LYS 187   7.855   2.943   3.893
  100   1HB   LYS 187          1HB       LYS 187   8.619   0.682   2.775
  101   2HB   LYS 187          2HB       LYS 187   9.155   1.648   1.406
  102   1HG   LYS 187          2HG       LYS 187  10.740   2.894   3.022
  103   2HG   LYS 187          1HG       LYS 187  10.150   1.863   4.303
  104   1HD   LYS 187          2HD       LYS 187  12.139   0.828   3.809
  105   2HD   LYS 187          1HD       LYS 187  11.013  -0.204   2.957
  106   1HE   LYS 187          2HE       LYS 187  11.652   0.992   0.777
  107   2HE   LYS 187          1HE       LYS 187  12.798   1.990   1.689
  108   1HZ   LYS 187          1HZ       LYS 187  13.953  -0.060   2.358
  109   2HZ   LYS 187          2HZ       LYS 187  13.887   0.056   0.712
  110   3HZ   LYS 187          3HZ       LYS 187  12.883  -0.988   1.508
  Start of MODEL    9
    1   1H    PRO 172          1H        PRO 172   9.324   4.312  -1.840
    2    HA   PRO 172           HA       PRO 172   7.822   5.043  -3.286
    3   1HB   PRO 172          2HB       PRO 172   8.154   2.497  -4.998
    4   2HB   PRO 172          1HB       PRO 172   7.787   4.158  -5.531
    5   1HG   PRO 172          2HG       PRO 172  10.350   3.279  -5.630
    6   2HG   PRO 172          1HG       PRO 172  10.033   4.916  -4.993
    7   1HD   PRO 172          2HD       PRO 172  10.636   2.371  -3.431
    8   2HD   PRO 172          1HD       PRO 172  11.170   4.042  -3.091
    9    H    CYS 173           H        CYS 173   5.727   4.933  -2.793
   10    HA   CYS 173           HA       CYS 173   4.301   2.290  -2.215
   11   1HB   CYS 173          2HB       CYS 173   4.397   4.716  -0.327
   12   2HB   CYS 173          1HB       CYS 173   3.117   3.490  -0.253
   13    H    SER 174           H        SER 174   2.511   2.233  -3.342
   14    HA   SER 174           HA       SER 174   1.492   4.387  -5.027
   15   1HB   SER 174          2HB       SER 174   1.540   1.977  -5.705
   16   2HB   SER 174          1HB       SER 174   0.411   1.562  -4.398
   17    HG   SER 174           HG       SER 174  -0.607   1.885  -6.396
   18    H    ILE 175           H        ILE 175  -0.583   5.234  -5.017
   19    HA   ILE 175           HA       ILE 175  -1.673   6.080  -2.391
   20    HB   ILE 175           HB       ILE 175  -3.380   7.414  -3.762
   21   1HG1  ILE 175          2HG1      ILE 175  -2.745   8.205  -6.120
   22   2HG1  ILE 175          1HG1      ILE 175  -1.649   6.840  -6.218
   23   1HG2  ILE 175          1HG2      ILE 175  -1.384   8.426  -2.668
   24   2HG2  ILE 175          2HG2      ILE 175  -0.458   8.212  -4.173
   25   3HG2  ILE 175          3HG2      ILE 175  -1.862   9.313  -4.121
   26   1HD1  ILE 175          1HD1      ILE 175  -3.647   5.299  -6.193
   27   2HD1  ILE 175          2HD1      ILE 175  -3.789   6.534  -7.470
   28   3HD1  ILE 175          3HD1      ILE 175  -4.725   6.704  -5.960
   29    H    CYS 176           H        CYS 176  -2.116   4.051  -1.679
   30    HA   CYS 176           HA       CYS 176  -4.569   2.557  -2.586
   31   1HB   CYS 176          2HB       CYS 176  -2.404   1.926  -0.518
   32   2HB   CYS 176          1HB       CYS 176  -3.906   0.995  -0.666
   33    H    SER 177           H        SER 177  -6.128   3.884  -2.144
   34    HA   SER 177           HA       SER 177  -6.704   5.156   0.505
   35   1HB   SER 177          2HB       SER 177  -7.251   6.357  -1.556
   36   2HB   SER 177          1HB       SER 177  -8.427   5.107  -2.005
   37    HG   SER 177           HG       SER 177  -8.449   6.670   0.370
   38    H    ASN 178           H        ASN 178  -8.492   2.594  -1.262
   39    HA   ASN 178           HA       ASN 178  -9.141   1.239   1.342
   40   1HB   ASN 178          1HB       ASN 178 -11.508   1.066   1.183
   41   2HB   ASN 178          2HB       ASN 178 -11.009   2.736   1.292
   42   1HD2  ASN 178          2HD2      ASN 178 -12.640   0.413  -0.730
   43   2HD2  ASN 178          1HD2      ASN 178 -13.231   1.640  -1.961
   44    H    ASN 179           H        ASN 179  -7.706  -0.251   0.527
   45    HA   ASN 179           HA       ASN 179  -8.796  -2.397  -1.189
   46   1HB   ASN 179          1HB       ASN 179  -7.785  -0.852  -2.944
   47   2HB   ASN 179          2HB       ASN 179  -6.213  -1.060  -2.190
   48   1HD2  ASN 179          2HD2      ASN 179  -5.062  -2.487  -3.457
   49   2HD2  ASN 179          1HD2      ASN 179  -5.749  -3.971  -4.289
   50    HA   PRO 180           HA       PRO 180  -5.996  -3.509   2.435
   51   1HB   PRO 180          1HB       PRO 180  -7.275  -5.660   3.535
   52   2HB   PRO 180          2HB       PRO 180  -7.744  -3.962   3.777
   53   1HG   PRO 180          2HG       PRO 180  -8.938  -5.967   1.792
   54   2HG   PRO 180          1HG       PRO 180  -9.820  -4.920   2.941
   55   1HD   PRO 180          2HD       PRO 180  -9.467  -4.181   0.295
   56   2HD   PRO 180          1HD       PRO 180  -9.417  -2.961   1.595
   57    H    THR 181           H        THR 181  -4.532  -3.862   0.759
   58    HA   THR 181           HA       THR 181  -3.245  -6.449   0.856
   59    HB   THR 181           HB       THR 181  -2.935  -7.176  -1.419
   60    HG1  THR 181           1HG      THR 181  -4.977  -8.120  -1.523
   61   1HG2  THR 181          1HG2      THR 181  -3.586  -5.203  -2.828
   62   2HG2  THR 181          2HG2      THR 181  -5.273  -5.359  -2.268
   63   3HG2  THR 181          3HG2      THR 181  -4.535  -6.655  -3.247
   64    H    CYS 182           H        CYS 182  -3.033  -3.686  -1.455
   65    HA   CYS 182           HA       CYS 182  -0.124  -3.500  -1.200
   66   1HB   CYS 182          1HB       CYS 182  -0.390  -1.325  -2.499
   67   2HB   CYS 182          2HB       CYS 182  -1.152  -2.743  -3.209
   68    H    TRP 183           H        TRP 183  -2.396  -2.284   0.973
   69    HA   TRP 183           HA       TRP 183  -0.898   0.130   1.812
   70   1HB   TRP 183          2HB       TRP 183  -3.533  -0.368   2.052
   71   2HB   TRP 183          1HB       TRP 183  -3.071  -1.111   3.567
   72    HD1  TRP 183           HD       TRP 183  -2.970   2.220   1.630
   73    HE1  TRP 183           1HE      TRP 183  -3.031   4.323   3.173
   74    HE3  TRP 183           3HE      TRP 183  -2.505  -0.330   6.001
   75    HZ2  TRP 183           2HZ      TRP 183  -2.863   4.655   6.004
   76    HZ3  TRP 183           3HZ      TRP 183  -2.452   0.949   8.116
   77    HH2  TRP 183           HH       TRP 183  -2.627   3.394   8.116
   78    H    ALA 184           H        ALA 184  -1.066  -3.077   3.314
   79    HA   ALA 184           HA       ALA 184   0.458  -2.304   5.705
   80   1HB   ALA 184          1HB       ALA 184  -1.138  -4.198   5.724
   81   2HB   ALA 184          2HB       ALA 184  -0.090  -5.109   4.603
   82   3HB   ALA 184          3HB       ALA 184   0.476  -4.729   6.251
   83    H    ILE 185           H        ILE 185   1.736  -3.562   2.668
   84    HA   ILE 185           HA       ILE 185   4.500  -3.084   3.669
   85    HB   ILE 185           HB       ILE 185   4.160  -5.339   4.394
   86   1HG1  ILE 185          1HG1      ILE 185   6.374  -4.618   4.170
   87   2HG1  ILE 185          2HG1      ILE 185   6.277  -6.333   3.912
   88   1HG2  ILE 185          1HG2      ILE 185   4.086  -7.406   3.108
   89   2HG2  ILE 185          2HG2      ILE 185   2.673  -6.385   2.738
   90   3HG2  ILE 185          3HG2      ILE 185   4.020  -6.495   1.576
   91   1HD1  ILE 185          1HD1      ILE 185   6.829  -4.225   1.719
   92   2HD1  ILE 185          2HD1      ILE 185   8.018  -5.322   2.470
   93   3HD1  ILE 185          3HD1      ILE 185   6.728  -5.982   1.429
   94    H    CYS 186           H        CYS 186   4.623  -1.534   2.257
   95    HA   CYS 186           HA       CYS 186   4.484  -2.104  -0.766
   96   1HB   CYS 186          2HB       CYS 186   3.925   0.237  -1.133
   97   2HB   CYS 186          1HB       CYS 186   2.749  -0.535  -0.059
   98    H    LYS 187           H        LYS 187   6.465  -2.332  -1.462
   99    HA   LYS 187           HA       LYS 187   8.886  -0.906  -0.232
  100   1HB   LYS 187          2HB       LYS 187   8.704  -3.224  -2.258
  101   2HB   LYS 187          1HB       LYS 187  10.219  -2.417  -1.872
  102   1HG   LYS 187          1HG       LYS 187  10.047  -3.085   0.523
  103   2HG   LYS 187          2HG       LYS 187   8.516  -3.901   0.202
  104   1HD   LYS 187          1HD       LYS 187   9.687  -5.477  -1.410
  105   2HD   LYS 187          2HD       LYS 187  11.221  -4.663  -1.093
  106   1HE   LYS 187          1HE       LYS 187  11.086  -5.350   1.345
  107   2HE   LYS 187          2HE       LYS 187   9.546  -6.169   1.025
  108   1HZ   LYS 187          1HZ       LYS 187  12.141  -6.830  -0.287
  109   2HZ   LYS 187          2HZ       LYS 187  11.409  -7.707   0.907
  110   3HZ   LYS 187          3HZ       LYS 187  10.706  -7.593  -0.584
  Start of MODEL   10
    1   1H    PRO 172          1H        PRO 172   9.555   5.442  -0.883
    2    HA   PRO 172           HA       PRO 172   8.107   5.821  -2.510
    3   1HB   PRO 172          2HB       PRO 172   9.079   3.314  -4.025
    4   2HB   PRO 172          1HB       PRO 172   8.472   4.854  -4.690
    5   1HG   PRO 172          1HG       PRO 172  11.149   4.469  -4.489
    6   2HG   PRO 172          2HG       PRO 172  10.472   6.042  -3.985
    7   1HD   PRO 172          1HD       PRO 172  11.363   3.724  -2.222
    8   2HD   PRO 172          2HD       PRO 172  11.539   5.478  -1.933
    9    H    CYS 173           H        CYS 173   6.013   5.330  -2.258
   10    HA   CYS 173           HA       CYS 173   5.054   2.494  -1.643
   11   1HB   CYS 173          2HB       CYS 173   4.312   4.991  -0.001
   12   2HB   CYS 173          1HB       CYS 173   3.507   3.412   0.124
   13    H    SER 174           H        SER 174   3.309   2.046  -2.792
   14    HA   SER 174           HA       SER 174   2.166   3.801  -4.801
   15   1HB   SER 174          1HB       SER 174   2.493   1.337  -5.091
   16   2HB   SER 174          2HB       SER 174   1.307   1.008  -3.811
   17    HG   SER 174           HG       SER 174   0.843   2.428  -6.228
   18    H    ILE 175           H        ILE 175   0.126   4.519  -5.002
   19    HA   ILE 175           HA       ILE 175  -1.252   5.550  -2.602
   20    HB   ILE 175           HB       ILE 175  -0.926   6.984  -4.522
   21   1HG1  ILE 175          1HG1      ILE 175  -3.292   8.152  -4.550
   22   2HG1  ILE 175          2HG1      ILE 175  -3.830   6.814  -3.553
   23   1HG2  ILE 175          1HG2      ILE 175  -2.313   7.062  -6.547
   24   2HG2  ILE 175          2HG2      ILE 175  -3.231   5.621  -6.023
   25   3HG2  ILE 175          3HG2      ILE 175  -1.504   5.483  -6.431
   26   1HD1  ILE 175          1HD1      ILE 175  -2.199   7.599  -1.755
   27   2HD1  ILE 175          2HD1      ILE 175  -3.335   8.883  -2.247
   28   3HD1  ILE 175          3HD1      ILE 175  -1.654   8.903  -2.845
   29    H    CYS 176           H        CYS 176  -1.757   3.716  -1.655
   30    HA   CYS 176           HA       CYS 176  -3.871   1.780  -2.623
   31   1HB   CYS 176          2HB       CYS 176  -1.729   1.108  -1.361
   32   2HB   CYS 176          1HB       CYS 176  -2.458   1.845   0.081
   33    H    SER 177           H        SER 177  -5.476   3.255  -2.768
   34    HA   SER 177           HA       SER 177  -6.610   4.822  -0.516
   35   1HB   SER 177          2HB       SER 177  -6.625   5.735  -2.766
   36   2HB   SER 177          1HB       SER 177  -7.722   4.453  -3.317
   37    HG   SER 177           HG       SER 177  -8.808   6.354  -2.711
   38    H    ASN 178           H        ASN 178  -8.283   2.182  -2.301
   39    HA   ASN 178           HA       ASN 178  -9.475   1.199   0.303
   40   1HB   ASN 178          2HB       ASN 178 -11.080   2.969  -0.557
   41   2HB   ASN 178          1HB       ASN 178 -11.357   2.000  -1.993
   42   1HD2  ASN 178          2HD2      ASN 178 -12.629   0.052  -1.713
   43   2HD2  ASN 178          1HD2      ASN 178 -13.587  -0.237  -0.176
   44    H    ASN 179           H        ASN 179  -8.101  -0.509  -0.092
   45    HA   ASN 179           HA       ASN 179  -9.143  -2.773  -1.590
   46   1HB   ASN 179          1HB       ASN 179  -7.864  -1.607  -3.492
   47   2HB   ASN 179          2HB       ASN 179  -6.368  -1.878  -2.613
   48   1HD2  ASN 179          2HD2      ASN 179  -5.551  -4.048  -2.593
   49   2HD2  ASN 179          1HD2      ASN 179  -6.286  -5.372  -3.629
   50    HA   PRO 180           HA       PRO 180  -6.649  -3.425   2.353
   51   1HB   PRO 180          2HB       PRO 180  -8.021  -5.423   3.614
   52   2HB   PRO 180          1HB       PRO 180  -8.521  -3.718   3.568
   53   1HG   PRO 180          1HG       PRO 180  -9.501  -6.002   1.776
   54   2HG   PRO 180          2HG       PRO 180 -10.501  -4.828   2.680
   55   1HD   PRO 180          2HD       PRO 180  -9.894  -4.449   0.003
   56   2HD   PRO 180          1HD       PRO 180  -9.983  -3.061   1.122
   57    H    THR 181           H        THR 181  -5.100  -3.991   0.740
   58    HA   THR 181           HA       THR 181  -3.742  -6.490   1.373
   59    HB   THR 181           HB       THR 181  -5.322  -7.219  -0.579
   60    HG1  THR 181           1HG      THR 181  -4.888  -5.398  -1.833
   61   1HG2  THR 181          1HG2      THR 181  -2.331  -7.758  -1.030
   62   2HG2  THR 181          2HG2      THR 181  -3.405  -8.690   0.052
   63   3HG2  THR 181          3HG2      THR 181  -3.690  -8.698  -1.712
   64    H    CYS 182           H        CYS 182  -3.567  -3.994  -1.237
   65    HA   CYS 182           HA       CYS 182  -0.705  -3.724  -1.151
   66   1HB   CYS 182          2HB       CYS 182  -1.059  -1.643  -2.519
   67   2HB   CYS 182          1HB       CYS 182  -1.963  -3.045  -3.079
   68    H    TRP 183           H        TRP 183  -2.637  -2.492   1.285
   69    HA   TRP 183           HA       TRP 183  -1.117  -0.032   1.819
   70   1HB   TRP 183          1HB       TRP 183  -3.639  -0.700   2.603
   71   2HB   TRP 183          2HB       TRP 183  -2.817  -1.259   4.042
   72    HD1  TRP 183           HD       TRP 183  -3.670   1.844   1.979
   73    HE1  TRP 183           1HE      TRP 183  -3.075   4.115   3.118
   74    HE3  TRP 183           3HE      TRP 183  -1.281  -0.161   6.000
   75    HZ2  TRP 183           2HZ      TRP 183  -1.863   4.785   5.602
   76    HZ3  TRP 183           3HZ      TRP 183  -0.388   1.368   7.725
   77    HH2  TRP 183           HH       TRP 183  -0.673   3.794   7.527
   78    H    ALA 184           H        ALA 184  -0.799  -3.186   3.384
   79    HA   ALA 184           HA       ALA 184   1.101  -2.296   5.431
   80   1HB   ALA 184          1HB       ALA 184   0.648  -5.131   4.339
   81   2HB   ALA 184          2HB       ALA 184  -0.267  -4.370   5.668
   82   3HB   ALA 184          3HB       ALA 184   1.461  -4.726   5.874
   83    H    ILE 185           H        ILE 185   1.848  -3.035   2.148
   84    HA   ILE 185           HA       ILE 185   4.768  -3.575   2.805
   85    HB   ILE 185           HB       ILE 185   3.742  -5.243   1.375
   86   1HG1  ILE 185          1HG1      ILE 185   5.628  -5.348  -0.479
   87   2HG1  ILE 185          2HG1      ILE 185   6.158  -3.802   0.152
   88   1HG2  ILE 185          1HG2      ILE 185   3.237  -4.991  -1.021
   89   2HG2  ILE 185          2HG2      ILE 185   3.644  -3.251  -0.963
   90   3HG2  ILE 185          3HG2      ILE 185   2.235  -3.874  -0.069
   91   1HD1  ILE 185          1HD1      ILE 185   7.513  -5.726   0.983
   92   2HD1  ILE 185          2HD1      ILE 185   6.674  -4.967   2.363
   93   3HD1  ILE 185          3HD1      ILE 185   6.061  -6.497   1.677
   94    H    CYS 186           H        CYS 186   4.829  -1.489   3.592
   95    HA   CYS 186           HA       CYS 186   5.698   0.617   1.523
   96   1HB   CYS 186          2HB       CYS 186   3.458   1.252   2.399
   97   2HB   CYS 186          1HB       CYS 186   4.075   1.218   4.064
   98    H    LYS 187           H        LYS 187   7.781   0.852   1.847
   99    HA   LYS 187           HA       LYS 187   9.023   1.149   4.627
  100   1HB   LYS 187          1HB       LYS 187  10.061  -0.757   2.463
  101   2HB   LYS 187          2HB       LYS 187  11.092  -0.196   3.749
  102   1HG   LYS 187          2HG       LYS 187   8.494  -1.778   4.265
  103   2HG   LYS 187          1HG       LYS 187  10.038  -2.540   3.922
  104   1HD   LYS 187          2HD       LYS 187  11.067  -1.496   5.966
  105   2HD   LYS 187          1HD       LYS 187   9.541  -0.693   6.337
  106   1HE   LYS 187          1HE       LYS 187   8.412  -2.948   6.609
  107   2HE   LYS 187          2HE       LYS 187   9.946  -3.758   6.235
  108   1HZ   LYS 187          1HZ       LYS 187  10.933  -2.647   8.173
  109   2HZ   LYS 187          2HZ       LYS 187   9.505  -1.893   8.521
  110   3HZ   LYS 187          3HZ       LYS 187   9.618  -3.538   8.624
  Start of MODEL   11
    1   1H    PRO 172          1H        PRO 172   9.942   4.871  -1.090
    2    HA   PRO 172           HA       PRO 172   8.486   4.879  -2.753
    3   1HB   PRO 172          1HB       PRO 172   8.935   1.861  -3.225
    4   2HB   PRO 172          2HB       PRO 172   8.557   3.132  -4.416
    5   1HG   PRO 172          2HG       PRO 172  11.138   2.381  -4.066
    6   2HG   PRO 172          1HG       PRO 172  10.765   4.122  -4.186
    7   1HD   PRO 172          1HD       PRO 172  11.357   2.492  -1.683
    8   2HD   PRO 172          2HD       PRO 172  11.840   4.168  -2.062
    9    H    CYS 173           H        CYS 173   6.368   4.899  -2.344
   10    HA   CYS 173           HA       CYS 173   5.001   2.730  -0.657
   11   1HB   CYS 173          1HB       CYS 173   5.483   4.659   0.803
   12   2HB   CYS 173          2HB       CYS 173   4.702   5.772  -0.334
   13    H    SER 174           H        SER 174   3.452   1.910  -1.862
   14    HA   SER 174           HA       SER 174   2.500   2.970  -4.416
   15   1HB   SER 174          1HB       SER 174   2.816   0.531  -3.955
   16   2HB   SER 174          2HB       SER 174   1.537   0.582  -2.728
   17    HG   SER 174           HG       SER 174   0.112   1.279  -4.383
   18    H    ILE 175           H        ILE 175   0.619   3.894  -4.878
   19    HA   ILE 175           HA       ILE 175  -1.046   5.225  -2.841
   20    HB   ILE 175           HB       ILE 175  -2.411   6.138  -4.642
   21   1HG1  ILE 175          1HG1      ILE 175  -0.519   5.206  -6.885
   22   2HG1  ILE 175          2HG1      ILE 175  -1.877   4.223  -6.436
   23   1HG2  ILE 175          1HG2      ILE 175  -0.810   7.842  -5.458
   24   2HG2  ILE 175          2HG2      ILE 175  -0.529   7.437  -3.747
   25   3HG2  ILE 175          3HG2      ILE 175   0.557   6.787  -5.005
   26   1HD1  ILE 175          1HD1      ILE 175  -3.512   6.006  -7.029
   27   2HD1  ILE 175          2HD1      ILE 175  -2.167   7.067  -7.530
   28   3HD1  ILE 175          3HD1      ILE 175  -2.469   5.538  -8.399
   29    H    CYS 176           H        CYS 176  -1.680   3.473  -1.721
   30    HA   CYS 176           HA       CYS 176  -3.679   1.478  -2.740
   31   1HB   CYS 176          2HB       CYS 176  -1.770   0.978  -1.083
   32   2HB   CYS 176          1HB       CYS 176  -2.736   1.840   0.133
   33    H    SER 177           H        SER 177  -5.242   2.839  -3.307
   34    HA   SER 177           HA       SER 177  -6.822   4.555  -1.342
   35   1HB   SER 177          1HB       SER 177  -6.222   5.567  -3.473
   36   2HB   SER 177          2HB       SER 177  -7.092   4.292  -4.363
   37    HG   SER 177           HG       SER 177  -8.345   6.161  -4.020
   38    H    ASN 178           H        ASN 178  -7.774   3.126  -0.196
   39    HA   ASN 178           HA       ASN 178  -9.224   1.515   0.700
   40   1HB   ASN 178          2HB       ASN 178 -10.782   3.328  -0.018
   41   2HB   ASN 178          1HB       ASN 178 -11.164   2.423  -1.469
   42   1HD2  ASN 178          1HD2      ASN 178 -12.467   0.486  -1.184
   43   2HD2  ASN 178          2HD2      ASN 178 -13.387   0.204   0.378
   44    H    ASN 179           H        ASN 179  -7.858  -0.206   0.279
   45    HA   ASN 179           HA       ASN 179  -8.985  -2.493  -1.103
   46   1HB   ASN 179          2HB       ASN 179  -7.851  -1.433  -3.110
   47   2HB   ASN 179          1HB       ASN 179  -6.299  -1.591  -2.310
   48   1HD2  ASN 179          2HD2      ASN 179  -5.405  -3.746  -2.156
   49   2HD2  ASN 179          1HD2      ASN 179  -6.115  -5.143  -3.112
   50    HA   PRO 180           HA       PRO 180  -6.535  -3.076   2.892
   51   1HB   PRO 180          2HB       PRO 180  -7.422  -5.650   3.658
   52   2HB   PRO 180          1HB       PRO 180  -8.222  -4.107   3.988
   53   1HG   PRO 180          1HG       PRO 180  -8.722  -6.007   1.640
   54   2HG   PRO 180          2HG       PRO 180  -9.931  -5.328   2.766
   55   1HD   PRO 180          2HD       PRO 180  -9.539  -4.143   0.334
   56   2HD   PRO 180          1HD       PRO 180  -9.704  -3.096   1.774
   57    H    THR 181           H        THR 181  -6.129  -5.121   0.131
   58    HA   THR 181           HA       THR 181  -3.835  -6.677   1.265
   59    HB   THR 181           HB       THR 181  -4.905  -6.520  -1.598
   60    HG1  THR 181           1HG      THR 181  -2.674  -6.875  -1.538
   61   1HG2  THR 181          1HG2      THR 181  -4.868  -8.924   0.344
   62   2HG2  THR 181          2HG2      THR 181  -5.465  -8.939  -1.337
   63   3HG2  THR 181          3HG2      THR 181  -6.317  -7.982  -0.097
   64    H    CYS 182           H        CYS 182  -3.878  -4.004  -1.218
   65    HA   CYS 182           HA       CYS 182  -0.972  -3.839  -1.314
   66   1HB   CYS 182          1HB       CYS 182  -1.322  -1.731  -2.598
   67   2HB   CYS 182          2HB       CYS 182  -2.288  -3.089  -3.166
   68    H    TRP 183           H        TRP 183  -2.816  -2.666   1.222
   69    HA   TRP 183           HA       TRP 183  -1.227  -0.261   1.820
   70   1HB   TRP 183          1HB       TRP 183  -3.738  -0.931   2.645
   71   2HB   TRP 183          2HB       TRP 183  -2.891  -1.578   4.028
   72    HD1  TRP 183           HD       TRP 183  -3.731   1.650   2.144
   73    HE1  TRP 183           1HE      TRP 183  -3.115   3.844   3.419
   74    HE3  TRP 183           3HE      TRP 183  -1.333  -0.613   6.024
   75    HZ2  TRP 183           2HZ      TRP 183  -1.873   4.353   5.924
   76    HZ3  TRP 183           3HZ      TRP 183  -0.419   0.803   7.831
   77    HH2  TRP 183           HH       TRP 183  -0.684   3.239   7.780
   78    H    ALA 184           H        ALA 184  -0.789  -3.521   3.023
   79    HA   ALA 184           HA       ALA 184   0.939  -2.913   5.277
   80   1HB   ALA 184          1HB       ALA 184   0.807  -5.446   3.532
   81   2HB   ALA 184          2HB       ALA 184  -0.206  -5.105   4.962
   82   3HB   ALA 184          3HB       ALA 184   1.541  -5.357   5.154
   83    H    ILE 185           H        ILE 185   1.912  -2.338   2.132
   84    HA   ILE 185           HA       ILE 185   4.841  -2.462   2.926
   85    HB   ILE 185           HB       ILE 185   4.433  -4.426   1.554
   86   1HG1  ILE 185          1HG1      ILE 185   6.434  -4.086  -0.160
   87   2HG1  ILE 185          2HG1      ILE 185   6.461  -2.429   0.409
   88   1HG2  ILE 185          1HG2      ILE 185   4.096  -4.462  -0.882
   89   2HG2  ILE 185          2HG2      ILE 185   3.997  -2.678  -0.931
   90   3HG2  ILE 185          3HG2      ILE 185   2.743  -3.622  -0.091
   91   1HD1  ILE 185          1HD1      ILE 185   8.214  -3.864   1.457
   92   2HD1  ILE 185          2HD1      ILE 185   7.081  -3.315   2.721
   93   3HD1  ILE 185          3HD1      ILE 185   6.974  -4.979   2.090
   94    H    CYS 186           H        CYS 186   4.525  -0.413   3.523
   95    HA   CYS 186           HA       CYS 186   4.557   1.741   1.321
   96   1HB   CYS 186          2HB       CYS 186   2.358   1.764   2.494
   97   2HB   CYS 186          1HB       CYS 186   3.175   1.944   4.058
   98    H    LYS 187           H        LYS 187   6.535   2.516   1.362
   99    HA   LYS 187           HA       LYS 187   8.256   2.637   3.909
  100   1HB   LYS 187          2HB       LYS 187   9.026   2.861   0.930
  101   2HB   LYS 187          1HB       LYS 187  10.145   3.244   2.232
  102   1HG   LYS 187          2HG       LYS 187  10.011   0.918   3.124
  103   2HG   LYS 187          1HG       LYS 187   8.873   0.477   1.850
  104   1HD   LYS 187          1HD       LYS 187  10.633   0.995   0.091
  105   2HD   LYS 187          2HD       LYS 187  11.775   1.438   1.363
  106   1HE   LYS 187          1HE       LYS 187  11.678  -0.925   2.279
  107   2HE   LYS 187          2HE       LYS 187  10.531  -1.370   1.002
  108   1HZ   LYS 187          1HZ       LYS 187  13.296  -0.352   0.542
  109   2HZ   LYS 187          2HZ       LYS 187  12.804  -1.921   0.383
  110   3HZ   LYS 187          3HZ       LYS 187  12.227  -0.767  -0.648
  Start of MODEL   12
    1   1H    PRO 172          1H        PRO 172   9.213   1.797  -2.266
    2    HA   PRO 172           HA       PRO 172   8.399   4.489  -2.861
    3   1HB   PRO 172          1HB       PRO 172   7.974   2.394  -5.082
    4   2HB   PRO 172          2HB       PRO 172   7.918   4.171  -5.194
    5   1HG   PRO 172          1HG       PRO 172  10.195   2.882  -5.898
    6   2HG   PRO 172          2HG       PRO 172  10.326   4.351  -4.890
    7   1HD   PRO 172          1HD       PRO 172  10.502   1.435  -4.007
    8   2HD   PRO 172          2HD       PRO 172  11.472   2.826  -3.447
    9    H    CYS 173           H        CYS 173   6.371   4.634  -2.106
   10    HA   CYS 173           HA       CYS 173   4.876   2.173  -1.134
   11   1HB   CYS 173          2HB       CYS 173   4.521   5.155  -0.476
   12   2HB   CYS 173          1HB       CYS 173   3.474   3.855   0.128
   13    H    SER 174           H        SER 174   3.146   1.556  -2.165
   14    HA   SER 174           HA       SER 174   2.172   2.637  -4.672
   15   1HB   SER 174          1HB       SER 174   0.558   0.755  -4.599
   16   2HB   SER 174          2HB       SER 174   2.192   0.222  -4.188
   17    HG   SER 174           HG       SER 174   1.591   0.392  -1.976
   18    H    ILE 175           H        ILE 175   0.387   3.672  -5.147
   19    HA   ILE 175           HA       ILE 175  -0.976   5.388  -3.179
   20    HB   ILE 175           HB       ILE 175  -0.308   6.283  -5.323
   21   1HG1  ILE 175          2HG1      ILE 175  -2.456   7.728  -5.836
   22   2HG1  ILE 175          1HG1      ILE 175  -3.259   6.742  -4.631
   23   1HG2  ILE 175          1HG2      ILE 175  -0.988   4.477  -6.906
   24   2HG2  ILE 175          2HG2      ILE 175  -2.695   4.942  -6.709
   25   3HG2  ILE 175          3HG2      ILE 175  -1.531   6.084  -7.442
   26   1HD1  ILE 175          1HD1      ILE 175  -0.835   8.618  -4.183
   27   2HD1  ILE 175          2HD1      ILE 175  -1.645   7.687  -2.894
   28   3HD1  ILE 175          3HD1      ILE 175  -2.534   8.967  -3.765
   29    H    CYS 176           H        CYS 176  -1.874   3.982  -1.881
   30    HA   CYS 176           HA       CYS 176  -4.568   2.709  -2.626
   31   1HB   CYS 176          2HB       CYS 176  -2.356   1.445  -0.904
   32   2HB   CYS 176          1HB       CYS 176  -4.050   0.936  -0.839
   33    H    SER 177           H        SER 177  -5.930   3.894  -1.638
   34    HA   SER 177           HA       SER 177  -5.517   5.273   1.016
   35   1HB   SER 177          2HB       SER 177  -7.629   6.408   0.630
   36   2HB   SER 177          1HB       SER 177  -6.580   6.536  -0.796
   37    HG   SER 177           HG       SER 177  -8.669   4.645  -0.397
   38    H    ASN 178           H        ASN 178  -7.835   2.808  -0.158
   39    HA   ASN 178           HA       ASN 178  -7.834   1.475   2.531
   40   1HB   ASN 178          2HB       ASN 178 -10.196   1.358   2.924
   41   2HB   ASN 178          1HB       ASN 178  -9.624   3.014   2.965
   42   1HD2  ASN 178          1HD2      ASN 178 -12.116   2.948   2.959
   43   2HD2  ASN 178          2HD2      ASN 178 -12.882   3.249   1.318
   44    H    ASN 179           H        ASN 179  -6.789  -0.134   1.457
   45    HA   ASN 179           HA       ASN 179  -8.346  -2.032  -0.234
   46   1HB   ASN 179          2HB       ASN 179  -7.289  -0.437  -1.958
   47   2HB   ASN 179          1HB       ASN 179  -5.712  -0.973  -1.402
   48   1HD2  ASN 179          1HD2      ASN 179  -8.566  -1.923  -3.211
   49   2HD2  ASN 179          2HD2      ASN 179  -7.836  -3.465  -3.887
   50    HA   PRO 180           HA       PRO 180  -5.825  -3.780   3.400
   51   1HB   PRO 180          2HB       PRO 180  -7.426  -6.224   2.440
   52   2HB   PRO 180          1HB       PRO 180  -6.912  -5.825   4.099
   53   1HG   PRO 180          2HG       PRO 180  -9.426  -5.187   3.313
   54   2HG   PRO 180          1HG       PRO 180  -8.480  -3.985   4.235
   55   1HD   PRO 180          1HD       PRO 180  -9.049  -4.015   1.244
   56   2HD   PRO 180          2HD       PRO 180  -8.896  -2.623   2.351
   57    H    THR 181           H        THR 181  -5.625  -5.041   0.149
   58    HA   THR 181           HA       THR 181  -3.306  -6.859   0.844
   59    HB   THR 181           HB       THR 181  -4.696  -6.361  -1.833
   60    HG1  THR 181           1HG      THR 181  -2.499  -8.035  -1.219
   61   1HG2  THR 181          1HG2      THR 181  -4.438  -8.982  -0.215
   62   2HG2  THR 181          2HG2      THR 181  -5.224  -8.802  -1.806
   63   3HG2  THR 181          3HG2      THR 181  -5.927  -8.013  -0.368
   64    H    CYS 182           H        CYS 182  -3.498  -4.080  -1.515
   65    HA   CYS 182           HA       CYS 182  -0.578  -3.719  -1.432
   66   1HB   CYS 182          1HB       CYS 182  -0.988  -1.688  -2.823
   67   2HB   CYS 182          2HB       CYS 182  -1.830  -3.122  -3.417
   68    H    TRP 183           H        TRP 183  -2.810  -2.615   0.823
   69    HA   TRP 183           HA       TRP 183  -1.478  -0.059   1.513
   70   1HB   TRP 183          1HB       TRP 183  -4.052  -0.792   1.947
   71   2HB   TRP 183          2HB       TRP 183  -3.418  -1.413   3.453
   72    HD1  TRP 183           HD       TRP 183  -4.104   1.761   1.468
   73    HE1  TRP 183           1HE      TRP 183  -3.875   3.974   2.836
   74    HE3  TRP 183           3HE      TRP 183  -2.192  -0.392   5.662
   75    HZ2  TRP 183           2HZ      TRP 183  -3.033   4.532   5.499
   76    HZ3  TRP 183           3HZ      TRP 183  -1.671   1.054   7.598
   77    HH2  TRP 183           HH       TRP 183  -2.084   3.468   7.517
   78    H    ALA 184           H        ALA 184  -1.308  -3.228   3.084
   79    HA   ALA 184           HA       ALA 184   0.369  -2.283   5.350
   80   1HB   ALA 184          1HB       ALA 184  -1.225  -4.164   5.602
   81   2HB   ALA 184          2HB       ALA 184   0.429  -4.719   5.935
   82   3HB   ALA 184          3HB       ALA 184  -0.336  -5.121   4.381
   83    H    ILE 185           H        ILE 185   1.578  -2.057   2.474
   84    HA   ILE 185           HA       ILE 185   4.337  -2.995   3.297
   85    HB   ILE 185           HB       ILE 185   3.434  -4.772   1.903
   86   1HG1  ILE 185          2HG1      ILE 185   5.487  -5.002   0.238
   87   2HG1  ILE 185          1HG1      ILE 185   5.962  -3.416   0.813
   88   1HG2  ILE 185          1HG2      ILE 185   3.153  -4.706  -0.540
   89   2HG2  ILE 185          2HG2      ILE 185   2.071  -3.524   0.230
   90   3HG2  ILE 185          3HG2      ILE 185   3.557  -2.965  -0.576
   91   1HD1  ILE 185          1HD1      ILE 185   5.708  -6.004   2.497
   92   2HD1  ILE 185          2HD1      ILE 185   7.223  -5.279   1.895
   93   3HD1  ILE 185          3HD1      ILE 185   6.259  -4.432   3.135
   94    H    CYS 186           H        CYS 186   4.549  -0.924   3.915
   95    HA   CYS 186           HA       CYS 186   5.444   1.045   1.745
   96   1HB   CYS 186          2HB       CYS 186   3.183   1.779   2.482
   97   2HB   CYS 186          1HB       CYS 186   3.732   1.859   4.166
   98    H    LYS 187           H        LYS 187   7.504   1.353   2.144
   99    HA   LYS 187           HA       LYS 187   8.750   1.036   4.920
  100   1HB   LYS 187          2HB       LYS 187   9.617  -0.257   2.793
  101   2HB   LYS 187          1HB       LYS 187  10.153   1.294   2.214
  102   1HG   LYS 187          2HG       LYS 187  12.093   0.376   3.060
  103   2HG   LYS 187          1HG       LYS 187  11.632   1.493   4.335
  104   1HD   LYS 187          2HD       LYS 187  10.674  -0.481   5.657
  105   2HD   LYS 187          1HD       LYS 187  11.172  -1.570   4.363
  106   1HE   LYS 187          1HE       LYS 187  13.597  -0.931   4.755
  107   2HE   LYS 187          2HE       LYS 187  13.095   0.164   6.057
  108   1HZ   LYS 187          1HZ       LYS 187  12.605  -2.778   6.006
  109   2HZ   LYS 187          2HZ       LYS 187  13.742  -2.003   6.921
  110   3HZ   LYS 187          3HZ       LYS 187  12.136  -1.759   7.219
  Start of MODEL   13
    1   1H    PRO 172          1H        PRO 172   9.799   4.617  -2.296
    2    HA   PRO 172           HA       PRO 172   8.027   6.303  -3.805
    3   1HB   PRO 172          2HB       PRO 172   8.891   3.662  -5.138
    4   2HB   PRO 172          1HB       PRO 172   8.105   5.081  -5.873
    5   1HG   PRO 172          1HG       PRO 172  10.794   4.817  -6.078
    6   2HG   PRO 172          2HG       PRO 172  10.126   6.418  -5.657
    7   1HD   PRO 172          1HD       PRO 172  11.380   4.351  -3.797
    8   2HD   PRO 172          2HD       PRO 172  11.564   6.126  -3.768
    9    H    CYS 173           H        CYS 173   6.043   5.752  -3.138
   10    HA   CYS 173           HA       CYS 173   5.407   2.990  -1.991
   11   1HB   CYS 173          1HB       CYS 173   5.922   4.576  -0.089
   12   2HB   CYS 173          2HB       CYS 173   4.591   5.624  -0.611
   13    H    SER 174           H        SER 174   3.543   2.284  -2.776
   14    HA   SER 174           HA       SER 174   2.016   3.632  -4.825
   15   1HB   SER 174          1HB       SER 174   2.392   1.162  -4.731
   16   2HB   SER 174          2HB       SER 174   1.386   1.053  -3.276
   17    HG   SER 174           HG       SER 174   0.588   2.030  -5.825
   18    H    ILE 175           H        ILE 175   0.194   4.646  -4.741
   19    HA   ILE 175           HA       ILE 175  -1.064   5.653  -2.240
   20    HB   ILE 175           HB       ILE 175  -2.040   6.169  -5.055
   21   1HG1  ILE 175          1HG1      ILE 175  -0.434   8.321  -3.461
   22   2HG1  ILE 175          2HG1      ILE 175   0.404   7.113  -4.370
   23   1HG2  ILE 175          1HG2      ILE 175  -3.342   8.126  -4.145
   24   2HG2  ILE 175          2HG2      ILE 175  -3.833   6.619  -3.341
   25   3HG2  ILE 175          3HG2      ILE 175  -2.756   7.764  -2.499
   26   1HD1  ILE 175          1HD1      ILE 175  -0.592   7.820  -6.521
   27   2HD1  ILE 175          2HD1      ILE 175   0.297   9.130  -5.700
   28   3HD1  ILE 175          3HD1      ILE 175  -1.486   9.114  -5.681
   29    H    CYS 176           H        CYS 176  -1.715   3.828  -1.342
   30    HA   CYS 176           HA       CYS 176  -3.653   1.844  -2.480
   31   1HB   CYS 176          1HB       CYS 176  -1.714   1.265  -0.925
   32   2HB   CYS 176          2HB       CYS 176  -2.645   2.024   0.386
   33    H    SER 177           H        SER 177  -5.293   3.165  -2.900
   34    HA   SER 177           HA       SER 177  -6.946   4.585  -0.770
   35   1HB   SER 177          2HB       SER 177  -6.442   5.827  -2.802
   36   2HB   SER 177          1HB       SER 177  -7.245   4.587  -3.800
   37    HG   SER 177           HG       SER 177  -8.427   6.098  -1.703
   38    H    ASN 178           H        ASN 178  -7.818   3.021   0.241
   39    HA   ASN 178           HA       ASN 178  -9.124   1.212   0.972
   40   1HB   ASN 178          1HB       ASN 178 -11.437   1.278   0.557
   41   2HB   ASN 178          2HB       ASN 178 -10.770   2.889   0.743
   42   1HD2  ASN 178          2HD2      ASN 178 -13.071   3.081  -0.103
   43   2HD2  ASN 178          1HD2      ASN 178 -13.237   3.288  -1.919
   44    H    ASN 179           H        ASN 179  -7.667  -0.346   0.271
   45    HA   ASN 179           HA       ASN 179  -8.823  -2.539  -1.312
   46   1HB   ASN 179          1HB       ASN 179  -7.677  -1.179  -3.166
   47   2HB   ASN 179          2HB       ASN 179  -6.144  -1.480  -2.370
   48   1HD2  ASN 179          2HD2      ASN 179  -8.696  -2.950  -4.272
   49   2HD2  ASN 179          1HD2      ASN 179  -7.801  -4.523  -4.579
   50    HA   PRO 180           HA       PRO 180  -6.612  -3.457   2.789
   51   1HB   PRO 180          2HB       PRO 180  -7.837  -6.193   2.108
   52   2HB   PRO 180          1HB       PRO 180  -7.586  -5.462   3.713
   53   1HG   PRO 180          1HG       PRO 180 -10.025  -5.269   2.552
   54   2HG   PRO 180          2HG       PRO 180  -9.330  -3.822   3.334
   55   1HD   PRO 180          1HD       PRO 180  -9.477  -4.446   0.353
   56   2HD   PRO 180          2HD       PRO 180  -9.647  -2.877   1.188
   57    H    THR 181           H        THR 181  -5.913  -5.141  -0.171
   58    HA   THR 181           HA       THR 181  -3.612  -6.698   0.967
   59    HB   THR 181           HB       THR 181  -4.558  -6.374  -1.925
   60    HG1  THR 181           1HG      THR 181  -2.443  -7.941  -0.888
   61   1HG2  THR 181          1HG2      THR 181  -5.957  -8.015  -0.608
   62   2HG2  THR 181          2HG2      THR 181  -4.999  -8.832  -1.873
   63   3HG2  THR 181          3HG2      THR 181  -4.481  -8.916  -0.168
   64    H    CYS 182           H        CYS 182  -3.677  -3.850  -1.314
   65    HA   CYS 182           HA       CYS 182  -0.783  -3.544  -1.249
   66   1HB   CYS 182          2HB       CYS 182  -1.168  -1.371  -2.397
   67   2HB   CYS 182          1HB       CYS 182  -2.068  -2.711  -3.103
   68    H    TRP 183           H        TRP 183  -2.818  -2.621   1.257
   69    HA   TRP 183           HA       TRP 183  -1.349  -0.205   2.081
   70   1HB   TRP 183          2HB       TRP 183  -3.894  -0.958   2.690
   71   2HB   TRP 183          1HB       TRP 183  -3.127  -1.644   4.104
   72    HD1  TRP 183           HD       TRP 183  -3.841   1.652   2.261
   73    HE1  TRP 183           1HE      TRP 183  -3.422   3.795   3.693
   74    HE3  TRP 183           3HE      TRP 183  -1.857  -0.749   6.291
   75    HZ2  TRP 183           2HZ      TRP 183  -2.491   4.207   6.347
   76    HZ3  TRP 183           3HZ      TRP 183  -1.202   0.597   8.259
   77    HH2  TRP 183           HH       TRP 183  -1.516   3.027   8.285
   78    H    ALA 184           H        ALA 184  -1.056  -3.495   3.324
   79    HA   ALA 184           HA       ALA 184   0.730  -2.833   5.542
   80   1HB   ALA 184          1HB       ALA 184   1.134  -5.305   5.665
   81   2HB   ALA 184          2HB       ALA 184   0.399  -5.503   4.053
   82   3HB   ALA 184          3HB       ALA 184  -0.590  -4.953   5.432
   83    H    ILE 185           H        ILE 185   1.634  -3.050   2.240
   84    HA   ILE 185           HA       ILE 185   4.399  -3.936   2.679
   85    HB   ILE 185           HB       ILE 185   3.208  -4.426   0.570
   86   1HG1  ILE 185          2HG1      ILE 185   5.228  -4.073  -1.067
   87   2HG1  ILE 185          1HG1      ILE 185   6.000  -3.199   0.242
   88   1HG2  ILE 185          1HG2      ILE 185   2.204  -2.206   0.054
   89   2HG2  ILE 185          2HG2      ILE 185   3.809  -1.582  -0.397
   90   3HG2  ILE 185          3HG2      ILE 185   3.061  -2.904  -1.338
   91   1HD1  ILE 185          1HD1      ILE 185   5.164  -6.182   0.239
   92   2HD1  ILE 185          2HD1      ILE 185   6.004  -5.369   1.586
   93   3HD1  ILE 185          3HD1      ILE 185   6.816  -5.548   0.007
   94    H    CYS 186           H        CYS 186   3.317  -0.671   1.885
   95    HA   CYS 186           HA       CYS 186   5.759   0.439   3.361
   96   1HB   CYS 186          1HB       CYS 186   6.159   2.144   1.649
   97   2HB   CYS 186          2HB       CYS 186   6.343   0.512   0.991
   98    H    LYS 187           H        LYS 187   5.039   1.705   4.878
   99    HA   LYS 187           HA       LYS 187   2.270   2.976   4.845
  100   1HB   LYS 187          1HB       LYS 187   3.191   1.527   6.818
  101   2HB   LYS 187          2HB       LYS 187   4.332   2.832   7.130
  102   1HG   LYS 187          1HG       LYS 187   2.332   4.382   7.535
  103   2HG   LYS 187          2HG       LYS 187   1.246   3.023   7.238
  104   1HD   LYS 187          2HD       LYS 187   2.261   1.785   9.216
  105   2HD   LYS 187          1HD       LYS 187   3.348   3.146   9.509
  106   1HE   LYS 187          2HE       LYS 187   1.354   4.648   9.953
  107   2HE   LYS 187          1HE       LYS 187   0.263   3.280   9.660
  108   1HZ   LYS 187          1HZ       LYS 187   1.341   2.103  11.507
  109   2HZ   LYS 187          2HZ       LYS 187   0.733   3.551  12.018
  110   3HZ   LYS 187          3HZ       LYS 187   2.358   3.376  11.779
  Start of MODEL   14
    1   1H    PRO 172          1H        PRO 172  10.037   3.849  -1.072
    2    HA   PRO 172           HA       PRO 172   8.637   4.063  -2.770
    3   1HB   PRO 172          2HB       PRO 172   8.659   1.012  -3.234
    4   2HB   PRO 172          1HB       PRO 172   8.492   2.319  -4.433
    5   1HG   PRO 172          2HG       PRO 172  10.932   1.208  -4.025
    6   2HG   PRO 172          1HG       PRO 172  10.814   2.985  -4.153
    7   1HD   PRO 172          2HD       PRO 172  11.112   1.293  -1.638
    8   2HD   PRO 172          1HD       PRO 172  11.837   2.883  -2.006
    9    H    CYS 173           H        CYS 173   6.524   4.372  -2.438
   10    HA   CYS 173           HA       CYS 173   4.835   2.442  -0.747
   11   1HB   CYS 173          1HB       CYS 173   5.523   4.352   0.658
   12   2HB   CYS 173          2HB       CYS 173   4.901   5.506  -0.536
   13    H    SER 174           H        SER 174   3.243   1.776  -1.991
   14    HA   SER 174           HA       SER 174   2.513   2.860  -4.601
   15   1HB   SER 174          1HB       SER 174   0.902   0.977  -4.655
   16   2HB   SER 174          2HB       SER 174   2.501   0.438  -4.132
   17    HG   SER 174           HG       SER 174   0.824  -0.377  -2.840
   18    H    ILE 175           H        ILE 175   0.714   3.846  -5.203
   19    HA   ILE 175           HA       ILE 175  -0.778   5.562  -3.309
   20    HB   ILE 175           HB       ILE 175   0.000   6.473  -5.387
   21   1HG1  ILE 175          1HG1      ILE 175  -3.034   6.997  -5.338
   22   2HG1  ILE 175          2HG1      ILE 175  -2.037   7.447  -3.989
   23   1HG2  ILE 175          1HG2      ILE 175  -1.132   6.264  -7.601
   24   2HG2  ILE 175          2HG2      ILE 175  -0.491   4.689  -7.064
   25   3HG2  ILE 175          3HG2      ILE 175  -2.238   5.027  -6.944
   26   1HD1  ILE 175          1HD1      ILE 175  -1.676   8.638  -6.776
   27   2HD1  ILE 175          2HD1      ILE 175  -2.417   9.411  -5.349
   28   3HD1  ILE 175          3HD1      ILE 175  -0.677   9.014  -5.346
   29    H    CYS 176           H        CYS 176  -1.708   4.100  -2.078
   30    HA   CYS 176           HA       CYS 176  -4.309   2.746  -2.984
   31   1HB   CYS 176          2HB       CYS 176  -2.130   1.544  -1.171
   32   2HB   CYS 176          1HB       CYS 176  -3.775   0.904  -1.301
   33    H    SER 177           H        SER 177  -5.783   3.769  -1.965
   34    HA   SER 177           HA       SER 177  -5.524   4.788   0.929
   35   1HB   SER 177          2HB       SER 177  -7.133   6.529   0.413
   36   2HB   SER 177          1HB       SER 177  -5.707   6.649  -0.636
   37    HG   SER 177           HG       SER 177  -8.196   5.435  -1.296
   38    H    ASN 178           H        ASN 178  -6.256   3.058   1.870
   39    HA   ASN 178           HA       ASN 178  -7.620   1.450   2.852
   40   1HB   ASN 178          1HB       ASN 178 -10.051   2.835   1.650
   41   2HB   ASN 178          2HB       ASN 178 -10.103   1.492   2.777
   42   1HD2  ASN 178          2HD2      ASN 178  -9.343   4.909   2.504
   43   2HD2  ASN 178          1HD2      ASN 178  -9.296   5.205   4.314
   44    H    ASN 179           H        ASN 179  -6.751  -0.261   1.881
   45    HA   ASN 179           HA       ASN 179  -8.278  -1.874  -0.022
   46   1HB   ASN 179          2HB       ASN 179  -7.045  -0.404  -1.676
   47   2HB   ASN 179          1HB       ASN 179  -5.518  -1.001  -1.043
   48   1HD2  ASN 179          2HD2      ASN 179  -5.597  -1.303  -3.505
   49   2HD2  ASN 179          1HD2      ASN 179  -6.059  -2.987  -4.069
   50    HA   PRO 180           HA       PRO 180  -6.070  -3.999   3.584
   51   1HB   PRO 180          1HB       PRO 180  -7.598  -6.366   2.387
   52   2HB   PRO 180          2HB       PRO 180  -7.237  -6.040   4.102
   53   1HG   PRO 180          2HG       PRO 180  -9.669  -5.343   3.119
   54   2HG   PRO 180          1HG       PRO 180  -8.801  -4.192   4.171
   55   1HD   PRO 180          2HD       PRO 180  -9.084  -4.095   1.138
   56   2HD   PRO 180          1HD       PRO 180  -9.053  -2.752   2.314
   57    H    THR 181           H        THR 181  -5.810  -5.325   0.319
   58    HA   THR 181           HA       THR 181  -3.357  -6.899   1.051
   59    HB   THR 181           HB       THR 181  -3.193  -7.784  -1.125
   60    HG1  THR 181           1HG      THR 181  -4.572  -8.611   0.453
   61   1HG2  THR 181          1HG2      THR 181  -5.721  -6.272  -2.011
   62   2HG2  THR 181          2HG2      THR 181  -4.084  -6.041  -2.680
   63   3HG2  THR 181          3HG2      THR 181  -4.921  -7.601  -2.892
   64    H    CYS 182           H        CYS 182  -3.798  -4.259  -1.345
   65    HA   CYS 182           HA       CYS 182  -0.983  -3.685  -1.641
   66   1HB   CYS 182          2HB       CYS 182  -2.719  -2.984  -3.279
   67   2HB   CYS 182          1HB       CYS 182  -3.455  -1.903  -2.088
   68    H    TRP 183           H        TRP 183  -2.968  -2.603   0.973
   69    HA   TRP 183           HA       TRP 183  -1.376  -0.154   1.529
   70   1HB   TRP 183          1HB       TRP 183  -3.995  -0.720   2.191
   71   2HB   TRP 183          2HB       TRP 183  -3.265  -1.219   3.691
   72    HD1  TRP 183           HD       TRP 183  -3.855   1.778   1.373
   73    HE1  TRP 183           1HE      TRP 183  -3.383   4.097   2.463
   74    HE3  TRP 183           3HE      TRP 183  -1.903  -0.043   5.710
   75    HZ2  TRP 183           2HZ      TRP 183  -2.384   4.881   5.013
   76    HZ3  TRP 183           3HZ      TRP 183  -1.175   1.565   7.440
   77    HH2  TRP 183           HH       TRP 183  -1.411   3.980   7.097
   78    H    ALA 184           H        ALA 184  -1.142  -3.359   2.862
   79    HA   ALA 184           HA       ALA 184   0.379  -2.680   5.262
   80   1HB   ALA 184          1HB       ALA 184   0.866  -5.151   5.327
   81   2HB   ALA 184          2HB       ALA 184   0.258  -5.310   3.661
   82   3HB   ALA 184          3HB       ALA 184  -0.846  -4.831   4.981
   83    H    ILE 185           H        ILE 185   1.641  -2.158   2.258
   84    HA   ILE 185           HA       ILE 185   4.472  -2.383   3.294
   85    HB   ILE 185           HB       ILE 185   4.152  -4.380   2.011
   86   1HG1  ILE 185          2HG1      ILE 185   6.352  -3.676   2.363
   87   2HG1  ILE 185          1HG1      ILE 185   6.238  -4.552   0.867
   88   1HG2  ILE 185          1HG2      ILE 185   2.588  -3.778   0.197
   89   2HG2  ILE 185          2HG2      ILE 185   4.012  -4.663  -0.408
   90   3HG2  ILE 185          3HG2      ILE 185   3.889  -2.898  -0.647
   91   1HD1  ILE 185          1HD1      ILE 185   6.581  -2.379  -0.423
   92   2HD1  ILE 185          2HD1      ILE 185   7.919  -2.741   0.700
   93   3HD1  ILE 185          3HD1      ILE 185   6.705  -1.505   1.128
   94    H    CYS 186           H        CYS 186   4.271  -0.296   3.702
   95    HA   CYS 186           HA       CYS 186   4.482   1.702   1.372
   96   1HB   CYS 186          1HB       CYS 186   2.226   1.881   2.427
   97   2HB   CYS 186          2HB       CYS 186   2.974   2.138   4.015
   98    H    LYS 187           H        LYS 187   6.462   2.466   1.478
   99    HA   LYS 187           HA       LYS 187   8.064   2.634   4.081
  100   1HB   LYS 187          2HB       LYS 187   8.945   1.388   1.951
  101   2HB   LYS 187          1HB       LYS 187   9.045   2.968   1.180
  102   1HG   LYS 187          1HG       LYS 187  10.694   3.681   3.000
  103   2HG   LYS 187          2HG       LYS 187  10.563   2.075   3.720
  104   1HD   LYS 187          1HD       LYS 187  11.476   1.045   1.578
  105   2HD   LYS 187          2HD       LYS 187  11.607   2.654   0.862
  106   1HE   LYS 187          2HE       LYS 187  13.270   3.322   2.658
  107   2HE   LYS 187          1HE       LYS 187  13.139   1.705   3.377
  108   1HZ   LYS 187          1HZ       LYS 187  13.930   0.769   1.264
  109   2HZ   LYS 187          2HZ       LYS 187  14.052   2.276   0.596
  110   3HZ   LYS 187          3HZ       LYS 187  15.022   1.854   1.865
  Start of MODEL   15
    1   1H    PRO 172          1H        PRO 172  10.206   4.431  -2.875
    2    HA   PRO 172           HA       PRO 172   8.468   5.143  -4.039
    3   1HB   PRO 172          2HB       PRO 172   7.990   2.305  -5.155
    4   2HB   PRO 172          1HB       PRO 172   7.701   3.876  -5.945
    5   1HG   PRO 172          2HG       PRO 172  10.005   2.542  -6.464
    6   2HG   PRO 172          1HG       PRO 172  10.085   4.300  -6.159
    7   1HD   PRO 172          2HD       PRO 172  10.773   2.024  -4.254
    8   2HD   PRO 172          1HD       PRO 172  11.584   3.605  -4.444
    9    H    CYS 173           H        CYS 173   6.564   5.496  -3.073
   10    HA   CYS 173           HA       CYS 173   5.432   3.531  -1.031
   11   1HB   CYS 173          2HB       CYS 173   6.022   5.832  -0.248
   12   2HB   CYS 173          1HB       CYS 173   4.878   6.521  -1.420
   13    H    SER 174           H        SER 174   3.829   2.365  -1.800
   14    HA   SER 174           HA       SER 174   2.405   2.763  -4.315
   15   1HB   SER 174          2HB       SER 174   1.896   0.776  -2.035
   16   2HB   SER 174          1HB       SER 174   1.105   0.712  -3.620
   17    HG   SER 174           HG       SER 174   3.903   0.660  -3.146
   18    H    ILE 175           H        ILE 175   0.674   3.912  -4.628
   19    HA   ILE 175           HA       ILE 175  -0.916   5.272  -2.553
   20    HB   ILE 175           HB       ILE 175  -2.313   6.196  -4.316
   21   1HG1  ILE 175          2HG1      ILE 175  -0.518   5.200  -6.611
   22   2HG1  ILE 175          1HG1      ILE 175  -1.884   4.253  -6.106
   23   1HG2  ILE 175          1HG2      ILE 175   0.652   6.783  -4.787
   24   2HG2  ILE 175          2HG2      ILE 175  -0.376   7.466  -3.500
   25   3HG2  ILE 175          3HG2      ILE 175  -0.708   7.859  -5.204
   26   1HD1  ILE 175          1HD1      ILE 175  -2.511   5.560  -8.063
   27   2HD1  ILE 175          2HD1      ILE 175  -2.144   7.091  -7.223
   28   3HD1  ILE 175          3HD1      ILE 175  -3.496   6.068  -6.664
   29    H    CYS 176           H        CYS 176  -1.502   3.480  -1.410
   30    HA   CYS 176           HA       CYS 176  -3.692   1.631  -2.388
   31   1HB   CYS 176          1HB       CYS 176  -1.641   0.883  -0.985
   32   2HB   CYS 176          2HB       CYS 176  -2.455   1.649   0.394
   33    H    SER 177           H        SER 177  -5.206   3.157  -2.654
   34    HA   SER 177           HA       SER 177  -6.298   4.917  -0.509
   35   1HB   SER 177          1HB       SER 177  -6.180   5.739  -2.791
   36   2HB   SER 177          2HB       SER 177  -7.331   4.500  -3.334
   37    HG   SER 177           HG       SER 177  -8.826   5.356  -1.826
   38    H    ASN 178           H        ASN 178  -8.076   2.329  -2.266
   39    HA   ASN 178           HA       ASN 178  -9.367   1.459   0.327
   40   1HB   ASN 178          1HB       ASN 178 -10.856   3.310  -0.575
   41   2HB   ASN 178          2HB       ASN 178 -11.169   2.341  -2.005
   42   1HD2  ASN 178          2HD2      ASN 178 -12.556   0.476  -1.723
   43   2HD2  ASN 178          1HD2      ASN 178 -13.549   0.258  -0.195
   44    H    ASN 179           H        ASN 179  -8.103  -0.340  -0.024
   45    HA   ASN 179           HA       ASN 179  -9.236  -2.546  -1.543
   46   1HB   ASN 179          1HB       ASN 179  -7.869  -1.476  -3.428
   47   2HB   ASN 179          2HB       ASN 179  -6.404  -1.793  -2.517
   48   1HD2  ASN 179          2HD2      ASN 179  -5.690  -4.008  -2.407
   49   2HD2  ASN 179          1HD2      ASN 179  -6.437  -5.309  -3.464
   50    HA   PRO 180           HA       PRO 180  -6.818  -3.410   2.412
   51   1HB   PRO 180          1HB       PRO 180  -8.320  -5.341   3.622
   52   2HB   PRO 180          2HB       PRO 180  -8.719  -3.607   3.609
   53   1HG   PRO 180          2HG       PRO 180  -9.822  -5.794   1.766
   54   2HG   PRO 180          1HG       PRO 180 -10.756  -4.580   2.688
   55   1HD   PRO 180          2HD       PRO 180 -10.108  -4.187   0.021
   56   2HD   PRO 180          1HD       PRO 180 -10.126  -2.819   1.165
   57    H    THR 181           H        THR 181  -5.358  -4.030   0.724
   58    HA   THR 181           HA       THR 181  -4.120  -6.656   1.237
   59    HB   THR 181           HB       THR 181  -5.009  -6.248  -1.674
   60    HG1  THR 181           1HG      THR 181  -3.776  -8.101  -2.033
   61   1HG2  THR 181          1HG2      THR 181  -5.491  -8.665   0.186
   62   2HG2  THR 181          2HG2      THR 181  -5.933  -8.567  -1.540
   63   3HG2  THR 181          3HG2      THR 181  -6.740  -7.510  -0.350
   64    H    CYS 182           H        CYS 182  -3.882  -3.958  -1.206
   65    HA   CYS 182           HA       CYS 182  -0.980  -3.954  -1.201
   66   1HB   CYS 182          1HB       CYS 182  -1.216  -1.808  -2.484
   67   2HB   CYS 182          2HB       CYS 182  -2.227  -3.117  -3.084
   68    H    TRP 183           H        TRP 183  -2.780  -2.765   1.330
   69    HA   TRP 183           HA       TRP 183  -1.193  -0.381   1.952
   70   1HB   TRP 183          1HB       TRP 183  -3.679  -1.096   2.817
   71   2HB   TRP 183          2HB       TRP 183  -2.796  -1.739   4.180
   72    HD1  TRP 183           HD       TRP 183  -3.666   1.496   2.296
   73    HE1  TRP 183           1HE      TRP 183  -3.063   3.687   3.580
   74    HE3  TRP 183           3HE      TRP 183  -1.281  -0.767   6.185
   75    HZ2  TRP 183           2HZ      TRP 183  -1.842   4.197   6.094
   76    HZ3  TRP 183           3HZ      TRP 183  -0.380   0.649   7.999
   77    HH2  TRP 183           HH       TRP 183  -0.655   3.084   7.953
   78    H    ALA 184           H        ALA 184  -0.666  -3.648   3.094
   79    HA   ALA 184           HA       ALA 184   1.068  -3.090   5.328
   80   1HB   ALA 184          1HB       ALA 184   1.182  -5.504   3.430
   81   2HB   ALA 184          2HB       ALA 184   1.856  -5.451   5.081
   82   3HB   ALA 184          3HB       ALA 184   0.100  -5.344   4.839
   83    H    ILE 185           H        ILE 185   2.025  -2.756   2.034
   84    HA   ILE 185           HA       ILE 185   4.928  -3.055   2.583
   85    HB   ILE 185           HB       ILE 185   4.007  -3.814   0.448
   86   1HG1  ILE 185          1HG1      ILE 185   6.306  -1.869  -0.206
   87   2HG1  ILE 185          2HG1      ILE 185   6.556  -3.202   0.883
   88   1HG2  ILE 185          1HG2      ILE 185   2.463  -1.963  -0.175
   89   2HG2  ILE 185          2HG2      ILE 185   3.848  -0.888  -0.500
   90   3HG2  ILE 185          3HG2      ILE 185   3.589  -2.339  -1.506
   91   1HD1  ILE 185          1HD1      ILE 185   6.023  -4.890  -0.854
   92   2HD1  ILE 185          2HD1      ILE 185   5.779  -3.584  -2.046
   93   3HD1  ILE 185          3HD1      ILE 185   7.385  -3.829  -1.306
   94    H    CYS 186           H        CYS 186   3.082  -0.173   1.707
   95    HA   CYS 186           HA       CYS 186   5.324   1.609   2.794
   96   1HB   CYS 186          2HB       CYS 186   4.530   2.121   0.496
   97   2HB   CYS 186          1HB       CYS 186   2.876   2.356   1.103
   98    H    LYS 187           H        LYS 187   5.033   1.926   4.868
   99    HA   LYS 187           HA       LYS 187   2.353   1.888   6.254
  100   1HB   LYS 187          2HB       LYS 187   3.422   1.796   8.349
  101   2HB   LYS 187          1HB       LYS 187   4.101   0.626   7.264
  102   1HG   LYS 187          2HG       LYS 187   5.948   1.245   8.474
  103   2HG   LYS 187          1HG       LYS 187   6.166   2.127   6.965
  104   1HD   LYS 187          1HD       LYS 187   5.266   4.231   8.111
  105   2HD   LYS 187          2HD       LYS 187   5.074   3.318   9.607
  106   1HE   LYS 187          1HE       LYS 187   7.579   2.904   9.677
  107   2HE   LYS 187          2HE       LYS 187   7.769   3.823   8.172
  108   1HZ   LYS 187          1HZ       LYS 187   6.820   5.765   9.309
  109   2HZ   LYS 187          2HZ       LYS 187   8.152   5.214  10.115
  110   3HZ   LYS 187          3HZ       LYS 187   6.643   4.909  10.711
  Start of MODEL   16
    1   1H    PRO 172          1H        PRO 172   8.997   4.533  -0.661
    2    HA   PRO 172           HA       PRO 172   7.621   6.566  -2.157
    3   1HB   PRO 172          1HB       PRO 172   8.627   4.121  -3.743
    4   2HB   PRO 172          2HB       PRO 172   8.056   5.694  -4.354
    5   1HG   PRO 172          2HG       PRO 172  10.720   5.275  -4.096
    6   2HG   PRO 172          1HG       PRO 172  10.045   6.831  -3.535
    7   1HD   PRO 172          2HD       PRO 172  10.830   4.402  -1.862
    8   2HD   PRO 172          1HD       PRO 172  11.072   6.133  -1.492
    9    H    CYS 173           H        CYS 173   5.526   6.058  -1.972
   10    HA   CYS 173           HA       CYS 173   4.557   3.200  -1.511
   11   1HB   CYS 173          2HB       CYS 173   3.716   5.588   0.236
   12   2HB   CYS 173          1HB       CYS 173   2.997   3.965   0.277
   13    H    SER 174           H        SER 174   2.868   2.826  -2.765
   14    HA   SER 174           HA       SER 174   1.838   4.685  -4.716
   15   1HB   SER 174          2HB       SER 174   0.869   1.875  -3.909
   16   2HB   SER 174          1HB       SER 174   0.327   2.742  -5.354
   17    HG   SER 174           HG       SER 174   2.508   2.882  -6.007
   18    H    ILE 175           H        ILE 175   0.003   5.700  -4.862
   19    HA   ILE 175           HA       ILE 175  -1.630   6.372  -2.502
   20    HB   ILE 175           HB       ILE 175  -0.957   8.089  -4.032
   21   1HG1  ILE 175          1HG1      ILE 175  -4.025   8.295  -3.863
   22   2HG1  ILE 175          2HG1      ILE 175  -3.059   8.258  -2.419
   23   1HG2  ILE 175          1HG2      ILE 175  -2.083   8.677  -6.179
   24   2HG2  ILE 175          2HG2      ILE 175  -1.302   7.078  -6.288
   25   3HG2  ILE 175          3HG2      ILE 175  -3.071   7.194  -6.093
   26   1HD1  ILE 175          1HD1      ILE 175  -1.855  10.342  -3.011
   27   2HD1  ILE 175          2HD1      ILE 175  -2.827  10.478  -4.501
   28   3HD1  ILE 175          3HD1      ILE 175  -3.622  10.561  -2.905
   29    H    CYS 176           H        CYS 176  -2.395   4.442  -1.994
   30    HA   CYS 176           HA       CYS 176  -4.293   2.814  -3.585
   31   1HB   CYS 176          2HB       CYS 176  -2.640   1.790  -2.037
   32   2HB   CYS 176          1HB       CYS 176  -3.412   2.591  -0.650
   33    H    SER 177           H        SER 177  -6.289   3.027  -3.545
   34    HA   SER 177           HA       SER 177  -7.994   4.285  -1.341
   35   1HB   SER 177          2HB       SER 177  -9.356   5.582  -2.941
   36   2HB   SER 177          1HB       SER 177  -7.673   6.136  -2.914
   37    HG   SER 177           HG       SER 177  -8.492   5.895  -5.019
   38    H    ASN 178           H        ASN 178  -9.194   2.644  -0.837
   39    HA   ASN 178           HA       ASN 178 -10.661   0.873  -0.743
   40   1HB   ASN 178          1HB       ASN 178 -12.119   2.391  -2.130
   41   2HB   ASN 178          2HB       ASN 178 -11.651   1.474  -3.545
   42   1HD2  ASN 178          2HD2      ASN 178 -13.466   1.328  -0.524
   43   2HD2  ASN 178          1HD2      ASN 178 -14.409  -0.180  -0.975
   44    H    ASN 179           H        ASN 179  -9.192  -0.701  -0.471
   45    HA   ASN 179           HA       ASN 179  -8.880  -2.840  -2.341
   46   1HB   ASN 179          1HB       ASN 179  -6.213  -1.363  -1.928
   47   2HB   ASN 179          2HB       ASN 179  -6.365  -3.021  -2.481
   48   1HD2  ASN 179          2HD2      ASN 179  -6.749   0.309  -3.460
   49   2HD2  ASN 179          1HD2      ASN 179  -7.027  -0.069  -5.235
   50    HA   PRO 180           HA       PRO 180  -8.960  -3.895   2.217
   51   1HB   PRO 180          2HB       PRO 180  -8.507  -6.709   1.125
   52   2HB   PRO 180          1HB       PRO 180  -9.507  -6.220   2.517
   53   1HG   PRO 180          1HG       PRO 180 -10.708  -6.624   0.112
   54   2HG   PRO 180          2HG       PRO 180 -11.162  -5.195   1.084
   55   1HD   PRO 180          2HD       PRO 180  -9.368  -5.273  -1.377
   56   2HD   PRO 180          1HD       PRO 180 -10.512  -4.010  -0.848
   57    H    THR 181           H        THR 181  -6.198  -5.273   0.408
   58    HA   THR 181           HA       THR 181  -4.384  -4.339   2.581
   59    HB   THR 181           HB       THR 181  -3.136  -6.218   3.099
   60    HG1  THR 181           1HG      THR 181  -4.717  -7.086   4.471
   61   1HG2  THR 181          1HG2      THR 181  -5.246  -8.079   1.819
   62   2HG2  THR 181          2HG2      THR 181  -3.926  -8.590   2.906
   63   3HG2  THR 181          3HG2      THR 181  -3.547  -7.926   1.294
   64    H    CYS 182           H        CYS 182  -4.090  -3.018   0.843
   65    HA   CYS 182           HA       CYS 182  -2.402  -3.850  -1.509
   66   1HB   CYS 182          2HB       CYS 182  -2.558  -1.485  -2.285
   67   2HB   CYS 182          1HB       CYS 182  -4.091  -2.359  -2.146
   68    H    TRP 183           H        TRP 183  -1.841  -1.398   0.962
   69    HA   TRP 183           HA       TRP 183   1.131  -1.483   0.505
   70   1HB   TRP 183          1HB       TRP 183   1.431   0.379   1.965
   71   2HB   TRP 183          2HB       TRP 183   0.375   0.704   0.611
   72    HD1  TRP 183           HD       TRP 183  -2.124   1.391   1.071
   73    HE1  TRP 183           1HE      TRP 183  -3.427   2.426   3.106
   74    HE3  TRP 183           3HE      TRP 183   1.242   0.041   4.648
   75    HZ2  TRP 183           2HZ      TRP 183  -2.880   2.584   5.875
   76    HZ3  TRP 183           3HZ      TRP 183   0.815   0.725   6.988
   77    HH2  TRP 183           HH       TRP 183  -1.213   1.964   7.588
   78    H    ALA 184           H        ALA 184   1.279  -3.626   1.146
   79    HA   ALA 184           HA       ALA 184   0.902  -4.522   3.899
   80   1HB   ALA 184          1HB       ALA 184   2.633  -5.838   1.740
   81   2HB   ALA 184          2HB       ALA 184   2.072  -6.609   3.247
   82   3HB   ALA 184          3HB       ALA 184   0.890  -6.111   2.007
   83    H    ILE 185           H        ILE 185   3.960  -3.415   2.452
   84    HA   ILE 185           HA       ILE 185   4.977  -2.699   5.138
   85    HB   ILE 185           HB       ILE 185   6.867  -4.587   3.621
   86   1HG1  ILE 185          1HG1      ILE 185   6.559  -6.221   5.800
   87   2HG1  ILE 185          2HG1      ILE 185   5.027  -5.385   5.964
   88   1HG2  ILE 185          1HG2      ILE 185   7.981  -2.882   5.052
   89   2HG2  ILE 185          2HG2      ILE 185   8.313  -4.515   5.648
   90   3HG2  ILE 185          3HG2      ILE 185   7.115  -3.485   6.485
   91   1HD1  ILE 185          1HD1      ILE 185   4.791  -7.558   4.799
   92   2HD1  ILE 185          2HD1      ILE 185   4.432  -6.288   3.602
   93   3HD1  ILE 185          3HD1      ILE 185   6.013  -7.100   3.587
   94    H    CYS 186           H        CYS 186   5.074  -0.697   4.373
   95    HA   CYS 186           HA       CYS 186   6.985   0.046   2.112
   96   1HB   CYS 186          1HB       CYS 186   4.659   0.062   1.142
   97   2HB   CYS 186          2HB       CYS 186   4.195   1.330   2.299
   98    H    LYS 187           H        LYS 187   8.384   1.361   3.013
   99    HA   LYS 187           HA       LYS 187   7.596   3.593   4.946
  100   1HB   LYS 187          1HB       LYS 187   9.822   1.524   5.494
  101   2HB   LYS 187          2HB       LYS 187   9.772   3.095   6.289
  102   1HG   LYS 187          2HG       LYS 187   7.558   2.574   7.320
  103   2HG   LYS 187          1HG       LYS 187   7.550   0.990   6.542
  104   1HD   LYS 187          1HD       LYS 187   9.656   0.349   7.812
  105   2HD   LYS 187          2HD       LYS 187   9.668   1.932   8.593
  106   1HE   LYS 187          1HE       LYS 187   7.432   1.421   9.674
  107   2HE   LYS 187          2HE       LYS 187   7.419  -0.169   8.890
  108   1HZ   LYS 187          1HZ       LYS 187   9.494  -0.698  10.063
  109   2HZ   LYS 187          2HZ       LYS 187   8.305  -0.296  11.137
  110   3HZ   LYS 187          3HZ       LYS 187   9.507   0.784  10.794